data_5hou_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 5hou _Structure_validation_residue.Date_analyzed 2016-10-08 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 1018 ' ' THR . . . . . . . . . . . . . 34.5 m . . . . . 0 N--CA 1.472 0.652 0 CA-C-O 119.029 -0.51 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -60.02 -27.37 66.84 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 177.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 67.0 m -74.53 -34.49 63.01 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 178.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.7 t70 -90.25 -27.43 19.49 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.426 1.09 . . . . 0.0 113.229 176.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -42.9 -54.38 4.22 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.731 2.412 . . . . 0.0 112.966 -178.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 42.1 p-90 -75.3 -4.84 41.5 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -175.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 87.1 mttt -107.91 -60.32 1.73 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -177.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 26.0 mt -120.14 12.14 11.79 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -169.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.5 tt . . . . . 0 CA--C 1.55 0.976 0 C-N-CA 125.191 1.396 . . . . 0.0 114.028 -176.514 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 86.5 mt . . . . . 0 CA--C 1.551 0.987 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.27 152.75 32.7 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -174.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 90.9 mt -125.19 179.96 4.84 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 129.209 3.004 . . . . 0.0 113.557 -177.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 88.0 p -100.11 152.58 37.87 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.85 1.66 . . . . 0.0 106.999 169.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_exo -56.48 -23.78 49.41 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.569 2.179 . . . . 0.0 114.889 -178.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.2 t70 -71.42 -29.15 64.56 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.945 0.898 . . . . 0.0 112.98 178.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 15.5 t70 -76.58 -15.0 59.96 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 93.8 mt -58.13 -35.38 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 O-C-N 121.435 -0.791 . . . . 0.0 109.947 175.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -69.14 -9.85 54.83 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.75 1.22 . . . . 0.0 113.391 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -83.73 -29.06 27.81 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.285 1.034 . . . . 0.0 111.715 177.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.3 p-90 . . . . . 0 N--CA 1.471 0.589 0 C-N-CA 123.847 0.859 . . . . 0.0 112.498 176.51 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 30.7 mmtp . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 119.714 -0.184 . . . . 0.0 110.524 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -64.99 -39.5 93.57 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.819 0.848 . . . . 0.0 111.34 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -59.0 -41.0 86.62 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.132 0.878 . . . . 0.0 111.11 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 94.3 mt -64.84 -38.44 90.97 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.683 0.793 . . . . 0.0 111.848 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -65.5 -53.83 35.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 CA-C-N 119.066 0.848 . . . . 0.0 109.454 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -52.29 -52.06 55.05 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.184 0.994 . . . . 0.0 111.563 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -35.53 80.46 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -179.11 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 14.0 tp60 -74.21 -44.05 54.75 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.044 0.838 . . . . 0.0 110.88 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.8 tt -59.63 -46.25 89.56 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.863 1.265 . . . . 0.0 110.435 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 92.4 t -58.24 -32.13 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.008 0.822 . . . . 0.0 111.221 175.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.58 -26.15 61.6 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.827 -1.17 . . . . 0.0 113.854 175.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.8 mp -63.6 -32.59 74.11 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 120.104 1.32 . . . . 0.0 108.911 173.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 4.1 mt -69.14 -50.42 48.09 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.708 1.203 . . . . 0.0 109.564 175.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 17.9 t60 -55.79 -53.55 55.28 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 122.603 0.361 . . . . 0.0 110.365 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -58.31 -27.29 63.96 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -86.28 -28.36 23.81 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.996 0.816 . . . . 0.0 112.885 176.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 40.9 mttm -86.06 -36.21 19.81 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.017 1.327 . . . . 0.0 112.223 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 49.5 t -60.85 -48.4 82.0 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 127.067 2.147 . . . . 0.0 111.051 177.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.5 pt20 . . . . . 0 CA--C 1.547 0.85 0 O-C-N 121.322 -0.861 . . . . 0.0 112.335 175.736 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 95.2 m-70 . . . . . 0 N--CA 1.472 0.659 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.7 t -67.61 -50.44 58.16 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.3 1.44 . . . . 0.0 109.258 175.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -55.49 -40.83 72.21 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.123 1.369 . . . . 0.0 111.585 174.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.3 m -64.74 -56.53 13.08 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.526 1.13 . . . . 0.0 111.044 177.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.7 mmt -64.25 -36.81 85.31 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.79 -32.08 73.41 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.909 1.686 . . . . 0.0 112.667 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -71.48 -41.4 69.37 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.165 0.586 . . . . 0.0 110.398 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 76.1 t -62.56 -48.06 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.467 0.707 . . . . 0.0 110.839 177.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.71 -44.63 90.44 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.918 0.887 . . . . 0.0 111.635 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -67.74 -17.43 64.55 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 177.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 58.2 t60 -88.75 -49.75 6.65 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.857 0.863 . . . . 0.0 109.512 173.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.2 ttp -56.77 -28.15 60.76 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.273 1.829 . . . . 0.0 113.591 -177.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.9 p -67.77 -27.7 66.99 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.569 1.148 . . . . 0.0 112.783 175.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -105.26 -17.55 14.42 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.775 1.63 . . . . 0.0 113.853 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 30.4 t -62.1 146.97 48.92 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.24 1.416 . . . . 0.0 112.218 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -116.79 -13.72 10.75 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.53 1.532 . . . . 0.0 113.881 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -94.81 -27.24 15.87 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.096 0.959 . . . . 0.0 112.373 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.34 -112.89 2.58 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.619 1.105 . . . . 0.0 113.007 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -61.78 -18.18 58.9 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 121.392 -1.064 . . . . 0.0 113.309 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.26 -0.25 44.35 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.45 1.5 . . . . 0.0 113.644 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 15.4 t -59.69 144.01 49.15 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 122.473 1.13 . . . . 0.0 110.779 179.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 56.4 mm-40 -78.52 -8.39 58.51 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.5 1.12 . . . . 0.0 113.053 -176.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 90.8 t -91.05 115.04 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 173.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.34 -36.88 66.76 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -177.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -67.49 -32.63 73.59 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.374 1.07 . . . . 0.0 112.809 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 47.9 t -74.73 -55.42 5.87 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.357 1.463 . . . . 0.0 109.72 177.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -54.91 -45.81 74.8 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.261 1.025 . . . . 0.0 112.624 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 23.8 p -63.9 -46.33 85.36 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 177.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 62.8 m -63.17 -33.22 75.01 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 118.859 0.754 . . . . 0.0 112.039 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -63.7 -30.8 71.86 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 118.168 -0.92 . . . . 0.0 112.674 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -63.98 -37.98 89.4 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.213 1.37 . . . . 0.0 110.692 173.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.9 mt -66.99 -42.49 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.205 1.002 . . . . 0.0 110.365 178.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 19.4 mm -66.09 -36.74 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 123.599 0.76 . . . . 0.0 110.911 176.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 54.1 m -66.11 -24.08 66.62 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.422 1.089 . . . . 0.0 113.251 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -62.35 -59.03 5.58 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.243 0.928 . . . . 0.0 110.852 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 56.5 m95 -60.61 -26.22 66.84 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 48.1 mttp -72.95 -33.75 66.1 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.869 0.868 . . . . 0.0 113.144 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.7 p30 -100.05 -29.56 12.45 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 6.3 t -79.05 133.92 36.78 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.439 1.096 . . . . 0.0 112.315 -178.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 74.2 p -130.12 2.14 4.74 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.658 1.583 . . . . 0.0 114.311 -178.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -78.31 155.78 29.98 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.203 1.401 . . . . 0.0 113.612 -178.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -88.56 -33.11 17.83 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.875 0.87 . . . . 0.0 110.646 171.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 19.8 t0 -103.03 80.24 1.84 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.851 2.06 . . . . 0.0 111.478 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 42.8 t -132.19 134.97 25.69 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 126.995 2.118 . . . . 0.0 107.958 177.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -59.96 -22.9 70.86 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 122.252 1.968 . . . . 0.0 113.52 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 5.0 t -92.14 -51.49 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 119.409 1.004 . . . . 0.0 111.634 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 19.6 m -65.68 -44.06 87.36 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -177.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.52 -56.4 27.27 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.149 -175.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -63.34 -30.65 73.25 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 121.789 1.675 . . . . 0.0 113.068 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 97.8 mt -69.84 -44.16 70.45 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.47 1.032 . . . . 0.0 111.288 176.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -64.74 -35.06 79.86 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.192 0.997 . . . . 0.0 111.184 175.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 57.4 t30 -68.12 -40.3 82.56 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.458 1.103 . . . . 0.0 111.065 175.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.748 0 C-N-CA 124.378 1.071 . . . . 0.0 112.763 177.619 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 95.9 m . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 119.733 -0.175 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -60.19 -28.48 68.0 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.61 0.764 . . . . 0.0 112.924 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 42.5 m -70.19 -34.2 72.66 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.853 0.861 . . . . 0.0 112.631 178.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -90.1 -26.61 20.14 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.593 1.157 . . . . 0.0 113.365 175.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.2 tt -45.41 -60.04 2.37 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 126.913 2.085 . . . . 0.0 113.498 -176.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 40.0 p-90 -66.72 -10.52 47.71 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -173.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 9.1 ptmm? -112.12 -57.72 2.23 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 47.2 mt -116.05 13.96 15.95 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 -171.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.9 tt . . . . . 0 CA--C 1.551 1.014 0 C-N-CA 125.701 1.6 . . . . 0.0 113.703 179.366 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 24.0 tp . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 62.1 mmm -67.3 159.5 29.11 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.732 1.753 . . . . 0.0 115.732 -177.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 96.3 mt -125.06 170.51 11.1 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 127.666 2.386 . . . . 0.0 112.766 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 30.7 t -86.36 146.65 42.67 Favored Pre-proline 0 CA--C 1.543 0.696 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 169.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.8 Cg_exo -54.14 -21.45 22.14 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.89 2.394 . . . . 0.0 115.087 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 32.7 t70 -73.27 -22.07 60.46 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.342 1.057 . . . . 0.0 113.006 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -78.92 -17.44 55.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.062 0.945 . . . . 0.0 112.994 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.65 -34.26 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 125.134 1.374 . . . . 0.0 110.667 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -68.41 -10.03 52.43 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.702 1.201 . . . . 0.0 113.814 178.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 52.6 tp60 -82.35 -39.11 23.24 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.093 -1.004 . . . . 0.0 111.373 177.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.255 3.9 p-90 . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 179.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 56.1 mtpt . . . . . 0 N--CA 1.474 0.75 0 CA-C-O 119.377 -0.344 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 6.9 mmp_? -58.47 -42.98 88.7 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.957 0.903 . . . . 0.0 111.544 176.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -64.43 -28.65 69.82 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 177.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 98.7 mt -69.92 -37.86 76.06 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.534 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -63.13 -52.75 55.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 174.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -52.51 -55.71 20.22 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.949 0.9 . . . . 0.0 111.412 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -34.26 77.41 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -178.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -69.47 -44.87 70.29 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.485 1.039 . . . . 0.0 110.365 177.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 5.1 tt -60.07 -43.8 95.21 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.603 1.161 . . . . 0.0 110.017 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 85.4 t -58.94 -31.43 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.1 0.864 . . . . 0.0 111.525 175.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 4.4 tp -72.26 -29.61 64.07 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.137 1.335 . . . . 0.0 112.816 175.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -60.97 -33.83 73.82 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 120.394 1.452 . . . . 0.0 109.14 174.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 7.0 mt -66.7 -51.84 51.47 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.307 1.043 . . . . 0.0 109.998 175.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 31.4 t60 -57.3 -57.35 13.0 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 119.19 -0.433 . . . . 0.0 110.291 177.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -51.79 -41.21 61.51 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.419 1.088 . . . . 0.0 113.548 -178.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -75.32 -35.99 61.13 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 36.9 mttm -73.31 -46.84 47.2 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.954 0.902 . . . . 0.0 110.844 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 35.3 t -55.79 -45.51 78.19 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 127.123 2.169 . . . . 0.0 111.151 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 7.7 tt0 . . . . . 0 CA--C 1.54 0.569 0 C-N-CA 125.782 1.633 . . . . 0.0 112.659 175.7 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 37.7 m80 . . . . . 0 CA--C 1.539 0.533 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.5 t -66.42 -51.84 52.7 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.806 1.243 . . . . 0.0 109.019 175.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -55.87 -38.86 70.69 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.806 1.242 . . . . 0.0 111.367 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 33.1 m -66.16 -57.14 8.29 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.959 0.904 . . . . 0.0 111.538 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.2 mmt -64.35 -36.33 83.79 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -177.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -64.71 -28.9 69.91 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 120.738 1.608 . . . . 0.0 112.773 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -74.06 -39.74 63.27 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.129 0.572 . . . . 0.0 110.449 173.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 92.8 t -63.01 -44.84 99.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 121.753 -0.592 . . . . 0.0 110.744 176.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.54 -44.8 95.71 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.957 0.903 . . . . 0.0 110.576 177.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -63.52 -31.4 72.55 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.127 0.876 . . . . 0.0 113.202 175.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 74.5 t60 -74.73 -50.64 16.74 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.324 -0.86 . . . . 0.0 109.303 175.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.7 ttp -58.65 -30.95 67.71 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.32 1.848 . . . . 0.0 114.127 -177.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 25.0 p -70.22 -27.85 64.81 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 119.958 1.254 . . . . 0.0 112.307 174.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 78.6 t60 -96.83 -24.02 16.1 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.032 1.733 . . . . 0.0 113.556 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 20.0 t -60.06 148.68 34.87 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.373 1.469 . . . . 0.0 113.182 -177.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -113.87 -14.59 12.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.303 1.841 . . . . 0.0 113.503 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -103.9 -31.98 9.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.453 1.101 . . . . 0.0 112.536 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.55 -107.78 0.58 Allowed Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.559 1.076 . . . . 0.0 113.601 177.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 64.6 tttp -59.29 -25.51 64.17 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.034 -1.274 . . . . 0.0 112.48 177.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -94.97 -0.23 54.05 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.453 1.501 . . . . 0.0 113.833 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.1 t -61.71 143.64 55.87 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 122.407 1.099 . . . . 0.0 110.581 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.8 mm-40 -80.15 -6.14 57.24 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.513 1.125 . . . . 0.0 113.373 -176.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 16.8 t -92.82 124.53 45.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.748 1.219 . . . . 0.0 108.653 175.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.59 -46.25 70.3 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -176.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.56 -31.88 71.4 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 -178.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 51.2 t -67.65 -57.48 6.32 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.914 0.886 . . . . 0.0 109.859 178.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -61.76 -15.53 41.93 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.7 m -89.05 -55.61 3.61 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.341 1.057 . . . . 0.0 112.121 176.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.2 m -61.34 -31.98 71.86 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.478 1.036 . . . . 0.0 111.989 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -61.43 -32.75 72.72 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.548 -0.72 . . . . 0.0 111.987 175.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -66.26 -32.28 73.6 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.503 1.047 . . . . 0.0 111.481 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 12.3 mt -71.18 -46.83 64.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.252 1.021 . . . . 0.0 109.675 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 23.2 mm -60.87 -44.06 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 123.942 0.897 . . . . 0.0 110.687 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 44.9 m -57.56 -22.44 44.69 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 178.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.0 t60 -63.31 -53.06 58.71 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.636 1.107 . . . . 0.0 110.277 176.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 64.6 m95 -65.05 -27.91 69.12 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -68.72 -33.02 73.22 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.579 0.752 . . . . 0.0 112.31 175.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -100.04 -35.64 9.63 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 -177.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.2 t -80.53 137.18 36.4 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.352 1.461 . . . . 0.0 112.555 -176.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 22.1 m -129.99 -19.77 3.19 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.476 1.511 . . . . 0.0 113.274 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -68.39 140.78 55.84 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.514 1.525 . . . . 0.0 112.048 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -77.81 -38.11 47.16 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.222 0.609 . . . . 0.0 112.387 177.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 24.0 t70 -86.98 69.95 10.28 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.055 1.742 . . . . 0.0 111.745 179.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.8 t -124.17 135.22 26.14 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 126.543 1.937 . . . . 0.0 109.763 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -58.89 -25.47 77.11 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.964 2.443 . . . . 0.0 114.405 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.5 t -92.21 -51.16 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 119.748 1.158 . . . . 0.0 111.726 176.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.8 m -69.6 -39.64 77.14 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -175.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.5 tt -56.44 -55.65 40.31 Favored Pre-proline 0 CA--C 1.547 0.852 0 O-C-N 120.893 -1.129 . . . . 0.0 112.76 -178.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -61.44 -28.79 84.24 Favored 'Trans proline' 0 C--N 1.353 0.765 0 CA-C-N 121.609 1.61 . . . . 0.0 113.264 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 91.2 mt -70.15 -45.53 66.59 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.807 1.185 . . . . 0.0 111.401 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -63.84 -33.27 75.32 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.191 0.597 . . . . 0.0 111.229 176.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 59.1 t30 -72.81 -40.63 65.67 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.79 1.236 . . . . 0.0 111.833 176.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.629 0 C-N-CA 125.044 1.338 . . . . 0.0 113.892 179.429 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 20.9 m . . . . . 0 N--CA 1.473 0.675 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -60.26 -31.37 70.15 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.772 0.829 . . . . 0.0 112.738 174.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 54.0 m -69.45 -32.8 71.96 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.1 t70 -90.08 -29.52 18.29 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.74 1.216 . . . . 0.0 113.058 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -45.2 -58.14 3.46 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.843 2.057 . . . . 0.0 113.508 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -69.99 -9.76 56.29 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -112.06 -51.78 2.83 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 116.835 2.161 . . . . 0.0 116.835 -176.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 55.4 mt -117.04 20.19 13.92 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -170.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 7.5 tp . . . . . 0 CA--C 1.55 0.945 0 C-N-CA 125.911 1.685 . . . . 0.0 115.012 -174.409 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 83.7 mt . . . . . 0 CA--C 1.547 0.855 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 5.6 tpt -62.98 135.41 57.28 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -173.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.5 tt -124.99 144.88 50.15 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.391 2.276 . . . . 0.0 111.379 -177.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 52.2 m -73.24 151.53 90.08 Favored Pre-proline 0 N--CA 1.475 0.811 0 C-N-CA 124.946 1.299 . . . . 0.0 113.141 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -60.78 -23.92 77.65 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.574 2.849 . . . . 0.0 115.252 -177.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -78.71 -23.76 45.33 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.47 -0.769 . . . . 0.0 112.315 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -83.48 -9.86 58.71 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.61 1.564 . . . . 0.0 112.526 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 89.2 mt -57.87 -32.16 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 119.131 0.878 . . . . 0.0 109.46 173.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -69.74 -9.92 56.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.372 1.069 . . . . 0.0 113.476 177.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -77.89 -28.78 49.98 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.109 0.964 . . . . 0.0 111.7 177.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.4 p-90 . . . . . 0 N--CA 1.469 0.504 0 C-N-CA 124.068 0.947 . . . . 0.0 112.853 177.612 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 59.0 mtpt . . . . . 0 N--CA 1.472 0.669 0 N-CA-C 110.476 -0.194 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 27.3 ttp-105 -57.04 -51.29 69.84 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.535 1.134 . . . . 0.0 112.509 178.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -67.41 -29.69 69.26 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.112 0.869 . . . . 0.0 112.766 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 60.4 mt -66.37 -42.13 88.46 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.941 0.791 . . . . 0.0 111.192 174.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.4 mt -64.22 -51.23 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.527 1.058 . . . . 0.0 109.569 175.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -53.88 -52.13 61.45 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.533 0.733 . . . . 0.0 111.558 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -37.05 85.68 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.176 0.898 . . . . 0.0 113.099 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 16.1 tp60 -69.82 -44.08 70.69 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.794 0.724 . . . . 0.0 111.045 178.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.0 tt -63.45 -41.91 98.64 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.471 0.709 . . . . 0.0 110.231 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 94.5 t -59.8 -32.21 49.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 119.398 0.999 . . . . 0.0 111.15 174.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 1.6 tp -71.2 -26.31 62.9 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.913 -1.117 . . . . 0.0 112.995 175.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.33 -29.13 70.22 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 120.597 1.544 . . . . 0.0 109.612 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.3 mt -73.37 -53.63 10.28 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.734 1.213 . . . . 0.0 108.906 175.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 15.4 t60 -54.98 -56.06 23.95 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 122.887 0.475 . . . . 0.0 110.792 177.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -55.99 -23.49 32.9 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -90.07 -33.6 16.24 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.144 -0.972 . . . . 0.0 113.112 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 42.4 mttm -82.34 -31.13 30.02 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.441 1.497 . . . . 0.0 112.693 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.1 t -68.98 -51.91 34.52 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.227 2.211 . . . . 0.0 111.488 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.4 pt20 . . . . . 0 N--CA 1.476 0.857 0 O-C-N 121.062 -1.024 . . . . 0.0 113.405 178.377 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 75.7 m80 . . . . . 0 N--CA 1.472 0.641 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.9 t -68.03 -50.23 56.65 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 174.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -56.06 -37.2 68.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.577 1.551 . . . . 0.0 111.563 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 24.1 m -68.26 -58.18 4.82 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.511 1.124 . . . . 0.0 111.296 176.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -39.14 91.09 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.564 -0.732 . . . . 0.0 112.729 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -63.27 -33.77 76.22 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.483 1.492 . . . . 0.0 112.956 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -70.83 -41.06 72.01 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.118 0.567 . . . . 0.0 110.582 174.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 70.1 t -63.84 -47.28 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.381 0.672 . . . . 0.0 110.989 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.58 -43.99 89.65 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.998 0.919 . . . . 0.0 111.237 179.034 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -68.39 -17.07 64.14 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 176.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 56.6 t60 -89.99 -48.33 7.28 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.916 0.886 . . . . 0.0 109.963 174.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.7 ttp -56.41 -27.77 57.46 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.377 1.871 . . . . 0.0 113.392 -178.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 12.4 p -69.53 -24.27 63.71 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.976 1.31 . . . . 0.0 113.037 175.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 66.0 m80 -108.96 -17.77 13.84 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.261 1.824 . . . . 0.0 114.093 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.9 t -61.19 149.05 38.74 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.542 1.537 . . . . 0.0 112.72 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -118.38 -15.15 9.72 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.891 1.676 . . . . 0.0 113.747 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -98.8 -28.89 13.28 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.325 1.05 . . . . 0.0 112.802 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.13 -111.24 1.89 Allowed Glycine 0 CA--C 1.536 1.376 0 C-N-CA 124.336 0.969 . . . . 0.0 113.112 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.7 mttt -61.28 -20.82 63.32 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 121.22 -1.164 . . . . 0.0 113.226 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.95 -0.6 50.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.637 1.575 . . . . 0.0 113.537 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.5 t -63.95 141.53 58.73 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.114 0.959 . . . . 0.0 109.935 177.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -80.33 -5.14 55.86 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.208 1.003 . . . . 0.0 113.675 -175.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 84.1 t -89.21 112.98 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 172.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.55 -38.76 64.14 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -69.31 -30.98 69.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.481 1.113 . . . . 0.0 113.423 -178.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 41.5 t -73.1 -54.82 7.54 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.135 1.374 . . . . 0.0 108.997 176.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.83 -25.59 65.11 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 90.1 p -82.24 -48.88 10.73 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.386 0.993 . . . . 0.0 112.151 175.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 69.8 m -61.59 -33.59 74.14 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.372 -0.83 . . . . 0.0 112.259 178.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 43.9 tpt85 -61.63 -29.99 70.41 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.486 -0.759 . . . . 0.0 112.934 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -71.0 -32.61 69.47 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.019 0.927 . . . . 0.0 111.212 176.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 27.9 mt -70.78 -44.76 75.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 124.156 0.982 . . . . 0.0 109.227 176.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 22.7 mm -61.79 -36.71 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.984 0.914 . . . . 0.0 110.947 174.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 61.0 m -63.02 -23.56 67.51 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.676 0.79 . . . . 0.0 113.121 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 6.8 t60 -63.63 -58.35 7.2 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.331 0.969 . . . . 0.0 110.694 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 56.2 m95 -61.69 -23.19 65.94 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 177.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 94.4 mttt -76.49 -35.57 58.31 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.937 0.895 . . . . 0.0 112.768 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -100.03 -30.31 12.04 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 179.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.6 t -76.14 136.52 39.81 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.099 1.359 . . . . 0.0 111.469 -179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.8 p -127.72 -6.98 5.64 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -176.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 -81.76 147.22 29.55 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.353 1.061 . . . . 0.0 113.335 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.7 p-80 -81.67 -27.8 33.86 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.738 0.815 . . . . 0.0 110.534 171.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 16.1 p-10 -98.69 69.93 1.88 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.487 2.315 . . . . 0.0 111.94 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 54.0 t -127.14 134.71 26.43 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 126.533 1.933 . . . . 0.0 109.248 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -57.0 -26.97 71.3 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 123.099 2.533 . . . . 0.0 114.551 -178.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 8.1 t -92.14 -52.96 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-N 119.441 1.019 . . . . 0.0 111.59 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.4 m -67.22 -39.11 86.22 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -174.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.1 tt -54.24 -57.79 16.71 Favored Pre-proline 0 CA--C 1.547 0.844 0 CA-C-O 117.804 -1.093 . . . . 0.0 113.209 -177.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.53 -31.25 92.14 Favored 'Trans proline' 0 C--N 1.352 0.736 0 CA-C-N 121.644 1.623 . . . . 0.0 113.041 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.13 -49.87 46.33 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.01 0.924 . . . . 0.0 112.44 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -65.52 -28.92 69.52 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.108 0.867 . . . . 0.0 111.862 176.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 9.4 t30 -71.87 -43.1 66.02 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.71 1.204 . . . . 0.0 111.949 175.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.59 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -179.008 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 90.8 m . . . . . 0 N--CA 1.469 0.488 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.19 -30.88 69.64 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 175.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 22.9 t -70.13 -33.65 72.09 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.5 t70 -90.15 -26.13 20.33 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.849 -1.157 . . . . 0.0 113.437 174.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -42.63 -58.02 2.47 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.891 2.076 . . . . 0.0 113.106 -179.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 45.3 p-90 -70.52 -11.91 61.23 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -172.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 50.4 pttt -112.03 -60.27 1.88 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -177.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 58.2 mt -120.21 18.59 12.28 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 116.65 2.092 . . . . 0.0 116.65 -172.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 5.4 tt . . . . . 0 CA--C 1.552 1.031 0 C-N-CA 125.266 1.426 . . . . 0.0 113.595 -178.754 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 22.7 tp . . . . . 0 CA--C 1.553 1.083 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 7.7 tpt -71.95 154.65 41.06 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -176.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 25.7 mt -124.26 169.81 11.39 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.503 2.321 . . . . 0.0 112.546 -176.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.2 m -76.92 151.44 82.06 Favored Pre-proline 0 CA--C 1.544 0.729 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 169.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -60.07 -14.59 29.13 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 123.086 2.524 . . . . 0.0 115.264 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.0 t70 -78.96 -19.17 52.36 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 120.916 -1.115 . . . . 0.0 112.978 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -81.65 -13.31 58.08 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.356 1.062 . . . . 0.0 113.081 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 91.3 mt -54.84 -36.93 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.471 1.509 . . . . 0.0 111.495 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -76.1 -9.91 59.0 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -84.53 -25.09 29.01 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.138 0.975 . . . . 0.0 113.526 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.678 0 CA-C-N 119.556 1.071 . . . . 0.0 112.301 -178.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 31.0 mmtp . . . . . 0 N--CA 1.474 0.747 0 CA-C-O 119.179 -0.438 . . . . 0.0 110.697 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -42.37 93.79 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.783 0.833 . . . . 0.0 111.136 174.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -58.84 -40.36 83.99 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.037 0.835 . . . . 0.0 111.289 174.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.8 -36.68 83.94 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 118.395 -0.812 . . . . 0.0 111.676 177.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -67.36 -55.14 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 119.216 0.916 . . . . 0.0 109.479 174.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -49.68 -52.33 31.85 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.687 1.195 . . . . 0.0 111.51 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 4.0 pp0? -65.22 -36.77 85.18 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 112.924 0.712 . . . . 0.0 112.924 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -69.69 -46.0 67.03 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.061 0.846 . . . . 0.0 110.139 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.11 -41.44 96.7 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.756 1.222 . . . . 0.0 111.156 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 83.8 t -60.15 -32.45 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-N 119.44 1.018 . . . . 0.0 110.937 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.37 -29.14 62.44 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.17 -0.956 . . . . 0.0 113.18 176.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -62.15 -37.45 85.26 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.445 1.02 . . . . 0.0 108.692 171.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.2 mt -65.59 -49.17 69.78 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.659 0.784 . . . . 0.0 110.077 177.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 28.5 t60 -56.58 -54.58 44.25 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 118.702 -0.666 . . . . 0.0 110.228 177.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.36 -46.27 66.09 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 118.603 0.638 . . . . 0.0 112.035 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -64.51 -45.2 88.26 Favored 'General case' 0 C--N 1.345 0.373 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 58.4 mttm -69.4 -25.34 64.09 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.688 1.195 . . . . 0.0 113.054 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.8 t -80.68 -52.26 7.75 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 127.11 2.164 . . . . 0.0 110.654 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.9 pt20 . . . . . 0 N--CA 1.474 0.761 0 O-C-N 120.202 -1.561 . . . . 0.0 112.791 179.416 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 99.2 m-70 . . . . . 0 N--CA 1.472 0.648 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.5 t -68.38 -50.42 53.12 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.906 1.282 . . . . 0.0 109.035 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -55.29 -39.07 69.43 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.028 1.331 . . . . 0.0 111.582 174.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 21.5 m -67.39 -57.43 6.59 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.459 1.104 . . . . 0.0 111.063 176.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.9 mmt -62.03 -37.07 83.54 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -177.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -65.23 -37.14 86.34 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.319 1.418 . . . . 0.0 113.053 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -65.14 -39.06 92.48 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 122.653 0.381 . . . . 0.0 110.539 175.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 96.9 t -65.12 -48.08 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 123.058 0.543 . . . . 0.0 110.459 175.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -39.35 92.23 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.161 0.984 . . . . 0.0 112.449 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 43.9 m-20 -61.31 -39.05 89.06 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.461 0.704 . . . . 0.0 111.501 175.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.2 t60 -78.75 -50.08 11.96 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.197 0.999 . . . . 0.0 111.733 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -56.84 -32.88 66.21 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.832 1.653 . . . . 0.0 114.116 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 6.6 t -72.71 -15.07 61.69 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 119.91 1.232 . . . . 0.0 112.818 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 81.7 t60 -105.27 -28.99 10.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.897 1.679 . . . . 0.0 112.639 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 30.4 t -58.5 144.77 41.32 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.105 1.762 . . . . 0.0 112.836 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -117.9 -12.25 10.18 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.602 1.561 . . . . 0.0 113.726 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -91.21 -27.16 18.65 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.209 1.004 . . . . 0.0 112.175 178.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.48 -112.33 2.32 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.764 1.173 . . . . 0.0 112.75 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.3 mttt -61.49 -19.57 62.21 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 121.588 -0.948 . . . . 0.0 113.417 178.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.85 -2.44 47.43 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.179 1.391 . . . . 0.0 113.625 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 18.1 t -59.93 144.46 48.93 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 122.323 1.058 . . . . 0.0 110.737 178.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -79.03 -8.3 58.83 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.463 1.105 . . . . 0.0 113.17 -176.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 97.6 t -89.99 115.01 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 173.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.66 -38.84 70.14 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -176.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -67.39 -37.99 83.99 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.796 0.838 . . . . 0.0 112.461 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 43.0 t -66.08 -56.63 10.55 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.687 1.595 . . . . 0.0 109.536 176.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -56.84 -31.44 64.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.389 1.076 . . . . 0.0 112.968 177.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.5 m -77.01 -49.89 14.36 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.027 0.931 . . . . 0.0 112.351 177.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 70.8 m -60.08 -36.0 76.42 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 121.529 -0.732 . . . . 0.0 111.6 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -58.87 -33.03 70.01 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.132 0.973 . . . . 0.0 112.782 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -67.09 -32.75 74.12 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 118.876 0.762 . . . . 0.0 111.671 177.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 1.7 mt -76.39 -45.42 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 123.289 0.636 . . . . 0.0 109.816 177.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 35.7 mm -60.57 -37.66 75.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.268 1.027 . . . . 0.0 110.735 176.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 22.7 t -58.14 -29.9 65.91 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.328 1.051 . . . . 0.0 112.252 176.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.3 t60 -63.94 -52.84 57.89 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.161 0.891 . . . . 0.0 109.995 176.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 39.1 m95 -61.74 -30.28 70.67 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 10.7 mtpm? -70.88 -28.61 64.69 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.458 0.703 . . . . 0.0 112.758 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -100.11 -38.12 8.67 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.951 1.464 . . . . 0.0 114.951 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.6 t -78.23 134.64 37.55 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.474 1.51 . . . . 0.0 112.929 -176.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 79.9 p -130.09 -1.67 4.6 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.646 1.578 . . . . 0.0 114.242 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 22.9 ttt-85 -83.07 145.68 29.13 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.193 1.397 . . . . 0.0 112.683 -177.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 41.9 p-80 -78.06 -30.11 49.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.509 0.724 . . . . 0.0 112.35 176.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 20.7 t0 -103.1 84.16 2.31 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.044 1.738 . . . . 0.0 111.316 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 46.8 t -139.67 135.79 17.06 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 126.85 2.06 . . . . 0.0 108.468 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -57.47 -27.48 76.44 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.17 2.58 . . . . 0.0 115.383 -176.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 16.6 t -92.14 -49.86 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 CA-C-N 119.805 1.184 . . . . 0.0 111.387 176.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 4.1 m -69.54 -39.91 77.17 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -174.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.1 tt -55.09 -57.02 21.88 Favored Pre-proline 0 N--CA 1.475 0.804 0 CA-C-O 117.748 -1.12 . . . . 0.0 112.934 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.54 -31.08 91.94 Favored 'Trans proline' 0 C--N 1.354 0.824 0 CA-C-N 121.682 1.636 . . . . 0.0 113.082 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.8 mt -70.55 -45.13 66.04 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.211 0.914 . . . . 0.0 111.601 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 60.1 mttm -60.99 -37.65 83.25 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.423 1.089 . . . . 0.0 110.898 175.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 20.4 t30 -73.3 -41.56 63.42 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.354 1.461 . . . . 0.0 112.745 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.628 0 C-N-CA 124.05 0.94 . . . . 0.0 113.453 -179.149 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.6 m-85 -60.28 -29.15 68.63 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.408 0.683 . . . . 0.0 112.277 174.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 35.9 m -68.01 -34.62 76.85 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.231 0.923 . . . . 0.0 112.916 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.4 t70 -90.03 -30.29 17.84 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.218 1.007 . . . . 0.0 113.136 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.1 tt -43.4 -58.38 2.6 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.105 2.162 . . . . 0.0 113.168 -178.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 44.5 p-90 -71.08 -11.45 60.96 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 -173.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -110.1 -60.08 1.84 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 116.312 1.967 . . . . 0.0 116.312 -175.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 77.9 mt -120.28 16.78 12.3 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 116.665 2.098 . . . . 0.0 116.665 -172.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 6.1 tt . . . . . 0 CA--C 1.554 1.127 0 C-N-CA 125.243 1.417 . . . . 0.0 113.349 -178.35 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 85.8 mt . . . . . 0 CA--C 1.547 0.832 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 68.0 mmm -66.03 148.07 52.37 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -177.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.05 178.18 5.67 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.688 1.995 . . . . 0.0 111.372 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 74.4 m -89.02 152.85 48.82 Favored Pre-proline 0 CA--C 1.546 0.791 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 169.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.74 -18.56 49.14 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 122.546 2.164 . . . . 0.0 115.781 -176.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -76.47 -17.08 59.48 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.04 -1.038 . . . . 0.0 112.596 177.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -82.79 -12.44 57.48 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.313 1.045 . . . . 0.0 112.535 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 96.4 mt -59.07 -35.88 59.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.869 1.268 . . . . 0.0 110.753 178.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -73.32 -9.8 59.08 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.811 1.244 . . . . 0.0 113.265 178.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -79.6 -20.72 46.19 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.964 0.906 . . . . 0.0 111.138 175.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.8 p-90 . . . . . 0 N--CA 1.468 0.441 0 C-N-CA 124.437 1.095 . . . . 0.0 113.033 177.171 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 39.9 ttmt . . . . . 0 CA--C 1.536 0.429 0 CA-C-O 119.61 -0.233 . . . . 0.0 111.495 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 96.9 mtm-85 -69.12 -33.28 73.22 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.427 -0.796 . . . . 0.0 111.181 174.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -65.36 -33.24 75.5 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 118.826 0.739 . . . . 0.0 111.367 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.44 -36.36 83.49 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 118.872 0.76 . . . . 0.0 111.052 175.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -67.01 -52.96 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 118.551 0.614 . . . . 0.0 109.63 175.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -51.94 -56.07 16.44 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.848 0.859 . . . . 0.0 111.443 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -36.05 83.05 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.0 tp60 -70.96 -41.76 70.63 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 119.234 0.925 . . . . 0.0 110.393 178.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.9 tt -62.18 -40.86 97.47 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.578 0.751 . . . . 0.0 109.919 177.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 97.1 t -59.62 -33.37 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.13 0.877 . . . . 0.0 110.942 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.0 tp -73.23 -25.55 60.78 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.875 1.216 . . . . 0.0 113.835 175.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -62.72 -30.19 71.23 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.788 1.176 . . . . 0.0 109.044 172.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.3 mt -72.95 -54.38 8.81 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.118 0.967 . . . . 0.0 108.513 174.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 20.4 t60 -49.4 -55.87 11.55 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.678 0.672 . . . . 0.0 111.273 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -57.65 -22.96 48.75 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -90.04 -24.65 21.12 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -88.0 -41.54 13.05 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 119.843 1.201 . . . . 0.0 112.211 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 25.4 t -59.59 -41.61 90.65 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.107 1.363 . . . . 0.0 111.108 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 6.7 pt20 . . . . . 0 CA--C 1.549 0.919 0 O-C-N 120.651 -1.281 . . . . 0.0 113.055 174.492 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 39.0 m80 . . . . . 0 CA--C 1.54 0.595 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 30.8 t -64.16 -50.05 69.71 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.643 1.177 . . . . 0.0 109.752 176.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -53.92 -43.58 69.87 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.222 1.409 . . . . 0.0 111.015 174.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 19.4 m -64.02 -55.34 22.99 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.699 0.8 . . . . 0.0 111.787 176.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.7 mmt -65.0 -34.64 78.92 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -67.37 -34.94 78.33 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 121.142 1.792 . . . . 0.0 112.081 178.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -66.19 -37.82 86.54 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.214 0.461 . . . . 0.0 110.46 174.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 78.7 t -64.96 -52.17 57.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 123.49 0.716 . . . . 0.0 110.448 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.11 -44.86 87.91 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.722 1.209 . . . . 0.0 112.666 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 37.7 m-20 -66.41 -20.39 66.05 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.562 0.745 . . . . 0.0 112.653 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 63.7 t60 -90.17 -50.92 5.72 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.362 1.065 . . . . 0.0 109.933 172.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.1 ttp -54.99 -34.53 63.49 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.646 1.978 . . . . 0.0 113.474 -177.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 14.8 t -64.12 -27.33 69.01 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 119.276 0.944 . . . . 0.0 112.403 177.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 41.6 m80 -98.28 -26.25 14.58 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.362 1.465 . . . . 0.0 113.302 177.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 49.6 t -63.38 132.49 51.63 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.509 1.523 . . . . 0.0 112.889 -178.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -106.67 -14.15 15.1 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.38 1.472 . . . . 0.0 113.717 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -84.31 -32.96 24.04 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.283 0.947 . . . . 0.0 111.216 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.55 -106.55 0.32 Allowed Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.066 1.317 . . . . 0.0 113.188 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.74 -21.56 63.11 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.753 -0.851 . . . . 0.0 113.2 177.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -97.86 -2.66 40.31 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.639 1.576 . . . . 0.0 113.571 177.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.8 t -60.13 144.59 49.44 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 122.304 1.049 . . . . 0.0 110.612 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -81.26 -10.06 59.66 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.962 1.305 . . . . 0.0 113.234 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 98.2 t -89.16 115.98 29.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 174.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.32 -41.46 72.44 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -64.08 -42.16 97.05 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.478 0.711 . . . . 0.0 112.389 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.7 t -63.12 -53.37 54.52 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.033 1.333 . . . . 0.0 109.974 176.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -56.06 -38.86 71.21 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.97 0.908 . . . . 0.0 112.375 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 25.5 m -67.06 -53.37 31.68 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.975 0.91 . . . . 0.0 113.135 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.8 m -59.34 -26.95 65.48 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.162 0.892 . . . . 0.0 112.823 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.6 -31.5 71.57 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 118.335 -0.841 . . . . 0.0 112.229 175.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -65.93 -38.67 89.25 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.921 1.237 . . . . 0.0 110.89 174.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 9.4 mt -68.39 -48.15 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.129 0.972 . . . . 0.0 110.323 179.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 16.8 mm -62.13 -36.29 73.49 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 123.918 0.887 . . . . 0.0 111.232 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 71.9 m -61.63 -23.71 66.22 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 176.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.7 t60 -64.58 -56.46 13.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.584 1.084 . . . . 0.0 110.268 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 55.5 m95 -61.21 -29.35 69.77 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -70.28 -30.29 67.27 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.939 0.896 . . . . 0.0 112.782 177.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -100.06 -38.91 8.36 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.2 t -80.07 133.4 36.11 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.483 1.513 . . . . 0.0 112.611 -176.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 71.7 p -130.0 1.61 4.78 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.929 1.692 . . . . 0.0 113.893 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -75.91 154.71 35.79 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.273 1.429 . . . . 0.0 113.299 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 18.8 t60 -88.26 -39.2 14.61 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.588 0.755 . . . . 0.0 110.365 172.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 20.1 t0 -94.96 80.49 3.66 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.915 1.686 . . . . 0.0 111.374 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.5 t -134.97 135.45 23.11 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.736 2.014 . . . . 0.0 109.123 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -59.05 -25.18 76.87 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.751 2.3 . . . . 0.0 114.153 -178.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.7 t -92.16 -52.97 9.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 119.817 1.189 . . . . 0.0 111.618 176.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 9.0 m -68.61 -37.73 80.02 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.235 1.569 . . . . 0.0 115.235 -174.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -56.27 -57.53 22.17 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-O 117.63 -1.176 . . . . 0.0 112.8 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -61.08 -31.62 90.9 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 121.933 1.755 . . . . 0.0 113.411 179.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 93.3 mt -68.13 -48.49 65.25 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.888 0.767 . . . . 0.0 111.175 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -63.95 -35.79 81.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.753 0.821 . . . . 0.0 111.37 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 49.4 t30 -64.51 -46.72 81.72 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.525 1.13 . . . . 0.0 110.894 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.77 0 C-N-CA 123.901 0.88 . . . . 0.0 112.515 176.97 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 86.6 m . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 119.46 -0.305 . . . . 0.0 111.25 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -60.11 -29.54 68.67 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.403 0.681 . . . . 0.0 112.602 176.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 70.5 m -71.04 -31.09 67.46 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.888 0.875 . . . . 0.0 113.215 178.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.1 t70 -90.05 -31.14 17.29 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.811 1.244 . . . . 0.0 112.826 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.8 tt -42.59 -60.02 1.69 Allowed 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 127.665 2.386 . . . . 0.0 113.489 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.4 p-90 -70.18 -11.36 60.84 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 115.272 1.582 . . . . 0.0 115.272 -174.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -111.5 -60.03 1.9 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 116.034 1.864 . . . . 0.0 116.034 -175.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 6.6 mp -120.18 20.21 12.07 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -174.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 3.0 tt . . . . . 0 N--CA 1.476 0.829 0 C-N-CA 124.979 1.311 . . . . 0.0 114.137 -178.938 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 21.3 tp . . . . . 0 CA--C 1.554 1.116 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 76.5 mmm -66.33 155.37 37.48 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 -177.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.07 167.18 15.12 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.071 2.148 . . . . 0.0 114.984 -178.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 88.2 p -91.58 162.26 32.02 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 127.202 2.201 . . . . 0.0 108.749 169.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -62.78 -24.56 74.6 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.023 1.815 . . . . 0.0 113.327 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.0 t70 -63.54 -29.12 70.43 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.756 0.823 . . . . 0.0 112.944 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 11.5 t70 -90.12 -17.58 27.42 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 75.5 mt -59.88 -38.33 75.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 CA-C-N 119.792 1.178 . . . . 0.0 110.942 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . 0.304 0.0 OUTLIER -67.98 -9.82 48.56 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 176.628 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -79.37 -29.84 42.3 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.105 -0.997 . . . . 0.0 111.77 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.27 15.0 p-90 . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 178.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 14.2 mptt . . . . . 0 N--CA 1.47 0.535 0 CA-C-O 118.309 -0.853 . . . . 0.0 110.387 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -55.79 -43.93 77.3 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 119.615 1.098 . . . . 0.0 111.586 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -60.71 -38.56 85.46 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.699 0.8 . . . . 0.0 111.582 176.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 93.2 mt -66.3 -38.79 88.54 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.36 0.664 . . . . 0.0 111.637 177.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -62.29 -54.57 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 119.027 0.83 . . . . 0.0 109.754 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -53.63 -55.57 24.72 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.818 1.247 . . . . 0.0 111.095 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -33.36 75.65 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -69.75 -46.56 65.59 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.809 1.186 . . . . 0.0 109.781 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 5.9 tp -59.22 -41.95 89.84 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.56 0.744 . . . . 0.0 111.195 177.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 63.4 t -59.08 -31.89 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-N 119.996 1.271 . . . . 0.0 111.485 176.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 5.8 tp -72.49 -31.42 65.38 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.707 -1.245 . . . . 0.0 112.871 175.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.0 mp -60.48 -31.14 70.18 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 120.249 1.386 . . . . 0.0 109.603 172.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.6 mt -71.1 -51.7 23.6 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.546 0.738 . . . . 0.0 109.975 176.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 21.6 t60 -56.29 -55.8 28.93 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.264 0.625 . . . . 0.0 111.071 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -50.39 -41.74 52.5 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.717 1.207 . . . . 0.0 114.004 -175.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -73.93 -44.44 55.04 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.212 0.915 . . . . 0.0 112.569 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 44.4 mttm -65.73 -43.13 89.96 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.364 1.066 . . . . 0.0 111.229 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 42.2 t -62.21 -47.35 84.83 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.196 1.798 . . . . 0.0 110.388 175.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 14.7 tt0 . . . . . 0 CA--C 1.539 0.548 0 O-C-N 121.302 -0.874 . . . . 0.0 112.881 177.413 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 32.6 m80 . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 43.5 t -67.15 -51.45 53.69 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.292 1.437 . . . . 0.0 109.656 177.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -57.11 -34.93 68.85 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.912 1.285 . . . . 0.0 111.6 174.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.5 m -69.21 -60.97 1.99 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.239 1.016 . . . . 0.0 110.908 175.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.1 mmt -59.4 -35.34 73.78 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -177.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -66.56 -34.47 77.98 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 120.659 1.572 . . . . 0.0 112.722 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -69.73 -37.36 76.47 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.914 -0.491 . . . . 0.0 110.311 173.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 59.3 t -64.78 -40.84 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-O 118.966 -0.54 . . . . 0.0 110.264 175.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.94 -43.78 94.78 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.908 1.283 . . . . 0.0 111.014 175.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -63.7 -36.6 84.37 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.222 0.609 . . . . 0.0 112.006 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 63.5 t60 -74.72 -52.55 11.27 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.741 0.816 . . . . 0.0 110.687 177.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.3 ttp -58.24 -33.27 69.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.741 1.616 . . . . 0.0 113.668 -176.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 3.9 t -75.45 -10.06 59.12 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 119.657 1.117 . . . . 0.0 113.275 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 46.6 m80 -117.37 -16.72 10.24 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.761 1.625 . . . . 0.0 113.717 177.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 38.1 t -57.57 144.72 36.2 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.466 1.506 . . . . 0.0 112.946 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -103.77 -15.12 15.82 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.046 1.738 . . . . 0.0 113.564 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -106.94 -34.0 7.34 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.329 1.052 . . . . 0.0 112.448 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.5 -105.73 0.24 Allowed Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.828 1.204 . . . . 0.0 114.096 177.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -60.09 -21.9 62.07 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 121.133 -1.216 . . . . 0.0 112.828 177.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -100.78 0.2 38.32 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.272 1.829 . . . . 0.0 113.522 176.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 12.5 t -63.67 143.28 57.97 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 122.261 1.029 . . . . 0.0 110.375 178.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -84.6 -6.48 59.37 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.761 1.224 . . . . 0.0 113.51 -176.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 88.0 t -83.96 120.91 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 173.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.66 -44.38 69.59 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 72.3 m80 -62.28 -42.3 99.23 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 50.2 t -64.91 -55.95 16.2 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.78 1.232 . . . . 0.0 111.311 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.61 -32.75 70.69 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.371 0.668 . . . . 0.0 112.482 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 74.2 m -73.63 -47.0 43.43 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.543 0.737 . . . . 0.0 111.549 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 69.6 m -62.27 -36.61 82.59 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.584 1.154 . . . . 0.0 112.1 178.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -61.65 -31.77 71.89 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.318 -0.864 . . . . 0.0 113.009 175.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -69.65 -28.53 65.97 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.146 0.884 . . . . 0.0 111.27 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.8 mm -70.83 -50.38 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 123.888 0.875 . . . . 0.0 109.645 174.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 12.9 mm -61.34 -42.22 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 124.949 1.299 . . . . 0.0 111.425 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 50.2 m -60.41 -20.81 61.03 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.431 0.901 . . . . 0.0 113.431 179.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.3 t60 -64.78 -55.9 16.89 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.474 1.034 . . . . 0.0 110.728 176.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 50.1 m95 -62.54 -24.72 67.66 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -74.08 -30.74 62.52 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.539 0.736 . . . . 0.0 112.461 176.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -100.05 -38.12 8.69 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.9 t -78.53 135.23 37.26 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.426 1.49 . . . . 0.0 112.373 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 79.7 p -129.97 2.17 4.81 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.518 1.527 . . . . 0.0 114.175 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -82.23 152.17 26.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.236 1.414 . . . . 0.0 113.499 -178.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 15.0 t60 -86.62 -37.92 17.59 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.862 0.865 . . . . 0.0 109.934 171.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 21.4 t0 -94.3 78.48 3.94 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.017 1.727 . . . . 0.0 111.336 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.8 t -132.67 135.44 26.11 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 126.819 2.047 . . . . 0.0 109.232 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -59.79 -24.24 75.1 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.798 2.332 . . . . 0.0 114.027 -178.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 8.1 t -92.22 -52.99 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-N 119.608 1.095 . . . . 0.0 111.855 176.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 15.2 m -68.97 -40.4 78.86 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -175.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.8 tt -55.92 -56.12 33.85 Favored Pre-proline 0 CA--C 1.545 0.785 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.571 -178.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -61.7 -30.15 84.7 Favored 'Trans proline' 0 C--N 1.355 0.873 0 CA-C-N 121.679 1.635 . . . . 0.0 113.287 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 91.2 mt -69.73 -45.7 67.58 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.873 1.215 . . . . 0.0 111.494 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -63.26 -35.85 81.72 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.917 0.887 . . . . 0.0 110.749 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 22.9 t30 -71.41 -40.12 70.68 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.004 1.322 . . . . 0.0 112.197 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.613 0 C-N-CA 124.804 1.242 . . . . 0.0 113.251 178.941 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 99.4 m . . . . . 0 N--CA 1.476 0.862 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -60.11 -29.3 68.52 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 177.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 69.8 m -70.55 -29.94 66.54 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.781 0.832 . . . . 0.0 112.911 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.9 t70 -90.22 -30.37 17.6 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.615 1.166 . . . . 0.0 113.156 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.5 tt -45.66 -59.96 2.46 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.88 2.072 . . . . 0.0 113.252 -177.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.4 p-90 -67.99 -8.5 37.94 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -174.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -111.99 -58.07 2.18 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 44.1 mt -120.15 19.95 12.13 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 116.061 1.874 . . . . 0.0 116.061 -171.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.1 tt . . . . . 0 CA--C 1.55 0.957 0 C-N-CA 125.871 1.668 . . . . 0.0 114.999 -178.216 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 35.6 tp . . . . . 0 CA--C 1.549 0.917 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 47.9 mmm -62.19 153.24 30.95 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 -177.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 94.7 mt -125.21 155.96 39.23 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 127.336 2.254 . . . . 0.0 112.337 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 33.5 p -75.95 160.01 79.5 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 170.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -61.81 -17.43 55.11 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 121.83 1.687 . . . . 0.0 114.139 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 28.8 t70 -77.08 -25.76 52.67 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.216 1.006 . . . . 0.0 112.877 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -77.89 -14.11 59.66 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.859 0.864 . . . . 0.0 112.703 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 77.7 mt -58.41 -37.46 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.892 1.277 . . . . 0.0 110.615 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -68.14 -9.96 50.52 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.068 1.747 . . . . 0.0 113.113 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -86.71 -27.05 23.94 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.666 1.186 . . . . 0.0 112.561 178.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 . . . . . 0 N--CA 1.477 0.913 0 C-N-CA 123.981 0.912 . . . . 0.0 112.349 174.871 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 33.4 mmtp . . . . . 0 N--CA 1.471 0.581 0 CA-C-O 118.233 -0.889 . . . . 0.0 112.116 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -54.35 -43.86 71.65 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 120.039 1.29 . . . . 0.0 112.106 178.228 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -60.7 -31.2 70.48 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 96.4 mt -71.41 -41.16 69.92 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.2 0.909 . . . . 0.0 111.705 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.9 mt -64.22 -51.75 64.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -55.94 -54.64 42.26 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.636 1.174 . . . . 0.0 111.258 177.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -35.6 80.79 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -177.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -66.35 -46.25 77.43 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.765 1.166 . . . . 0.0 109.773 176.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 10.3 tp -59.94 -42.03 93.11 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.118 0.567 . . . . 0.0 111.017 176.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 84.3 t -60.93 -31.01 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.661 1.119 . . . . 0.0 111.285 175.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.6 tp -74.79 -28.18 60.62 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.228 1.376 . . . . 0.0 112.816 174.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 8.6 mp -61.31 -28.13 68.98 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 120.288 1.404 . . . . 0.0 108.934 171.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.9 mt -74.55 -58.7 3.12 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.079 -0.962 . . . . 0.0 108.926 174.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 25.2 t60 -47.6 -55.37 9.43 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.062 0.846 . . . . 0.0 110.438 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -51.0 -36.08 37.35 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.355 1.062 . . . . 0.0 113.74 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -83.62 -37.8 22.41 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 178.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -70.06 -37.32 75.48 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 119.848 1.204 . . . . 0.0 110.578 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 36.5 t -65.95 -43.04 89.12 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.813 2.045 . . . . 0.0 110.899 176.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 24.5 tt0 . . . . . 0 N--CA 1.476 0.858 0 C-N-CA 124.631 1.172 . . . . 0.0 113.135 175.957 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 54.2 m80 . . . . . 0 CA--C 1.539 0.542 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 24.6 t -68.96 -53.13 22.45 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.532 1.133 . . . . 0.0 108.605 175.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 20.6 ttt85 -55.12 -32.45 62.06 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.517 1.527 . . . . 0.0 111.644 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.2 m -73.36 -59.06 2.89 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.17 1.388 . . . . 0.0 111.336 174.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.7 mmt -62.28 -36.25 81.5 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -65.15 -29.29 70.11 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 120.588 1.54 . . . . 0.0 112.711 178.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -74.9 -38.52 61.82 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.35 0.66 . . . . 0.0 110.447 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 84.1 t -63.17 -44.28 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.729 0.695 . . . . 0.0 110.011 175.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -47.65 84.06 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.189 0.996 . . . . 0.0 110.784 177.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -63.81 -22.96 67.17 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 176.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 71.5 t60 -83.94 -49.78 8.66 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.998 0.817 . . . . 0.0 109.632 174.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 34.8 ttp -57.57 -29.4 64.4 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.418 1.887 . . . . 0.0 113.559 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 20.2 p -69.85 -29.1 66.26 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 121.087 -1.008 . . . . 0.0 112.528 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -95.79 -26.34 15.7 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.894 1.678 . . . . 0.0 112.992 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 18.0 t -60.63 150.26 32.46 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.598 1.559 . . . . 0.0 112.873 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -121.25 -13.18 8.53 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.888 1.675 . . . . 0.0 113.638 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -95.57 -27.64 15.24 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.254 1.022 . . . . 0.0 112.421 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.55 -113.07 2.77 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 124.534 1.064 . . . . 0.0 113.132 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -63.46 -15.58 58.16 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.149 -1.206 . . . . 0.0 113.644 178.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -97.92 -1.71 42.28 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.242 1.417 . . . . 0.0 113.128 175.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 18.5 t -60.33 144.02 51.6 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 122.278 1.037 . . . . 0.0 110.839 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 58.1 mm-40 -78.88 -7.75 58.22 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.562 1.145 . . . . 0.0 113.0 -176.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 93.8 t -90.23 116.57 31.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 173.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.34 -38.6 68.97 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -65.93 -44.74 84.23 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.212 0.605 . . . . 0.0 112.247 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 40.4 t -59.94 -55.9 28.32 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.992 1.317 . . . . 0.0 110.728 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.95 -22.59 64.58 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.7 m -83.4 -51.56 7.29 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.882 0.873 . . . . 0.0 111.368 176.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 57.7 m -58.51 -35.98 73.1 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.269 -0.895 . . . . 0.0 112.354 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 37.3 tpt85 -63.7 -24.76 67.91 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.48 -0.762 . . . . 0.0 112.982 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -72.62 -30.4 64.31 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.015 0.825 . . . . 0.0 111.152 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.0 mm -70.51 -44.73 76.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 175.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 26.7 mm -60.22 -37.91 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.725 1.21 . . . . 0.0 110.645 176.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 67.4 m -61.64 -25.23 67.24 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.047 0.939 . . . . 0.0 113.324 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.2 t60 -62.84 -56.73 14.8 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.87 1.214 . . . . 0.0 110.838 179.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 51.8 m95 -62.85 -21.47 65.98 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 64.0 mttm -82.19 -26.77 33.07 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.331 1.052 . . . . 0.0 112.799 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -100.12 -43.64 6.26 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.955 1.302 . . . . 0.0 113.341 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 9.4 t -84.0 133.53 34.67 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.579 1.952 . . . . 0.0 110.958 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 69.4 p -129.97 -4.69 4.52 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.644 1.35 . . . . 0.0 114.644 -177.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 77.1 mtp85 -66.19 153.39 42.56 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.815 1.646 . . . . 0.0 113.64 -178.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -86.97 -26.45 23.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.444 0.698 . . . . 0.0 111.349 171.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 21.3 t0 -108.06 78.7 1.2 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.865 2.066 . . . . 0.0 111.433 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.0 t -136.48 136.01 21.49 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 127.289 2.236 . . . . 0.0 108.334 178.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -59.01 -24.28 72.62 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.763 2.309 . . . . 0.0 114.068 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.9 t -92.15 -52.01 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.694 1.134 . . . . 0.0 111.288 175.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 10.8 m -68.6 -42.1 78.63 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.974 1.472 . . . . 0.0 114.974 -175.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.2 tt -52.27 -57.48 15.18 Favored Pre-proline 0 CA--C 1.547 0.844 0 CA-C-O 117.802 -1.094 . . . . 0.0 113.316 -177.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -60.46 -31.65 92.79 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.78 1.654 . . . . 0.0 113.54 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.6 mt -73.25 -44.58 59.14 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.659 0.784 . . . . 0.0 112.255 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -58.94 -37.86 77.69 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.842 0.857 . . . . 0.0 110.305 174.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 38.5 t30 -73.37 -36.57 66.11 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.94 1.696 . . . . 0.0 113.385 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -178.207 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 91.2 m . . . . . 0 N--CA 1.477 0.893 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.35 -29.37 68.85 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.157 0.983 . . . . 0.0 112.956 174.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 18.2 m -69.26 -33.92 73.98 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -90.18 -28.07 19.15 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.062 0.945 . . . . 0.0 112.985 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -44.76 -60.13 2.18 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 126.761 2.024 . . . . 0.0 113.932 -176.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -68.03 -10.24 52.16 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -171.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.67 -56.59 2.36 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -176.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 53.2 mt -119.99 11.4 11.74 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 -171.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.552 1.03 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 27.8 tp . . . . . 0 CA--C 1.553 1.062 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.85 137.85 56.9 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -174.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -125.03 139.37 53.87 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 128.088 2.555 . . . . 0.0 111.994 -179.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 73.8 p -64.79 146.29 98.62 Favored Pre-proline 0 N--CA 1.473 0.725 0 C-N-CA 124.109 0.963 . . . . 0.0 113.237 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -60.79 -30.26 89.86 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.816 2.344 . . . . 0.0 114.393 -177.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.27 -22.57 66.31 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.526 -0.734 . . . . 0.0 112.623 176.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 13.6 t70 -90.06 -9.85 46.95 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 84.7 mt -55.92 -37.81 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-N 119.638 1.108 . . . . 0.0 111.035 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -64.07 -9.73 18.02 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.133 1.373 . . . . 0.0 113.961 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.4 tp60 -77.43 -37.87 50.8 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.079 -1.013 . . . . 0.0 111.323 174.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 . . . . . 0 N--CA 1.472 0.638 0 C-N-CA 123.486 0.714 . . . . 0.0 111.979 178.783 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 72.9 mmtt . . . . . 0 N--CA 1.469 0.499 0 CA-C-O 119.536 -0.269 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -53.64 -44.3 69.47 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.092 0.957 . . . . 0.0 112.16 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -63.5 -30.98 72.02 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 177.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 75.9 mt -70.14 -40.93 74.5 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.618 0.767 . . . . 0.0 110.031 175.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.5 mt -60.65 -50.78 79.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.19 -53.18 57.04 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.413 1.085 . . . . 0.0 111.516 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -35.45 79.56 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -69.41 -46.77 66.05 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.951 0.796 . . . . 0.0 110.865 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.7 tt -58.81 -43.1 90.51 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.034 0.934 . . . . 0.0 110.379 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 60.2 t -61.56 -31.81 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.979 0.809 . . . . 0.0 111.515 175.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 33.6 tp -67.02 -37.55 84.34 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.606 -1.309 . . . . 0.0 111.976 174.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.93 -25.57 63.58 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 119.326 0.966 . . . . 0.0 110.955 176.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 7.0 mt -74.07 -55.12 6.49 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.734 0.814 . . . . 0.0 109.737 176.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 14.2 t60 -56.96 -50.48 72.51 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 119.192 -0.432 . . . . 0.0 110.898 178.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -60.01 -22.53 62.71 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -178.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -90.14 -31.06 17.25 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.975 -1.078 . . . . 0.0 112.927 173.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 58.1 mttm -80.09 -40.01 28.45 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.104 1.362 . . . . 0.0 112.6 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.5 t -63.06 -45.79 90.53 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.527 1.931 . . . . 0.0 111.44 177.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.7 pt20 . . . . . 0 CA--C 1.545 0.772 0 O-C-N 121.292 -0.88 . . . . 0.0 111.783 175.382 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 35.9 m80 . . . . . 0 N--CA 1.472 0.647 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 40.4 t -62.32 -46.74 87.35 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.27 1.028 . . . . 0.0 109.91 176.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -54.92 -35.22 63.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.36 1.464 . . . . 0.0 112.146 175.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 49.3 m -72.07 -60.18 2.36 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.614 0.765 . . . . 0.0 110.807 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 15.6 mmt -60.34 -34.03 73.25 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -64.88 -33.58 76.35 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 120.566 1.53 . . . . 0.0 112.675 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -72.14 -37.91 69.34 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.131 0.572 . . . . 0.0 110.197 174.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 66.9 t -62.45 -46.61 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 122.948 0.499 . . . . 0.0 110.696 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.0 -43.7 98.5 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.975 0.91 . . . . 0.0 111.799 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -64.86 -32.89 74.81 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 176.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 61.0 t60 -75.04 -52.07 11.99 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.728 0.811 . . . . 0.0 110.204 175.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 40.6 ttp -56.73 -31.16 64.26 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.524 1.93 . . . . 0.0 114.304 -177.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.7 t -77.98 -9.94 59.35 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 120.059 1.3 . . . . 0.0 112.99 176.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -118.93 -14.0 9.43 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.749 1.619 . . . . 0.0 113.916 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 43.5 t -56.61 144.65 31.16 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.684 1.594 . . . . 0.0 113.045 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -96.71 -13.84 22.45 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.003 1.721 . . . . 0.0 113.588 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -118.7 -30.68 5.05 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.268 1.027 . . . . 0.0 113.558 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.21 -107.58 0.6 Allowed Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.717 1.151 . . . . 0.0 113.436 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -61.62 -20.59 63.52 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 121.053 -1.263 . . . . 0.0 112.945 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -100.51 1.52 41.11 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.062 1.745 . . . . 0.0 113.561 176.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.5 t -63.54 139.86 58.81 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.262 1.025 . . . . 0.0 110.013 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -81.44 0.14 38.98 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -175.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 16.6 t -90.49 125.3 43.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.732 1.213 . . . . 0.0 109.159 176.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.38 -28.1 51.83 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -175.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -90.06 -18.63 25.57 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.686 1.735 . . . . 0.0 115.686 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 52.7 t -83.17 -59.86 2.33 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.126 1.37 . . . . 0.0 111.076 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.02 -29.53 65.38 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 4.7 p -73.57 -54.92 7.06 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 124.958 1.303 . . . . 0.0 111.822 176.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 53.0 m -59.4 -34.68 72.74 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.47 0.708 . . . . 0.0 111.692 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 45.1 tpt85 -62.86 -30.02 71.2 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -67.78 -34.7 77.31 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.307 0.958 . . . . 0.0 110.963 175.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 10.2 mt -67.82 -45.64 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 124.15 0.98 . . . . 0.0 109.731 176.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 15.0 mm -60.76 -36.74 73.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.918 0.887 . . . . 0.0 111.229 176.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.14 -21.17 66.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 177.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.0 t60 -64.11 -59.97 3.8 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.422 1.01 . . . . 0.0 110.726 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 62.4 m95 -60.62 -26.95 67.39 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 63.4 mttm -71.5 -34.76 70.41 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.831 0.852 . . . . 0.0 112.787 178.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.14 -32.31 10.97 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 178.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 9.6 t -78.21 133.78 37.69 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.444 1.498 . . . . 0.0 111.996 -178.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 71.5 p -130.09 -1.04 4.64 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.335 1.454 . . . . 0.0 114.492 -178.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -80.14 150.26 30.27 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.738 1.215 . . . . 0.0 112.685 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.1 p-80 -84.37 -36.13 22.69 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.329 0.652 . . . . 0.0 111.569 175.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.8 t0 -94.19 70.05 3.8 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.069 1.748 . . . . 0.0 111.854 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 47.7 t -122.99 134.2 24.94 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 126.329 1.852 . . . . 0.0 109.524 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -58.33 -25.64 73.68 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.927 2.418 . . . . 0.0 114.36 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 39.3 t -92.12 -52.55 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 119.209 0.913 . . . . 0.0 111.65 176.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 7.8 m -69.73 -36.97 76.31 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -175.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -57.36 -57.12 27.26 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 117.625 -1.178 . . . . 0.0 112.337 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -59.94 -30.9 92.82 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.778 1.652 . . . . 0.0 113.197 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 94.5 mt -70.28 -47.02 63.1 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.183 0.901 . . . . 0.0 111.869 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -63.64 -37.97 89.36 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.725 0.693 . . . . 0.0 110.635 176.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 34.3 t30 -65.47 -36.55 84.23 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.638 1.175 . . . . 0.0 112.267 176.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.699 0 C-N-CA 124.304 1.041 . . . . 0.0 113.325 178.54 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 6.2 m . . . . . 0 N--CA 1.475 0.796 0 N-CA-C 110.832 -0.062 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -60.24 -31.14 69.92 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.527 0.731 . . . . 0.0 112.49 176.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 49.0 m -69.86 -29.32 66.52 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.863 0.756 . . . . 0.0 112.871 177.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.0 t70 -90.17 -29.76 18.05 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.776 1.231 . . . . 0.0 113.23 176.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.1 tt -45.49 -60.0 2.41 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.943 2.097 . . . . 0.0 113.42 -177.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.0 p-90 -69.6 -10.49 58.41 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -173.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -109.6 -53.77 2.63 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 115.748 1.759 . . . . 0.0 115.748 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 59.6 mt -119.9 11.61 11.86 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 116.263 1.949 . . . . 0.0 116.263 -172.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 7.0 tt . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 124.249 1.019 . . . . 0.0 111.279 178.914 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 98.5 mt . . . . . 0 CA--C 1.548 0.896 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 71.6 mmm -62.39 151.49 36.81 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.09 168.0 14.0 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.874 2.07 . . . . 0.0 110.866 178.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 59.4 m -75.49 145.6 79.51 Favored Pre-proline 0 CA--C 1.546 0.825 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 169.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -57.02 -18.66 29.35 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.755 2.303 . . . . 0.0 115.527 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -77.16 -24.29 51.52 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.531 1.133 . . . . 0.0 112.723 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 18.5 t70 -81.84 -9.91 59.47 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.028 0.931 . . . . 0.0 113.221 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 67.7 mt -55.88 -35.24 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.277 1.431 . . . . 0.0 110.283 175.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -67.06 -9.87 43.87 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.784 1.634 . . . . 0.0 113.643 178.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -82.28 -27.04 32.59 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.034 0.934 . . . . 0.0 111.7 176.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.3 p-90 . . . . . 0 N--CA 1.472 0.632 0 CA-C-O 118.106 -0.95 . . . . 0.0 112.316 176.362 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 54.5 mtpt . . . . . 0 N--CA 1.47 0.566 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -50.24 -43.76 53.1 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.77 1.628 . . . . 0.0 113.018 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -61.7 -32.61 72.83 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 177.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 83.2 mt -71.72 -39.34 70.18 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.345 1.058 . . . . 0.0 110.985 177.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 3.0 mt -62.79 -52.45 59.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.343 0.657 . . . . 0.0 109.583 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -56.18 -58.26 8.71 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.634 1.174 . . . . 0.0 111.218 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -35.78 81.72 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -177.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -65.62 -43.07 90.7 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.802 1.183 . . . . 0.0 110.332 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 8.0 tp -62.06 -39.89 93.92 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.25 0.62 . . . . 0.0 110.627 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 63.3 t -60.86 -34.3 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.131 0.878 . . . . 0.0 110.802 174.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 3.4 tp -71.48 -27.77 63.48 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 120.286 1.403 . . . . 0.0 112.853 175.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.9 mp -63.51 -29.2 70.51 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 120.523 1.51 . . . . 0.0 109.63 173.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.1 mt -75.55 -51.39 13.02 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.99 0.916 . . . . 0.0 108.739 174.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 30.6 t60 -53.31 -55.9 20.94 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 123.652 0.781 . . . . 0.0 110.827 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.97 -41.97 65.07 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.09 0.956 . . . . 0.0 113.338 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -72.34 -42.65 65.12 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.537 -0.727 . . . . 0.0 112.399 178.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 56.1 mttm -71.01 -36.47 72.43 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.638 1.175 . . . . 0.0 112.229 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 12.0 t -67.69 -41.44 83.61 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.44 1.896 . . . . 0.0 109.834 175.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.0 tt0 . . . . . 0 CA--C 1.543 0.679 0 C-N-CA 124.357 1.063 . . . . 0.0 110.347 172.392 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 41.2 m80 . . . . . 0 CA--C 1.538 0.494 0 N-CA-C 113.032 0.752 . . . . 0.0 113.032 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 40.7 t -67.55 -51.92 44.95 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.012 1.325 . . . . 0.0 109.678 177.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -57.15 -38.77 74.03 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.7 1.2 . . . . 0.0 111.123 174.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.9 m -65.98 -57.06 8.66 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.465 1.106 . . . . 0.0 111.596 177.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 15.0 mmt -63.41 -37.07 85.86 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 118.235 -0.888 . . . . 0.0 113.147 -177.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -65.34 -32.69 74.46 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 121.143 1.792 . . . . 0.0 112.084 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -69.92 -38.93 76.38 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.911 -0.493 . . . . 0.0 110.777 173.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 89.0 t -64.66 -42.73 95.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 118.791 0.723 . . . . 0.0 110.436 175.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.47 -45.98 84.21 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.344 1.057 . . . . 0.0 110.374 176.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -66.07 -21.54 66.37 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 177.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 60.3 t60 -86.43 -49.56 7.53 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.64 0.776 . . . . 0.0 109.697 174.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -58.31 -27.44 64.1 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.254 1.822 . . . . 0.0 113.532 -177.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 19.4 p -72.34 -26.54 61.96 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.519 1.128 . . . . 0.0 112.618 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 80.3 t60 -102.36 -21.83 14.22 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.06 1.744 . . . . 0.0 113.523 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 25.0 t -57.71 143.06 43.13 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.281 1.432 . . . . 0.0 113.144 -177.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -107.88 -15.7 14.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.999 1.72 . . . . 0.0 113.418 -178.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -103.23 -32.82 9.42 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.561 1.144 . . . . 0.0 112.281 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.56 -105.87 0.26 Allowed Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.979 1.276 . . . . 0.0 113.869 177.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -59.15 -22.13 60.45 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.31 -1.112 . . . . 0.0 112.943 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -102.59 1.78 35.24 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.398 1.879 . . . . 0.0 113.828 177.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 19.5 t -62.32 141.49 58.26 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.216 1.006 . . . . 0.0 110.575 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -81.74 -5.46 58.16 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.324 1.05 . . . . 0.0 113.333 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 97.8 t -86.86 115.57 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 172.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.09 -39.59 69.47 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -176.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.34 -40.89 96.78 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.659 0.784 . . . . 0.0 112.552 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.2 t -65.25 -57.16 9.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.469 1.508 . . . . 0.0 110.818 178.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -61.1 -27.65 68.52 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 68.5 m -76.85 -45.27 29.03 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.381 -0.825 . . . . 0.0 111.198 175.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 64.0 m -62.84 -35.98 81.71 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.239 1.016 . . . . 0.0 111.554 176.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 3.3 mmm-85 -61.81 -30.39 70.79 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -68.37 -29.56 68.3 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.363 0.983 . . . . 0.0 111.243 176.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 1.8 mm -73.28 -47.01 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 176.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 24.6 mm -61.15 -37.99 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.947 1.299 . . . . 0.0 111.571 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 49.1 m -62.78 -21.28 65.75 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.961 0.904 . . . . 0.0 113.222 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.6 t60 -66.24 -60.47 2.76 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.334 0.97 . . . . 0.0 110.448 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 67.2 m95 -59.6 -28.99 67.66 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 89.7 mttt -67.79 -36.09 79.83 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.652 0.781 . . . . 0.0 113.03 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.18 -31.82 11.2 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.1 t -79.22 135.19 36.71 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.198 1.399 . . . . 0.0 112.165 -177.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.7 p -130.1 -2.27 4.56 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.248 1.419 . . . . 0.0 114.644 -177.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -81.75 149.83 28.23 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.736 1.214 . . . . 0.0 112.876 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -84.56 -30.99 24.61 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.549 0.739 . . . . 0.0 111.493 174.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.3 t0 -97.33 69.93 2.28 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.228 1.811 . . . . 0.0 111.346 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.9 t -126.14 135.02 26.54 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 126.296 1.839 . . . . 0.0 109.723 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -57.76 -25.64 69.53 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 123.049 2.499 . . . . 0.0 114.606 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 14.7 t -92.23 -50.89 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 119.48 1.036 . . . . 0.0 111.795 176.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 6.9 m -70.44 -40.28 73.87 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -174.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.4 tt -54.43 -55.94 32.07 Favored Pre-proline 0 CA--C 1.547 0.862 0 CA-C-O 117.825 -1.083 . . . . 0.0 112.854 -178.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -60.92 -30.27 89.66 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.761 1.641 . . . . 0.0 113.454 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.88 -44.17 66.87 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.41 1.004 . . . . 0.0 111.645 177.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -64.97 -31.12 72.2 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.7 0.8 . . . . 0.0 111.35 175.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 32.4 t30 -75.98 -37.13 58.87 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.057 1.343 . . . . 0.0 112.074 176.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.653 0 C-N-CA 124.565 1.146 . . . . 0.0 113.53 -179.437 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 85.9 m . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 119.725 -0.179 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -60.01 -27.09 66.59 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.6 0.76 . . . . 0.0 112.71 176.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 45.5 m -74.79 -30.62 61.5 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.931 0.892 . . . . 0.0 113.06 178.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.2 t70 -90.12 -29.38 18.34 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.581 1.152 . . . . 0.0 112.878 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -43.31 -60.15 1.81 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 127.515 2.326 . . . . 0.0 113.933 -177.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 51.7 p-90 -68.59 -9.79 51.87 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 -172.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -111.96 -56.83 2.34 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 -177.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 63.9 mt -120.02 14.26 12.3 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -170.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.8 tt . . . . . 0 CA--C 1.552 1.054 0 C-N-CA 125.795 1.638 . . . . 0.0 113.842 179.388 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 25.3 tp . . . . . 0 CA--C 1.55 0.977 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.1 141.58 57.4 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -175.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.3 tt -125.16 142.39 51.52 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 128.657 2.783 . . . . 0.0 111.158 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 40.7 t -66.44 142.69 97.85 Favored Pre-proline 0 N--CA 1.477 0.878 0 C-N-CA 124.088 0.955 . . . . 0.0 112.372 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.66 -21.4 47.01 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.76 2.306 . . . . 0.0 115.445 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.7 t70 -75.78 -24.81 56.02 Favored 'General case' 0 CA--C 1.549 0.921 0 O-C-N 121.395 -0.815 . . . . 0.0 112.164 176.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -83.79 -9.72 58.59 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.371 1.869 . . . . 0.0 112.569 177.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 85.2 mt -56.02 -31.15 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.429 1.013 . . . . 0.0 109.678 174.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -67.85 -9.87 48.28 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.011 1.324 . . . . 0.0 113.703 176.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -80.78 -25.14 38.1 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.089 1.356 . . . . 0.0 111.803 177.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 4.5 p-90 . . . . . 0 N--CA 1.472 0.66 0 C-N-CA 124.6 1.16 . . . . 0.0 113.455 177.369 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 54.0 mttp . . . . . 0 N--CA 1.471 0.616 0 CA-C-O 119.036 -0.507 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -54.56 -46.05 73.59 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.22 0.918 . . . . 0.0 111.876 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -62.3 -30.16 70.95 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 177.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.49 -38.82 71.15 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.658 0.783 . . . . 0.0 110.649 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.6 mt -64.32 -53.14 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -53.17 -51.98 60.28 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.399 1.08 . . . . 0.0 111.461 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.53 -34.51 78.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -179.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -71.0 -49.62 43.19 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.815 0.734 . . . . 0.0 110.136 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.5 tt -58.0 -44.8 87.43 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.116 1.366 . . . . 0.0 111.178 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 88.5 t -59.57 -32.94 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 119.457 1.026 . . . . 0.0 111.662 176.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 4.4 tp -74.41 -24.45 59.1 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.847 1.203 . . . . 0.0 113.086 175.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.2 mp -62.77 -31.14 72.05 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 120.546 1.521 . . . . 0.0 109.08 171.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 5.6 mt -70.02 -53.19 18.73 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.123 0.969 . . . . 0.0 109.476 175.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.4 t60 -54.82 -56.04 23.68 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.09 0.556 . . . . 0.0 110.717 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.28 -27.23 54.63 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -86.78 -26.38 24.15 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.467 1.03 . . . . 0.0 113.392 176.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 43.9 mttm -89.94 -36.3 15.08 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.186 1.794 . . . . 0.0 112.683 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.3 t -61.68 -47.96 82.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.957 2.103 . . . . 0.0 111.273 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 13.3 pt20 . . . . . 0 CA--C 1.549 0.939 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 177.167 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 55.4 m80 . . . . . 0 N--CA 1.472 0.671 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.7 t -69.18 -50.72 45.03 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.763 1.225 . . . . 0.0 108.967 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 19.0 tpp85 -55.9 -36.15 67.34 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.412 1.485 . . . . 0.0 111.733 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 8.2 m -69.46 -57.59 5.05 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.145 1.378 . . . . 0.0 111.171 176.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.6 mmt -64.33 -35.48 80.99 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -177.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -63.94 -32.35 73.86 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 120.889 1.677 . . . . 0.0 112.359 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -72.32 -42.39 65.47 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.372 0.669 . . . . 0.0 110.46 174.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 76.8 t -60.51 -47.78 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 123.221 0.608 . . . . 0.0 110.797 176.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.18 -45.16 94.08 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.557 1.143 . . . . 0.0 112.377 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 24.4 m-80 -63.31 -33.59 75.85 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 177.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 66.9 t60 -75.24 -49.42 19.38 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.221 0.609 . . . . 0.0 110.827 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.7 ttp -57.37 -31.21 65.55 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.93 1.692 . . . . 0.0 114.286 -176.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 13.1 t -77.85 -14.41 59.57 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.974 1.261 . . . . 0.0 112.535 176.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 84.3 t60 -99.86 -29.39 12.62 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.771 1.628 . . . . 0.0 111.774 175.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 19.0 t -60.78 152.38 27.14 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.548 1.939 . . . . 0.0 112.513 179.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -127.44 -10.46 5.72 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.381 1.472 . . . . 0.0 114.024 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -92.28 -25.23 18.69 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.071 0.948 . . . . 0.0 112.593 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 55.15 -115.64 5.91 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.259 0.933 . . . . 0.0 112.582 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 62.7 tttp -60.63 -21.28 62.57 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.356 -1.085 . . . . 0.0 112.998 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.07 -1.66 57.75 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.753 1.221 . . . . 0.0 113.628 177.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.9 t -64.65 141.49 58.75 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.056 0.932 . . . . 0.0 109.83 177.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -80.48 -5.21 56.28 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 90.4 t -89.51 113.69 26.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.64 -40.82 66.14 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -176.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -67.62 -30.46 70.04 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.63 1.172 . . . . 0.0 113.609 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.5 t -74.18 -55.53 5.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.068 1.347 . . . . 0.0 109.257 177.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.34 -25.81 66.1 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 85.1 p -81.72 -49.26 10.66 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.34 0.973 . . . . 0.0 111.852 175.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 50.1 m -60.07 -34.49 73.51 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.462 0.705 . . . . 0.0 112.234 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 48.0 tpt85 -61.1 -29.92 70.04 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.464 -0.772 . . . . 0.0 113.028 177.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -69.95 -33.31 71.94 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.712 0.805 . . . . 0.0 110.974 176.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 16.8 mt -69.03 -43.88 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 124.638 1.175 . . . . 0.0 109.373 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 16.9 mm -62.85 -38.12 81.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 123.993 0.917 . . . . 0.0 110.793 174.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 5.6 t -62.44 -27.38 69.06 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.131 0.972 . . . . 0.0 112.65 177.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.9 t60 -60.81 -55.95 26.99 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.292 0.951 . . . . 0.0 111.011 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 43.7 m95 -61.96 -28.72 69.75 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 92.3 mttt -73.3 -28.0 61.85 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.143 0.977 . . . . 0.0 112.794 178.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -100.09 -38.58 8.49 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.5 t -76.7 134.6 39.18 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.787 1.635 . . . . 0.0 112.835 -176.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.5 p -130.07 -0.51 4.67 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.535 1.534 . . . . 0.0 114.361 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -82.85 153.52 25.12 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.019 1.327 . . . . 0.0 113.255 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 16.2 t60 -86.45 -40.38 15.38 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.831 0.853 . . . . 0.0 111.13 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.3 t0 -91.48 69.91 5.89 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.604 1.561 . . . . 0.0 111.852 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.4 t -121.32 132.59 24.18 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 126.297 1.839 . . . . 0.0 109.22 178.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -59.9 -24.41 76.07 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.596 2.197 . . . . 0.0 114.378 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.6 t -92.2 -50.87 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 119.525 1.057 . . . . 0.0 111.476 175.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 12.9 m -69.92 -38.64 76.3 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.9 tt -54.19 -56.37 26.94 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-O 117.752 -1.118 . . . . 0.0 113.006 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -61.41 -30.1 86.56 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 121.77 1.647 . . . . 0.0 113.327 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 93.5 mt -70.95 -46.22 62.79 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.341 0.973 . . . . 0.0 111.736 177.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -62.89 -31.75 72.86 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.636 0.774 . . . . 0.0 111.019 176.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 18.8 t30 -74.35 -39.84 62.53 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.332 1.453 . . . . 0.0 112.137 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.74 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -179.976 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 15.3 m . . . . . 0 N--CA 1.472 0.635 0 CA-C-O 119.444 -0.313 . . . . 0.0 110.218 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -60.07 -30.47 69.24 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.497 0.719 . . . . 0.0 112.289 174.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 50.6 m -70.16 -32.73 70.84 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.7 t70 -90.18 -29.87 17.97 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.098 0.959 . . . . 0.0 112.857 176.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.3 tt -41.46 -58.31 1.93 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 127.484 2.314 . . . . 0.0 113.497 -178.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 48.4 p-90 -71.77 -9.9 58.98 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -173.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.06 -60.16 1.9 Allowed 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 116.504 2.039 . . . . 0.0 116.504 -179.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 48.2 mt -120.16 19.72 12.17 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -170.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 CA--C 1.553 1.069 0 C-N-CA 126.045 1.738 . . . . 0.0 114.487 -177.561 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 94.6 mt . . . . . 0 CA--C 1.548 0.894 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 68.4 mmm -65.94 149.73 49.76 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.685 1.13 . . . . 0.0 113.502 -178.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.87 175.72 7.1 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.975 1.71 . . . . 0.0 111.436 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 74.5 p -78.72 151.16 76.68 Favored Pre-proline 0 CA--C 1.544 0.729 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 169.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.58 -12.23 27.2 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.188 2.592 . . . . 0.0 115.136 -179.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -95.55 -18.97 20.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.29 1.036 . . . . 0.0 112.974 177.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.68 -9.97 59.59 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.074 -1.016 . . . . 0.0 112.404 177.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 77.3 mt -54.81 -31.86 25.12 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 125.979 1.712 . . . . 0.0 110.8 175.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -66.09 -10.08 37.13 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.487 1.515 . . . . 0.0 113.544 177.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.1 tm0? -76.75 -33.85 58.09 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.001 -1.062 . . . . 0.0 111.488 177.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 . . . . . 0 N--CA 1.47 0.55 0 CA-C-O 117.918 -1.039 . . . . 0.0 113.124 178.298 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 81.7 mttt . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 119.208 -0.425 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -57.16 -45.6 83.49 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.543 0.737 . . . . 0.0 111.889 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -60.02 -41.8 92.97 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 118.842 0.746 . . . . 0.0 111.725 175.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.17 -40.05 90.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.746 0.819 . . . . 0.0 112.152 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.5 mt -64.0 -52.03 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 119.504 1.047 . . . . 0.0 109.714 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -53.51 -56.95 12.67 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.217 1.007 . . . . 0.0 111.171 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.87 -36.56 84.75 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -69.53 -42.99 73.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.724 1.147 . . . . 0.0 110.656 178.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 8.2 tp -61.51 -40.09 93.36 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.545 0.738 . . . . 0.0 110.395 176.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 95.8 t -60.52 -32.43 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 119.204 0.911 . . . . 0.0 110.929 174.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.8 tp -72.72 -27.58 62.14 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 120.055 1.298 . . . . 0.0 113.306 174.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -61.88 -33.73 74.73 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 120.412 1.46 . . . . 0.0 108.815 173.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.3 mt -68.89 -51.12 43.5 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.174 0.99 . . . . 0.0 110.046 175.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 19.6 t60 -56.79 -55.85 29.09 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.392 177.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -50.8 -45.8 59.47 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -70.19 -35.3 73.84 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 43.9 mttm -77.73 -38.45 47.09 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.22 1.008 . . . . 0.0 111.745 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 49.6 t -60.8 -46.65 89.7 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.47 2.308 . . . . 0.0 109.587 175.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.4 tt0 . . . . . 0 CA--C 1.541 0.632 0 C-N-CA 125.974 1.71 . . . . 0.0 111.062 173.725 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 36.3 m80 . . . . . 0 CA--C 1.536 0.405 0 CA-C-O 117.747 -1.12 . . . . 0.0 113.941 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . 0.322 0.8 OUTLIER -72.81 -35.15 67.28 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 120.326 1.421 . . . . 0.0 111.207 178.1 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -60.21 -40.85 91.6 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.752 1.221 . . . . 0.0 110.611 171.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.9 m -65.11 -55.37 19.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.688 1.195 . . . . 0.0 110.667 176.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.7 mmt -62.78 -39.2 93.46 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.604 0.965 . . . . 0.0 113.604 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -64.7 -29.61 70.6 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 120.794 1.634 . . . . 0.0 113.133 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -72.67 -39.42 67.11 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.01 0.524 . . . . 0.0 110.483 173.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 90.5 t -63.41 -45.83 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.194 0.598 . . . . 0.0 110.188 175.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.92 -42.86 90.69 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.983 1.313 . . . . 0.0 112.104 178.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -63.01 -32.79 74.23 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.224 0.609 . . . . 0.0 112.385 176.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 65.2 t60 -79.61 -49.31 12.36 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.642 0.777 . . . . 0.0 110.768 176.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 31.3 ttp -56.55 -34.04 66.7 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.717 1.607 . . . . 0.0 113.904 -176.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 10.2 t -73.21 -13.06 61.08 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 120.181 1.355 . . . . 0.0 113.085 176.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 58.9 m80 -107.1 -24.79 11.83 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.478 1.511 . . . . 0.0 112.595 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.4 t -61.59 150.06 37.33 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.538 1.535 . . . . 0.0 112.343 178.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -128.89 -8.86 4.93 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.87 1.668 . . . . 0.0 113.641 -179.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.76 -28.22 21.85 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.242 0.928 . . . . 0.0 111.86 178.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.65 -109.66 1.0 Allowed Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.952 1.263 . . . . 0.0 112.761 178.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -60.23 -22.98 63.68 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.155 0.982 . . . . 0.0 113.247 177.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.87 -1.46 49.36 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.296 1.438 . . . . 0.0 113.846 178.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.9 t -61.0 141.97 56.95 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 122.289 1.042 . . . . 0.0 110.62 178.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.8 mm-40 -78.62 -10.54 59.78 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.721 1.208 . . . . 0.0 113.115 -176.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 64.6 t -90.65 114.85 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 124.874 1.27 . . . . 0.0 107.582 174.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.32 -37.0 66.84 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -64.93 -41.63 95.38 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.445 1.098 . . . . 0.0 112.204 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.5 t -67.04 -56.38 10.31 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.594 1.558 . . . . 0.0 109.994 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.57 -26.94 62.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.28 1.032 . . . . 0.0 113.255 178.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 70.8 m -82.33 -47.27 12.55 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.049 0.94 . . . . 0.0 112.124 175.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 60.2 m -62.17 -34.8 77.11 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 121.56 -0.713 . . . . 0.0 111.873 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -59.07 -31.53 68.97 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.338 1.055 . . . . 0.0 112.503 176.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -67.71 -34.14 76.29 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.873 0.869 . . . . 0.0 111.299 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.4 mt -72.23 -46.04 59.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 124.343 1.057 . . . . 0.0 110.035 177.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 19.2 mm -62.57 -39.69 85.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.142 0.977 . . . . 0.0 111.301 176.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 16.5 t -60.39 -26.16 66.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.085 0.954 . . . . 0.0 112.712 177.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.6 t60 -61.54 -57.28 12.73 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.092 0.86 . . . . 0.0 111.159 177.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 59.5 m95 -62.45 -22.56 66.31 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 178.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -79.66 -29.92 41.03 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.509 1.123 . . . . 0.0 112.614 178.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -99.96 -36.32 9.42 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 179.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.4 t -74.04 139.33 44.64 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.354 1.461 . . . . 0.0 111.289 -178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 74.2 p -130.12 -2.84 4.52 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 -177.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -96.09 141.51 29.38 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.227 1.411 . . . . 0.0 112.647 -177.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -74.34 -34.4 63.41 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 121.728 -0.607 . . . . 0.0 111.819 176.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 36.7 t0 -90.89 79.34 5.93 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.718 1.607 . . . . 0.0 111.038 178.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.4 t -135.13 137.43 26.85 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 127.106 2.162 . . . . 0.0 109.124 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -56.72 -26.54 66.27 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.858 2.372 . . . . 0.0 114.604 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.8 t -92.24 -51.65 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-N 119.783 1.174 . . . . 0.0 111.604 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 6.1 m -69.63 -39.72 76.97 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 -174.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 1.6 tt -56.24 -55.91 37.0 Favored Pre-proline 0 CA--C 1.546 0.823 0 CA-C-O 117.578 -1.201 . . . . 0.0 112.903 -177.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.18 -32.49 94.56 Favored 'Trans proline' 0 C--N 1.354 0.848 0 CA-C-N 121.845 1.695 . . . . 0.0 113.169 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 98.4 mt -69.31 -46.19 67.72 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.001 0.819 . . . . 0.0 111.47 177.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 48.7 mttm -62.63 -41.89 99.28 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.026 0.93 . . . . 0.0 110.472 176.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.0 t30 -63.71 -39.19 93.7 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.274 1.429 . . . . 0.0 112.252 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.74 0 C-N-CA 124.325 1.05 . . . . 0.0 113.662 178.576 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.477 0.883 0 CA-C-O 119.698 -0.191 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -60.17 -25.76 65.79 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 175.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 45.3 m -75.05 -31.89 61.4 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.378 -0.826 . . . . 0.0 112.642 177.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -90.06 -25.45 20.78 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.62 1.168 . . . . 0.0 112.902 175.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.9 tt -45.51 -60.01 2.41 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 127.451 2.3 . . . . 0.0 113.87 -178.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.2 p-90 -70.08 -8.36 48.76 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -173.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 10.2 ptmm? -112.15 -56.0 2.45 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 4.2 mp -120.12 16.88 12.44 Favored 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 117.055 2.243 . . . . 0.0 117.055 -176.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.9 tt . . . . . 0 N--CA 1.48 1.044 0 O-C-N 120.473 -1.392 . . . . 0.0 113.802 179.27 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 28.3 tp . . . . . 0 CA--C 1.552 1.027 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.4 tpt -62.75 145.52 54.64 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -175.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.89 149.29 47.71 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 128.251 2.621 . . . . 0.0 109.682 177.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 24.2 m -71.51 134.41 84.4 Favored Pre-proline 0 N--CA 1.474 0.737 0 CA-C-O 118.327 -0.844 . . . . 0.0 110.966 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -55.39 -28.8 65.19 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.002 2.468 . . . . 0.0 116.085 -176.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -70.72 -15.25 62.68 Favored 'General case' 0 CA--C 1.55 0.954 0 O-C-N 120.912 -1.118 . . . . 0.0 113.196 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.1 t70 -89.76 -9.83 47.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.243 1.817 . . . . 0.0 113.13 178.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 72.7 mt -52.56 -34.35 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 125.045 1.338 . . . . 0.0 111.33 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -67.44 -9.73 44.64 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.562 1.145 . . . . 0.0 113.697 177.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -75.65 -20.2 58.64 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 120.928 -1.108 . . . . 0.0 111.109 175.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.54 0.591 0 CA-C-N 119.022 0.828 . . . . 0.0 109.876 178.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 30.1 mtpp . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 77.9 mtm-85 -60.68 -39.27 87.82 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.868 0.867 . . . . 0.0 112.619 179.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -63.58 -27.87 69.54 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 86.3 mt -70.26 -37.71 74.96 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.176 0.59 . . . . 0.0 110.593 175.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.5 mt -62.1 -51.81 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 175.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -54.57 -54.01 46.98 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.966 0.906 . . . . 0.0 111.016 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -36.17 83.12 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.164 0.893 . . . . 0.0 113.352 -178.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -71.74 -44.15 64.59 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.888 0.767 . . . . 0.0 110.96 179.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 12.3 tp -63.76 -38.35 90.79 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.569 0.747 . . . . 0.0 110.784 177.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 87.8 t -61.87 -32.27 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 CA-C-N 119.735 1.152 . . . . 0.0 110.619 174.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 15.6 tp -69.53 -34.98 75.02 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 120.762 -1.211 . . . . 0.0 111.608 174.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.4 mp -59.14 -26.14 64.48 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 120.11 1.323 . . . . 0.0 110.271 174.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 4.0 mt -77.5 -53.25 7.84 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.289 -0.882 . . . . 0.0 109.933 176.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.6 t60 -54.93 -52.93 61.42 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.13 0.572 . . . . 0.0 110.226 177.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -58.19 -22.78 53.04 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.79 1.236 . . . . 0.0 113.968 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -90.07 -29.42 18.37 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.157 -0.964 . . . . 0.0 113.417 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 31.9 mttp -86.07 -34.67 20.62 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.682 1.193 . . . . 0.0 112.623 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 20.2 t -63.92 -44.83 91.72 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.277 1.831 . . . . 0.0 110.946 177.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.0 pt20 . . . . . 0 CA--C 1.546 0.825 0 O-C-N 120.797 -1.19 . . . . 0.0 111.819 174.178 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 7.6 m170 . . . . . 0 N--CA 1.47 0.573 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 33.6 t -62.44 -49.07 76.91 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.024 1.329 . . . . 0.0 109.716 177.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -55.41 -36.99 67.06 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.933 1.293 . . . . 0.0 111.813 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.6 m -70.67 -56.52 6.26 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.887 0.875 . . . . 0.0 111.772 176.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 14.6 mmt -65.07 -32.71 74.56 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -65.51 -32.21 73.69 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 120.753 1.615 . . . . 0.0 112.303 178.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -72.47 -38.55 68.18 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.534 0.734 . . . . 0.0 110.449 174.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 77.0 t -62.22 -47.24 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.277 0.631 . . . . 0.0 110.327 175.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.57 -45.11 95.15 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.878 0.871 . . . . 0.0 111.708 178.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -67.83 -21.22 65.21 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.2 t60 -83.86 -49.39 9.07 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 118.803 0.729 . . . . 0.0 109.339 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.0 ttp -57.55 -27.92 63.07 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.189 1.796 . . . . 0.0 113.778 -177.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 17.2 p -70.75 -30.35 66.83 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 119.507 1.049 . . . . 0.0 112.244 174.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 84.1 t60 -92.39 -27.08 17.73 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.831 1.652 . . . . 0.0 112.835 178.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 14.2 t -63.13 153.02 35.63 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.853 1.661 . . . . 0.0 112.776 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -133.15 -7.24 3.02 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.555 1.542 . . . . 0.0 114.23 -179.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -90.55 -22.85 21.09 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.385 0.993 . . . . 0.0 113.012 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.3 -116.61 5.91 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.448 1.023 . . . . 0.0 112.354 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 58.1 tptt -56.4 -24.3 43.91 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.774 1.23 . . . . 0.0 113.211 176.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.48 -1.86 57.41 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.576 1.151 . . . . 0.0 114.043 178.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 20.0 t -62.66 141.88 58.33 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.112 0.958 . . . . 0.0 110.586 178.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.7 mm-40 -78.09 -9.4 59.13 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.592 1.157 . . . . 0.0 113.163 -176.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 99.3 t -91.87 114.56 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 173.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.85 -42.99 72.68 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -64.42 -37.88 89.09 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.866 0.866 . . . . 0.0 112.945 -178.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 29.7 t -65.86 -59.59 3.71 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.508 1.523 . . . . 0.0 110.378 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.13 -30.86 64.77 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.874 0.87 . . . . 0.0 112.58 178.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.3 m -75.52 -50.63 15.08 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.757 0.823 . . . . 0.0 112.486 176.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 63.6 m -60.04 -36.39 77.18 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.663 -0.648 . . . . 0.0 111.801 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 48.2 tpt85 -59.81 -29.54 68.31 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.849 0.86 . . . . 0.0 113.047 177.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -70.29 -30.06 66.97 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.72 0.808 . . . . 0.0 111.245 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 6.6 mt -73.45 -44.63 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.168 0.987 . . . . 0.0 109.221 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 24.0 mm -58.71 -39.18 75.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 123.86 0.864 . . . . 0.0 109.887 174.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 4.1 t -60.72 -28.56 68.76 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.037 0.935 . . . . 0.0 113.054 176.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.1 t60 -61.76 -55.25 32.15 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.404 1.002 . . . . 0.0 110.44 177.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 44.2 m95 -61.69 -30.65 70.88 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 178.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -70.29 -27.95 64.81 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.703 0.801 . . . . 0.0 112.703 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -100.05 -38.98 8.34 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 179.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.8 t -75.62 137.66 40.9 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.796 1.638 . . . . 0.0 112.862 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 68.2 p -129.97 4.11 4.89 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.692 1.597 . . . . 0.0 114.045 -178.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 69.8 mtm180 -82.1 158.5 23.69 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.126 1.37 . . . . 0.0 113.551 -178.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 23.9 t60 -95.88 -40.22 9.42 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.34 1.056 . . . . 0.0 109.84 170.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.6 t0 -92.79 69.99 4.73 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.7 1.6 . . . . 0.0 111.655 178.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 52.7 t -123.27 133.65 24.67 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 126.653 1.981 . . . . 0.0 108.412 177.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -59.01 -25.61 78.44 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.709 2.273 . . . . 0.0 114.425 -176.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 6.3 t -92.13 -50.29 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 119.519 1.054 . . . . 0.0 111.649 176.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.4 m -68.86 -41.32 78.58 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -175.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.9 tt -50.75 -57.18 14.31 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.472 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -61.3 -31.77 89.42 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.021 1.814 . . . . 0.0 113.591 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 89.7 mt -70.87 -46.44 62.63 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.76 0.824 . . . . 0.0 111.676 178.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -62.26 -36.74 82.97 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.155 0.982 . . . . 0.0 110.397 176.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 13.9 t30 -69.92 -38.32 76.19 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.29 1.436 . . . . 0.0 112.448 175.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 113.777 1.028 . . . . 0.0 113.777 179.562 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 61.4 m . . . . . 0 N--CA 1.474 0.77 0 CA-C-O 119.419 -0.324 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -60.03 -21.94 62.0 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.504 0.928 . . . . 0.0 113.504 178.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 21.3 t -79.0 -33.65 44.77 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.32 1.048 . . . . 0.0 112.646 178.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 36.4 t70 -89.77 -26.5 20.57 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.838 0.855 . . . . 0.0 112.104 175.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.7 tt -45.82 -60.06 2.45 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 127.176 2.191 . . . . 0.0 113.367 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.2 p-90 -68.91 -8.96 49.07 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -172.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -111.89 -58.51 2.12 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 -178.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 58.0 mt -120.05 16.29 12.46 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -171.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.6 tt . . . . . 0 CA--C 1.551 0.989 0 C-N-CA 124.915 1.286 . . . . 0.0 113.046 179.977 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 83.8 mt . . . . . 0 CA--C 1.551 1.019 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.24 151.61 46.64 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -175.154 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 95.9 mt -125.19 170.28 11.4 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.778 2.831 . . . . 0.0 113.504 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.7 m -90.8 150.43 42.14 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 169.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -53.72 -25.1 32.75 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.069 2.512 . . . . 0.0 115.651 -178.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.8 t70 -69.87 -24.08 63.37 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.891 0.876 . . . . 0.0 112.889 178.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -76.17 -18.04 59.28 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.86 0.864 . . . . 0.0 112.361 178.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 93.3 mt -59.5 -34.02 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.59 0.756 . . . . 0.0 109.322 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -71.18 -9.87 58.8 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -84.15 -29.77 26.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.93 0.892 . . . . 0.0 111.521 176.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.3 p-90 . . . . . 0 CA--C 1.542 0.656 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 176.619 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 80.6 tttt . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 119.64 -0.219 . . . . 0.0 111.581 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 70.2 mtp180 -62.38 -41.49 98.68 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.779 0.832 . . . . 0.0 111.122 174.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -59.59 -33.04 70.96 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.065 0.946 . . . . 0.0 112.103 179.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 83.6 mt -65.67 -40.56 92.52 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.963 0.801 . . . . 0.0 112.018 178.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.1 mt -68.35 -51.19 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-N 118.342 0.519 . . . . 0.0 109.677 176.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -55.13 -54.41 43.58 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.576 1.15 . . . . 0.0 110.889 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -34.99 79.49 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.148 -0.97 . . . . 0.0 113.168 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -68.67 -48.99 62.54 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.092 0.86 . . . . 0.0 109.655 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 16.8 tp -59.82 -43.93 94.28 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.425 0.69 . . . . 0.0 111.413 177.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 61.0 t -61.43 -24.98 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 O-C-N 120.64 -1.288 . . . . 0.0 111.331 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 3.7 tp -79.81 -26.09 40.64 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.289 1.404 . . . . 0.0 112.408 172.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.5 mp -60.84 -45.27 95.15 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 120.596 1.544 . . . . 0.0 107.367 170.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.2 mp -61.41 -50.59 72.22 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.307 1.043 . . . . 0.0 111.102 175.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 31.0 t60 -55.61 -57.3 12.54 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.424 1.011 . . . . 0.0 110.285 177.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.59 -30.93 63.76 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.549 1.14 . . . . 0.0 114.032 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 43.1 t60 -75.48 -38.63 59.44 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.522 -0.736 . . . . 0.0 112.04 176.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 42.7 mttm -79.81 -33.62 40.26 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.521 1.128 . . . . 0.0 111.853 -179.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 13.6 t -63.26 -44.77 94.21 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 127.406 2.283 . . . . 0.0 111.677 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.6 pt20 . . . . . 0 N--CA 1.475 0.807 0 O-C-N 120.726 -1.234 . . . . 0.0 111.727 174.64 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 35.3 m80 . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 53.2 t -68.17 -51.03 50.35 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.813 1.245 . . . . 0.0 108.858 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 43.2 ttp-105 -54.42 -39.65 67.53 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.11 1.364 . . . . 0.0 111.283 173.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.2 m -65.43 -56.57 11.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.523 1.129 . . . . 0.0 111.394 176.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 19.9 mmt -66.45 -34.54 78.17 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -177.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -65.44 -32.25 73.77 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 120.88 1.673 . . . . 0.0 112.286 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -70.62 -39.71 73.56 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.034 0.534 . . . . 0.0 110.491 174.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 71.5 t -63.77 -46.9 93.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.261 0.625 . . . . 0.0 111.025 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.5 -43.38 93.37 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.647 0.779 . . . . 0.0 111.259 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -68.32 -18.09 64.42 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 176.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 66.6 t60 -88.03 -49.82 6.8 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.535 0.734 . . . . 0.0 109.432 173.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 27.2 ttp -57.15 -27.86 62.25 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.151 1.781 . . . . 0.0 113.616 -178.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 11.4 p -69.37 -26.52 64.7 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 121.114 -0.991 . . . . 0.0 112.641 175.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 68.8 m80 -104.32 -18.65 14.36 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.111 1.765 . . . . 0.0 113.947 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.0 t -62.84 150.77 40.84 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.282 1.433 . . . . 0.0 112.517 -179.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -121.52 -14.79 8.16 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.846 1.658 . . . . 0.0 113.743 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -97.29 -29.33 13.61 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.339 1.056 . . . . 0.0 112.598 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.92 -110.24 1.22 Allowed Glycine 0 CA--C 1.535 1.308 0 C-N-CA 124.484 1.04 . . . . 0.0 113.41 177.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -60.76 -20.27 60.98 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.095 -1.238 . . . . 0.0 113.3 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.49 -0.49 43.28 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.858 1.663 . . . . 0.0 113.588 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.7 t -63.7 142.46 58.39 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 122.106 0.955 . . . . 0.0 110.284 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -81.87 -3.2 53.52 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 86.2 t -89.75 115.81 30.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 173.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.42 -37.29 67.46 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -71.11 -27.36 63.53 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.125 0.97 . . . . 0.0 113.231 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 43.0 t -78.18 -56.86 4.13 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.6 1.56 . . . . 0.0 110.044 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.52 -27.69 66.41 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 179.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 16.2 p -77.18 -50.37 13.1 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.394 -0.816 . . . . 0.0 111.587 175.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 57.9 m -61.65 -36.37 80.59 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.524 -0.735 . . . . 0.0 112.55 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -61.1 -31.72 71.4 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 121.664 -0.647 . . . . 0.0 112.655 177.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -66.22 -29.94 70.29 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.018 0.826 . . . . 0.0 111.465 175.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.8 mt -76.29 -46.85 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 124.455 1.102 . . . . 0.0 109.807 176.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 33.3 mm -58.48 -36.91 61.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.157 0.983 . . . . 0.0 110.522 175.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 68.9 m -63.95 -21.38 66.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.358 1.063 . . . . 0.0 113.395 177.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.9 t60 -66.15 -57.45 7.62 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.88 1.218 . . . . 0.0 110.843 178.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 43.9 m95 -61.67 -21.25 64.27 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 177.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 92.8 mttt -79.38 -28.38 41.9 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.5 1.12 . . . . 0.0 112.713 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -100.13 -42.89 6.52 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.883 1.273 . . . . 0.0 113.697 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 12.7 t -81.39 133.2 35.38 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.463 1.905 . . . . 0.0 111.652 -178.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.9 p -130.04 -5.18 4.46 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -179.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 74.7 mtp85 -67.15 156.14 36.97 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.1 1.76 . . . . 0.0 114.18 -178.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -85.19 -34.05 22.15 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.846 0.858 . . . . 0.0 111.394 173.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 18.4 t0 -104.45 86.36 2.5 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.727 2.011 . . . . 0.0 111.278 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.0 t -136.5 137.0 22.89 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 126.572 1.949 . . . . 0.0 109.604 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -56.21 -29.11 74.33 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.386 2.724 . . . . 0.0 114.632 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 20.1 t -92.24 -54.86 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 CA-C-N 119.276 0.944 . . . . 0.0 111.934 175.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 9.7 m -66.39 -37.64 85.71 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -173.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.29 -57.98 17.48 Favored Pre-proline 0 CA--C 1.548 0.901 0 CA-C-N 120.046 1.294 . . . . 0.0 112.743 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.0 -29.03 87.18 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 121.806 1.671 . . . . 0.0 113.497 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 92.0 mt -70.44 -44.04 68.65 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.555 1.07 . . . . 0.0 111.482 177.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -62.32 -36.51 82.39 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 118.38 0.536 . . . . 0.0 110.766 175.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.0 t30 -69.21 -36.18 76.99 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 124.706 1.202 . . . . 0.0 112.349 176.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.706 0 C-N-CA 125.071 1.349 . . . . 0.0 114.203 178.767 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 22.8 m . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 119.399 -0.334 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.24 -30.66 69.56 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.754 0.706 . . . . 0.0 112.299 175.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 43.6 m -71.4 -31.37 67.19 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 31.7 t70 -90.11 -28.06 19.22 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.983 1.313 . . . . 0.0 113.391 176.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.5 tt -42.99 -59.99 1.8 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 127.335 2.254 . . . . 0.0 113.347 -177.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.3 p-90 -69.22 -9.43 52.99 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 -174.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -111.98 -59.88 1.93 Allowed 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -178.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 45.8 mt -120.25 20.25 12.02 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -171.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.7 tt . . . . . 0 CA--C 1.555 1.157 0 C-N-CA 125.764 1.626 . . . . 0.0 114.425 -177.211 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 25.3 tp . . . . . 0 CA--C 1.553 1.082 0 CA-C-O 120.765 0.317 . . . . 0.0 111.558 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.9 tpt -65.1 141.72 58.62 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 -175.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.5 tt -125.05 148.52 48.47 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.438 2.295 . . . . 0.0 111.75 -176.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 43.3 t -72.63 138.88 80.45 Favored Pre-proline 0 N--CA 1.474 0.755 0 C-N-CA 124.101 0.961 . . . . 0.0 111.383 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -57.15 -26.5 69.69 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 122.659 2.239 . . . . 0.0 114.71 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.6 t70 -69.3 -21.35 63.87 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 121.452 -0.78 . . . . 0.0 112.658 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 19.1 t70 -89.97 -9.89 47.07 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.809 1.644 . . . . 0.0 113.699 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 63.0 mt -51.63 -38.42 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 125.031 1.332 . . . . 0.0 111.244 177.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -67.16 -9.74 43.08 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.233 1.413 . . . . 0.0 113.611 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -78.32 -29.63 47.78 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.032 -1.042 . . . . 0.0 111.661 175.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.2 p-90 . . . . . 0 N--CA 1.473 0.714 0 CA-C-O 118.247 -0.882 . . . . 0.0 112.186 176.836 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 48.5 tptt . . . . . 0 N--CA 1.469 0.487 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.96 -41.29 11.83 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.666 1.587 . . . . 0.0 110.668 175.006 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.6 mtpt -59.4 -34.16 72.11 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.243 1.017 . . . . 0.0 112.257 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 54.7 mt -62.46 -37.82 87.41 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.332 0.969 . . . . 0.0 111.932 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.9 mt -67.82 -51.82 46.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.709 0.804 . . . . 0.0 109.552 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -54.75 -55.07 33.86 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.656 1.182 . . . . 0.0 111.032 178.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -34.84 78.85 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -177.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -69.35 -45.41 69.46 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.074 0.852 . . . . 0.0 110.518 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 7.2 tp -62.71 -39.36 93.81 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.365 0.666 . . . . 0.0 111.146 178.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 71.7 t -60.51 -31.99 50.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 119.656 1.116 . . . . 0.0 110.987 175.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 7.9 tp -72.62 -28.55 62.82 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 120.714 -1.241 . . . . 0.0 112.299 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.35 -28.54 70.07 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 120.403 1.456 . . . . 0.0 110.178 174.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 1.9 mt -74.15 -51.34 15.87 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.96 0.904 . . . . 0.0 108.772 175.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 20.4 t60 -55.3 -54.77 39.41 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.512 0.725 . . . . 0.0 111.167 177.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.43 -23.16 36.63 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -178.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -90.06 -38.02 13.87 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.274 -0.891 . . . . 0.0 112.318 174.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 52.1 mttm -78.34 -25.04 46.28 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.607 1.563 . . . . 0.0 113.467 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 50.8 t -77.9 -53.48 7.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.418 2.287 . . . . 0.0 111.9 178.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.9 pt20 . . . . . 0 N--CA 1.478 0.967 0 O-C-N 121.185 -0.947 . . . . 0.0 112.518 177.584 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 70.5 m80 . . . . . 0 CA--C 1.54 0.589 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 51.2 t -69.44 -52.61 25.18 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.023 1.329 . . . . 0.0 108.518 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -54.78 -34.81 63.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.378 1.471 . . . . 0.0 111.602 174.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 21.4 m -71.08 -59.02 3.01 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.779 1.231 . . . . 0.0 111.591 176.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.0 mmt -62.97 -33.68 75.9 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -64.99 -32.64 74.46 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 120.81 1.641 . . . . 0.0 112.482 177.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -72.79 -38.15 67.35 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.233 0.613 . . . . 0.0 110.452 174.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 96.0 t -63.47 -46.87 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.491 0.587 . . . . 0.0 110.456 176.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -46.47 85.93 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.04 0.836 . . . . 0.0 111.136 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -66.36 -19.52 65.83 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 177.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 65.3 t60 -86.61 -49.38 7.57 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.089 0.858 . . . . 0.0 109.49 173.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 34.9 ttp -57.01 -28.99 62.97 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.445 1.898 . . . . 0.0 113.59 -177.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 16.3 p -70.29 -27.93 64.79 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.954 0.902 . . . . 0.0 112.738 175.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 73.1 m80 -101.62 -18.24 15.98 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.762 1.625 . . . . 0.0 113.906 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 16.8 t -61.5 155.24 22.48 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.183 1.393 . . . . 0.0 112.562 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -126.7 -12.23 6.04 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.782 1.633 . . . . 0.0 113.702 -178.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -96.52 -27.67 14.75 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.351 1.06 . . . . 0.0 112.051 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.23 -114.41 4.19 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.777 1.18 . . . . 0.0 113.406 177.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -62.13 -16.38 52.2 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 121.325 -1.103 . . . . 0.0 113.444 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.24 -0.51 43.93 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.342 1.457 . . . . 0.0 113.382 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.6 t -60.32 142.61 54.51 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 122.403 1.097 . . . . 0.0 110.634 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.0 mm-40 -77.86 -9.44 59.06 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.696 1.198 . . . . 0.0 113.015 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 99.8 t -88.58 115.22 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.6 -41.76 66.97 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -65.76 -41.49 92.03 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.505 0.722 . . . . 0.0 112.884 -179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 41.1 t -61.35 -56.4 20.82 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.718 1.207 . . . . 0.0 110.665 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.42 -30.97 69.96 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.293 0.637 . . . . 0.0 112.632 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 74.7 m -71.64 -51.05 25.15 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.981 0.912 . . . . 0.0 111.161 176.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 33.6 m -58.38 -36.61 73.77 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.952 0.901 . . . . 0.0 112.146 176.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.24 -30.46 71.12 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 118.092 -0.956 . . . . 0.0 113.179 175.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -69.11 -27.46 65.6 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.664 1.12 . . . . 0.0 110.828 176.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.3 mm -74.29 -48.41 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.772 0.829 . . . . 0.0 109.58 175.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 20.2 mm -59.14 -40.56 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.403 1.081 . . . . 0.0 110.714 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 49.9 m -62.14 -22.25 65.71 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.961 0.904 . . . . 0.0 113.068 177.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.3 t60 -66.52 -56.95 8.47 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.514 1.052 . . . . 0.0 109.966 176.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 42.9 m95 -61.47 -32.66 72.67 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.273 0.942 . . . . 0.0 112.966 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -65.45 -28.55 69.31 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.352 -0.843 . . . . 0.0 112.948 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -100.02 -50.02 4.13 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.776 1.23 . . . . 0.0 114.271 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 11.1 t -79.87 132.21 36.04 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.629 1.972 . . . . 0.0 112.525 -176.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 4.4 t -130.14 -2.36 4.54 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.2 1.4 . . . . 0.0 113.872 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 83.5 mtt-85 -69.51 145.74 52.43 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.94 1.296 . . . . 0.0 113.478 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 85.0 t60 -79.79 -34.72 39.41 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 169.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -86.5 69.95 10.42 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.764 1.625 . . . . 0.0 112.14 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.7 t -136.28 133.06 19.24 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 126.055 1.742 . . . . 0.0 109.743 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -58.83 -25.07 75.05 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 122.86 2.373 . . . . 0.0 114.149 -178.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 17.6 t -92.17 -51.66 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 119.28 0.945 . . . . 0.0 111.961 176.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.4 m -71.28 -35.66 71.42 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -174.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.37 -56.56 25.21 Favored Pre-proline 0 N--CA 1.474 0.749 0 CA-C-N 119.773 1.169 . . . . 0.0 113.204 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -60.52 -33.49 93.74 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.032 1.821 . . . . 0.0 113.089 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 94.9 mt -68.4 -45.56 72.34 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.973 0.806 . . . . 0.0 111.565 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 55.4 mttm -61.94 -45.01 95.57 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.911 0.884 . . . . 0.0 109.834 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 19.2 t30 -61.38 -40.9 96.04 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.938 1.295 . . . . 0.0 112.411 176.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.731 0 C-N-CA 124.468 1.107 . . . . 0.0 113.935 179.027 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 87.1 m . . . . . 0 N--CA 1.475 0.802 0 CA-C-O 119.412 -0.327 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -60.21 -31.85 70.55 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 49.9 m -68.45 -34.52 76.11 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.76 0.709 . . . . 0.0 112.804 178.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.1 t70 -90.3 -24.32 20.92 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 174.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.6 tt -46.09 -60.08 2.49 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.233 1.813 . . . . 0.0 113.588 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 51.0 p-90 -65.11 -10.24 29.08 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -173.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 58.4 pttt -111.97 -53.46 2.7 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 6.2 mp -120.16 20.03 12.11 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 116.774 2.138 . . . . 0.0 116.774 -175.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.217 0 O-C-N 120.223 -1.548 . . . . 0.0 114.885 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 27.4 tp . . . . . 0 CA--C 1.555 1.159 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 10.8 tpt -70.95 147.87 48.27 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 14.5 mt -118.81 160.9 21.06 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.852 1.661 . . . . 0.0 113.144 -178.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 43.3 t -71.71 145.0 89.13 Favored Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 169.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -58.19 -14.76 20.65 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 123.095 2.53 . . . . 0.0 116.357 -175.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -72.93 -22.99 60.64 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.32 -0.862 . . . . 0.0 112.886 177.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 14.9 t70 -84.8 -10.08 57.55 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.406 1.082 . . . . 0.0 113.006 178.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 91.7 mt -56.59 -34.94 43.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.569 1.148 . . . . 0.0 110.584 176.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -73.45 -9.89 59.16 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.819 1.248 . . . . 0.0 113.641 178.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -84.33 -24.61 29.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.067 0.947 . . . . 0.0 112.773 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.471 0.613 0 CA-C-N 119.476 1.034 . . . . 0.0 111.756 -179.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 20.7 tptm . . . . . 0 N--CA 1.472 0.661 0 N-CA-C 111.501 0.185 . . . . 0.0 111.501 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 78.4 mtm180 -76.76 -43.96 34.92 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.088 1.355 . . . . 0.0 111.311 175.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -56.72 -35.22 68.3 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.252 1.021 . . . . 0.0 112.111 175.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 57.3 mt -59.63 -37.94 80.01 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.202 0.91 . . . . 0.0 112.016 177.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -67.1 -54.59 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 118.703 0.683 . . . . 0.0 109.245 175.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -52.71 -51.75 59.1 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.462 1.105 . . . . 0.0 112.011 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -35.17 78.63 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.338 -0.851 . . . . 0.0 113.178 -179.087 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -71.41 -42.54 68.17 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.569 1.077 . . . . 0.0 109.693 178.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.5 tt -61.81 -44.44 96.86 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.706 1.602 . . . . 0.0 110.723 178.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 89.1 t -61.81 -26.64 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 O-C-N 120.589 -1.32 . . . . 0.0 110.904 174.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.78 -27.53 58.04 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 120.465 -1.397 . . . . 0.0 111.939 173.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.7 mp -61.14 -41.17 96.24 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.478 1.49 . . . . 0.0 107.878 169.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.84 -48.72 73.31 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.503 -0.76 . . . . 0.0 111.074 176.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 15.3 t60 -55.13 -52.47 63.18 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.033 0.833 . . . . 0.0 109.743 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -60.08 -24.34 64.52 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -178.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -88.26 -29.03 20.72 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.16 0.891 . . . . 0.0 112.467 175.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 59.7 mttm -85.37 -39.56 17.47 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.52 1.528 . . . . 0.0 113.084 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.8 t -60.62 -44.6 96.16 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.362 1.865 . . . . 0.0 110.755 176.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.4 pt20 . . . . . 0 CA--C 1.547 0.845 0 O-C-N 121.415 -0.803 . . . . 0.0 112.069 174.805 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 44.8 m80 . . . . . 0 N--CA 1.469 0.486 0 CA-C-O 118.748 -0.644 . . . . 0.0 112.286 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.0 t -65.12 -51.16 62.93 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.847 0.748 . . . . 0.0 109.174 174.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -53.6 -34.3 57.93 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.064 1.346 . . . . 0.0 111.972 174.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 52.7 m -73.6 -61.06 1.97 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.162 0.985 . . . . 0.0 111.679 176.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 21.9 mmm -64.28 -30.21 71.27 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 -175.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -65.31 -34.34 78.1 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 120.727 1.603 . . . . 0.0 112.084 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -70.8 -37.27 73.26 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.41 0.684 . . . . 0.0 110.353 175.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 90.3 t -64.6 -48.63 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.578 0.751 . . . . 0.0 110.379 176.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.13 -43.57 91.99 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.976 0.911 . . . . 0.0 111.703 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -68.66 -17.13 64.03 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 177.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 72.0 t60 -90.13 -50.84 5.77 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.727 1.211 . . . . 0.0 109.997 174.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 38.7 ttp -57.31 -26.46 60.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.581 1.953 . . . . 0.0 113.513 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 2.8 p -60.31 -35.45 75.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.803 1.241 . . . . 0.0 112.886 176.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -111.94 -10.2 13.98 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.86 1.264 . . . . 0.0 114.322 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 43.4 t -63.55 129.85 41.91 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.105 0.866 . . . . 0.0 111.434 178.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -101.05 -16.12 17.21 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.103 1.361 . . . . 0.0 114.072 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.31 -31.13 20.36 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.024 0.829 . . . . 0.0 111.758 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.36 -110.77 1.48 Allowed Glycine 0 CA--C 1.532 1.114 0 C-N-CA 124.494 1.045 . . . . 0.0 112.94 178.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.53 -20.39 60.13 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 121.384 -1.068 . . . . 0.0 113.187 177.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -96.54 -2.36 45.21 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.621 1.568 . . . . 0.0 113.567 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.7 t -62.5 142.38 57.96 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.145 0.974 . . . . 0.0 110.011 177.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -81.62 -5.28 57.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.254 1.022 . . . . 0.0 113.565 -176.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.0 t -89.22 115.44 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.91 -43.56 73.37 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -62.63 -38.19 89.27 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.509 0.724 . . . . 0.0 112.872 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.6 t -67.13 -57.74 6.21 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.488 1.515 . . . . 0.0 110.165 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -55.21 -36.39 65.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.033 0.933 . . . . 0.0 112.439 178.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 13.1 m -69.95 -51.56 31.7 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 124.045 0.938 . . . . 0.0 112.394 175.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 70.2 m -61.09 -37.35 82.43 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.19 -0.944 . . . . 0.0 112.066 -179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.41 -33.78 68.23 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.141 0.976 . . . . 0.0 112.165 176.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -67.46 -31.02 70.89 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.934 0.893 . . . . 0.0 112.057 177.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.5 mt -77.46 -45.33 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-N 118.514 0.597 . . . . 0.0 110.01 176.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 28.5 mm -58.37 -38.58 70.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.832 0.853 . . . . 0.0 110.011 176.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 67.9 m -62.23 -24.98 67.56 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.17 0.988 . . . . 0.0 113.222 176.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.1 t60 -64.81 -55.88 16.91 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.836 1.198 . . . . 0.0 109.526 176.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 48.4 m95 -59.27 -33.48 71.1 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 178.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -68.41 -30.14 68.99 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 177.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -100.09 -34.86 9.89 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.5 t -75.86 131.58 39.79 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.41 1.484 . . . . 0.0 112.95 -175.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 67.7 p -130.07 0.6 4.72 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 126.022 1.729 . . . . 0.0 113.421 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 47.6 ttt85 -74.73 135.67 41.79 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.79 1.636 . . . . 0.0 111.22 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 43.2 p-80 -75.33 -36.6 61.01 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 121.897 -0.502 . . . . 0.0 112.166 178.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -101.74 69.98 1.23 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.546 1.538 . . . . 0.0 112.462 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 44.7 t -114.62 132.79 22.71 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 126.546 1.938 . . . . 0.0 108.427 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -59.12 -26.17 80.69 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.899 2.4 . . . . 0.0 115.03 -176.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 41.8 t -92.22 -49.59 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-N 119.232 0.923 . . . . 0.0 111.601 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 13.0 m -68.88 -43.99 74.16 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.297 1.221 . . . . 0.0 114.297 -176.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.1 tt -53.21 -56.57 22.77 Favored Pre-proline 0 CA--C 1.548 0.877 0 CA-C-O 117.891 -1.052 . . . . 0.0 113.105 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -60.95 -32.68 92.72 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 121.873 1.716 . . . . 0.0 113.188 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 92.6 mt -70.16 -44.06 69.57 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.215 0.916 . . . . 0.0 111.637 177.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -60.44 -37.71 81.81 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.496 1.119 . . . . 0.0 110.731 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 17.3 t30 -73.43 -41.32 63.41 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.653 1.581 . . . . 0.0 113.087 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.664 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -177.912 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 9.6 t . . . . . 0 CA--C 1.536 0.432 0 CA-C-O 118.582 -0.723 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -50.73 -31.95 18.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.089 1.356 . . . . 0.0 112.998 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 26.9 m -72.58 -30.84 64.74 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.932 0.893 . . . . 0.0 113.153 178.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 30.8 t70 -90.28 -30.15 17.69 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.53 1.532 . . . . 0.0 113.277 174.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 1.8 tt -45.68 -60.03 2.43 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 128.276 2.63 . . . . 0.0 112.969 -175.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.4 p-90 -63.33 -13.85 43.4 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -174.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -112.07 -52.33 2.79 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 117.557 2.428 . . . . 0.0 117.557 -177.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 69.8 mt -120.03 20.46 12.11 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 116.319 1.97 . . . . 0.0 116.319 -169.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 12.9 tp . . . . . 0 CA--C 1.549 0.931 0 N-CA-C 115.911 1.819 . . . . 0.0 115.911 -172.923 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 21.7 tp . . . . . 0 CA--C 1.554 1.122 0 CA-C-O 121.059 0.457 . . . . 0.0 111.641 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.8 tpt -70.25 143.97 51.97 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 116.369 1.988 . . . . 0.0 116.369 -174.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 71.2 mt -125.02 153.15 43.27 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 127.015 2.126 . . . . 0.0 113.63 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 37.0 p -81.61 161.91 59.91 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 123.454 0.702 . . . . 0.0 110.075 171.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -59.67 -21.35 62.5 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.468 2.112 . . . . 0.0 114.869 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -76.66 -22.04 54.58 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.727 0.811 . . . . 0.0 113.099 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -80.18 -19.4 47.19 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.751 0.82 . . . . 0.0 112.664 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 64.7 mt -55.03 -38.07 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.869 1.668 . . . . 0.0 111.57 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.82 -9.87 48.11 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -82.88 -26.75 31.26 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.943 0.897 . . . . 0.0 112.36 177.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.273 4.2 p-90 . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 58.5 mtpt . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 112.43 0.529 . . . . 0.0 112.43 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -76.28 -43.27 42.44 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.794 0.838 . . . . 0.0 111.285 175.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -61.86 -36.07 80.15 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.898 0.879 . . . . 0.0 111.892 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 64.3 mt -68.87 -38.45 79.73 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.659 1.184 . . . . 0.0 111.259 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 48.4 mt -61.76 -50.65 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 118.858 0.754 . . . . 0.0 109.257 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -56.01 -54.73 41.37 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.593 0.757 . . . . 0.0 111.039 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -35.21 80.3 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -177.06 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -68.36 -47.66 66.83 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.259 0.936 . . . . 0.0 109.892 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 10.7 tp -60.37 -39.29 86.7 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.479 0.711 . . . . 0.0 111.296 177.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 90.5 t -62.21 -31.12 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.791 1.178 . . . . 0.0 110.966 175.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.6 tp -73.61 -29.53 62.43 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.658 -1.276 . . . . 0.0 111.984 174.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.71 -29.8 69.57 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 120.219 1.372 . . . . 0.0 109.901 173.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.5 mt -74.19 -51.88 14.16 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.696 0.798 . . . . 0.0 109.302 175.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 24.4 t60 -55.07 -52.99 61.48 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.38 0.672 . . . . 0.0 111.597 178.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -59.12 -23.24 61.96 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -178.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -90.1 -32.88 16.49 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.171 0.896 . . . . 0.0 112.088 173.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 49.5 mttm -74.85 -38.24 62.04 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.842 1.257 . . . . 0.0 112.198 177.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 26.0 t -61.12 -50.0 74.98 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.22 2.208 . . . . 0.0 110.951 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.8 pt20 . . . . . 0 CA--C 1.548 0.879 0 O-C-N 121.33 -0.856 . . . . 0.0 112.216 175.435 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 59.5 m80 . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 45.3 t -67.4 -50.81 57.98 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.41 1.084 . . . . 0.0 108.389 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -55.82 -37.53 68.8 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.418 1.487 . . . . 0.0 111.433 173.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.3 m -67.96 -60.08 2.78 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.289 1.035 . . . . 0.0 111.241 176.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.8 mmt -62.17 -35.13 77.87 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -64.7 -32.52 74.23 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 120.922 1.692 . . . . 0.0 112.567 177.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.5 m-80 -72.87 -38.62 66.94 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.173 0.589 . . . . 0.0 110.592 174.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 58.1 t -63.76 -47.17 92.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-N 118.597 0.635 . . . . 0.0 110.558 176.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -44.94 86.22 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.54 0.736 . . . . 0.0 110.864 178.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -66.77 -17.66 64.98 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 176.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.7 t60 -90.04 -49.08 6.79 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.021 0.928 . . . . 0.0 109.951 173.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.1 ttp -56.47 -28.45 59.74 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.579 1.951 . . . . 0.0 113.258 -178.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 14.7 p -67.91 -29.4 68.47 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.383 1.073 . . . . 0.0 112.814 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -97.85 -28.9 13.64 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.645 1.578 . . . . 0.0 112.532 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.6 t -63.77 133.71 53.98 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.94 1.296 . . . . 0.0 112.966 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -109.25 -11.94 14.83 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.42 1.488 . . . . 0.0 113.833 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.53 -29.95 20.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.883 0.873 . . . . 0.0 111.409 178.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.41 -112.78 2.88 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.507 1.051 . . . . 0.0 112.963 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 59.5 tttm -60.86 -20.48 61.93 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.44 -1.035 . . . . 0.0 112.855 177.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -93.28 -2.64 54.79 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.955 1.302 . . . . 0.0 113.47 176.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 22.7 t -59.87 142.91 52.67 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 122.384 1.088 . . . . 0.0 110.277 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -78.81 -5.74 54.17 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.463 1.105 . . . . 0.0 113.488 -176.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 6.7 t -96.98 123.55 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.821 1.248 . . . . 0.0 108.715 175.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.28 -45.12 72.42 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -176.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -30.6 71.06 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 -178.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 54.0 t -72.27 -56.37 5.63 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.164 0.986 . . . . 0.0 109.738 178.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.73 -26.44 63.95 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 177.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 46.1 m -80.56 -45.31 17.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.819 0.847 . . . . 0.0 111.586 176.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 63.7 m -64.99 -34.55 78.71 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.316 1.046 . . . . 0.0 112.741 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.55 -30.86 70.92 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.332 -0.855 . . . . 0.0 111.879 176.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -68.41 -31.18 70.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.565 0.746 . . . . 0.0 111.764 177.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.3 mm -70.39 -45.6 74.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 30.1 mm -62.49 -39.35 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 124.887 1.275 . . . . 0.0 110.429 177.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 16.5 t -59.66 -29.95 68.41 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.413 1.085 . . . . 0.0 112.717 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.5 t60 -60.06 -51.76 68.24 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.146 0.884 . . . . 0.0 110.486 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 24.8 m95 -64.74 -24.52 67.59 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 14.2 mptt -75.91 -30.4 58.76 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.586 0.754 . . . . 0.0 112.509 176.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -100.04 -34.75 9.95 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -178.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.1 t -79.27 131.29 36.11 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.992 1.317 . . . . 0.0 112.924 -176.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.0 p -130.05 -3.88 4.51 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.815 1.646 . . . . 0.0 114.209 -178.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -82.44 141.76 32.47 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.551 1.54 . . . . 0.0 111.842 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 47.7 p-80 -77.45 -40.56 42.82 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.88 -0.513 . . . . 0.0 111.993 177.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.2 t70 -87.0 69.98 10.27 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.045 1.738 . . . . 0.0 111.518 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 41.9 t -121.34 133.55 24.24 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.305 1.842 . . . . 0.0 109.347 178.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -59.66 -24.0 73.71 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.608 2.205 . . . . 0.0 113.572 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 15.8 t -92.12 -54.97 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 119.268 0.94 . . . . 0.0 111.637 176.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 17.0 m -69.22 -35.29 76.03 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -174.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -57.08 -56.89 28.78 Favored Pre-proline 0 CA--C 1.548 0.889 0 CA-C-N 120.01 1.277 . . . . 0.0 112.629 -178.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -60.21 -32.8 94.89 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 121.84 1.693 . . . . 0.0 113.161 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.2 mt -68.7 -47.85 65.38 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 118.798 0.727 . . . . 0.0 111.929 178.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -59.65 -37.1 77.79 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.034 0.533 . . . . 0.0 111.772 176.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 14.0 t30 -70.46 -40.75 73.5 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.611 1.564 . . . . 0.0 112.33 177.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.707 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -179.708 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 28.9 m . . . . . 0 N--CA 1.479 0.993 0 N-CA-C 111.132 0.049 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -60.13 -24.92 65.07 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.786 0.835 . . . . 0.0 112.737 176.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 11.2 m -70.19 -35.99 74.33 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.119 0.872 . . . . 0.0 113.104 179.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.8 t70 -90.18 -27.91 19.24 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.69 0.796 . . . . 0.0 112.818 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.8 tt -43.09 -58.4 2.47 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 126.919 2.088 . . . . 0.0 113.685 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 52.9 p-90 -70.18 -10.42 58.79 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -173.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 9.3 ptmm? -112.19 -59.91 1.93 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.251 1.945 . . . . 0.0 116.251 -175.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 59.1 mt -119.45 17.31 12.96 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 116.165 1.913 . . . . 0.0 116.165 -171.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.554 1.113 0 C-N-CA 126.154 1.781 . . . . 0.0 113.536 179.037 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 22.7 tp . . . . . 0 CA--C 1.551 1.015 0 N-CA-C 111.701 0.259 . . . . 0.0 111.701 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 7.8 tpt -64.35 146.22 54.78 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 18.2 tp -125.02 151.5 45.5 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.032 2.133 . . . . 0.0 113.047 -174.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 62.0 m -82.87 145.18 49.42 Favored Pre-proline 0 N--CA 1.476 0.84 0 C-N-CA 123.501 0.72 . . . . 0.0 110.493 174.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.47 -30.58 74.39 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.839 2.359 . . . . 0.0 115.734 -177.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.47 -22.31 66.14 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 178.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -87.98 -10.06 51.58 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.568 1.147 . . . . 0.0 113.673 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 96.6 mt -58.43 -34.49 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 CA-C-N 119.29 0.95 . . . . 0.0 109.776 175.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -66.85 -9.9 42.5 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.432 1.893 . . . . 0.0 114.058 177.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -87.51 -26.84 22.98 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.821 0.848 . . . . 0.0 112.361 178.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 . . . . . 0 N--CA 1.472 0.648 0 C-N-CA 123.787 0.835 . . . . 0.0 112.336 176.887 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 92.8 mttt . . . . . 0 N--CA 1.473 0.699 0 CA-C-O 119.044 -0.503 . . . . 0.0 110.54 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -57.96 -46.63 84.83 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.68 0.792 . . . . 0.0 111.534 176.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -60.47 -40.13 90.11 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.548 0.739 . . . . 0.0 111.393 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 71.6 mt -66.15 -40.61 90.69 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 117.916 -1.04 . . . . 0.0 111.961 177.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -62.45 -52.93 53.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 CA-C-N 120.038 1.29 . . . . 0.0 109.267 175.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -54.02 -54.01 45.03 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.014 0.925 . . . . 0.0 111.148 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -65.06 -36.17 83.48 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.379 -0.826 . . . . 0.0 112.58 -179.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -68.04 -45.45 73.9 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.039 0.836 . . . . 0.0 110.599 177.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.6 tt -62.6 -41.29 98.88 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.185 0.994 . . . . 0.0 110.516 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 99.5 t -60.17 -32.16 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 CA-C-N 119.269 0.94 . . . . 0.0 111.031 174.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.8 tp -69.98 -31.21 68.79 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.812 -1.18 . . . . 0.0 112.313 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.41 -28.36 69.2 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 120.325 1.42 . . . . 0.0 110.062 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 5.2 mt -72.89 -50.45 23.69 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.365 1.066 . . . . 0.0 109.579 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.0 t60 -57.25 -55.95 28.07 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 122.768 0.427 . . . . 0.0 110.313 176.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.01 -25.24 43.57 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.879 1.272 . . . . 0.0 114.429 -178.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -90.11 -31.35 17.15 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 175.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 41.6 mttm -83.91 -36.16 23.54 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.598 1.159 . . . . 0.0 112.122 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.3 t -61.27 -53.75 52.79 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.092 2.157 . . . . 0.0 110.948 177.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.2 pt20 . . . . . 0 N--CA 1.475 0.797 0 O-C-N 121.042 -1.036 . . . . 0.0 113.121 176.978 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 57.8 m80 . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 33.2 t -66.92 -50.17 63.25 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.313 1.045 . . . . 0.0 108.748 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -54.69 -34.39 62.24 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.341 1.456 . . . . 0.0 111.91 174.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 26.2 m -72.82 -58.44 3.34 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.672 1.189 . . . . 0.0 111.607 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -37.58 82.46 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.549 -0.719 . . . . 0.0 112.603 -178.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -62.7 -34.44 77.14 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.424 1.466 . . . . 0.0 113.071 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -71.04 -39.69 72.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.061 0.544 . . . . 0.0 110.421 175.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 94.5 t -64.38 -46.57 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.361 0.664 . . . . 0.0 110.831 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.92 -42.29 93.62 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.124 0.969 . . . . 0.0 111.84 178.568 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -66.59 -30.64 70.98 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 55.8 t60 -77.78 -48.67 16.02 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.988 0.813 . . . . 0.0 110.213 175.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 35.7 ttp -56.42 -31.86 64.32 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.303 1.841 . . . . 0.0 114.199 -177.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.7 t -77.48 -10.13 59.3 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 119.805 1.184 . . . . 0.0 112.999 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 50.8 m80 -114.28 -18.99 11.46 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.797 1.639 . . . . 0.0 113.175 177.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 34.8 t -57.57 145.62 33.04 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.493 1.517 . . . . 0.0 112.879 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -109.41 -14.86 14.35 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.821 1.648 . . . . 0.0 113.648 -179.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -104.55 -30.16 10.19 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.465 1.106 . . . . 0.0 112.666 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.99 -110.66 1.59 Allowed Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.61 1.1 . . . . 0.0 113.822 177.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.32 -15.77 60.92 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 120.93 -1.335 . . . . 0.0 113.372 177.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -99.52 -0.21 41.07 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.937 1.695 . . . . 0.0 113.011 174.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 15.4 t -63.71 142.03 58.55 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.326 1.05 . . . . 0.0 110.033 178.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -81.58 -5.25 57.84 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.287 1.035 . . . . 0.0 113.489 -176.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.8 t -87.22 114.49 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 172.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.78 -39.41 65.4 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -176.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -67.78 -41.05 83.83 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.344 0.658 . . . . 0.0 112.585 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.9 t -62.12 -54.82 35.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.981 1.312 . . . . 0.0 110.198 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.6 -22.96 64.31 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.044 0.938 . . . . 0.0 113.078 177.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.4 m -82.01 -52.06 7.42 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.051 0.941 . . . . 0.0 111.939 176.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 41.7 m -61.05 -34.18 74.47 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 119.17 0.895 . . . . 0.0 112.056 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -60.04 -31.31 69.85 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.285 -0.885 . . . . 0.0 112.759 175.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -69.11 -30.7 69.04 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.707 1.14 . . . . 0.0 111.229 176.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 15.0 mt -74.27 -48.42 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.502 1.121 . . . . 0.0 109.929 176.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 25.8 mm -61.86 -37.47 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.939 0.895 . . . . 0.0 111.046 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 73.1 m -61.74 -24.83 67.06 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.395 -0.815 . . . . 0.0 112.869 176.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 10.0 t60 -64.91 -54.85 24.21 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.411 1.005 . . . . 0.0 109.963 176.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 46.3 m95 -62.05 -28.83 69.87 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 177.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -71.03 -29.93 65.99 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.784 0.834 . . . . 0.0 112.709 177.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -100.19 -40.85 7.36 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.2 t -77.76 135.45 38.0 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.472 1.509 . . . . 0.0 112.381 -177.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 3.8 t -130.11 2.76 4.77 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.542 1.537 . . . . 0.0 114.008 -179.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -78.25 153.49 31.82 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.207 1.403 . . . . 0.0 114.207 -177.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 80.6 t60 -86.89 -39.26 15.97 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.086 0.955 . . . . 0.0 109.859 170.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.7 t70 -93.71 78.59 4.25 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.654 1.582 . . . . 0.0 111.682 178.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.2 t -137.79 135.06 18.52 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 126.882 2.073 . . . . 0.0 108.887 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -58.56 -26.95 80.85 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 122.809 2.339 . . . . 0.0 114.799 -177.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 4.9 t -92.11 -50.68 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 119.653 1.115 . . . . 0.0 111.869 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.7 m -69.92 -39.21 76.29 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -175.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.5 tt -53.34 -57.7 15.73 Favored Pre-proline 0 N--CA 1.474 0.746 0 CA-C-O 117.588 -1.196 . . . . 0.0 112.781 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.62 -32.7 93.64 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-N 121.569 1.596 . . . . 0.0 113.424 -179.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.27 -46.8 63.62 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.636 1.107 . . . . 0.0 112.011 178.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -64.49 -30.52 71.55 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.346 1.059 . . . . 0.0 111.416 177.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 37.8 t30 -78.07 -41.58 34.97 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.797 1.639 . . . . 0.0 112.39 176.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.557 0 C-N-CA 124.761 1.224 . . . . 0.0 114.192 -179.253 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 76.8 m . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -60.21 -24.82 65.12 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 9.1 t -75.63 -31.05 59.7 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.897 0.879 . . . . 0.0 112.359 178.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.9 t70 -90.02 -28.07 19.32 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.001 0.92 . . . . 0.0 112.319 175.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.9 tt -46.49 -59.02 3.24 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 126.993 2.117 . . . . 0.0 112.847 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.6 p-90 -69.69 -9.24 53.6 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.021 1.489 . . . . 0.0 115.021 -173.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -112.0 -56.25 2.41 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -177.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 50.1 mt -120.14 15.86 12.36 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -172.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.2 tt . . . . . 0 CA--C 1.549 0.909 0 C-N-CA 126.07 1.748 . . . . 0.0 114.891 -179.18 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 23.9 tp . . . . . 0 CA--C 1.554 1.125 0 CA-C-O 121.051 0.453 . . . . 0.0 111.756 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 8.0 tpt -71.73 151.77 43.32 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 115.923 1.823 . . . . 0.0 115.923 -175.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 91.3 mt -125.03 162.98 23.36 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.061 2.144 . . . . 0.0 113.709 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 31.2 t -83.67 144.83 46.21 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 169.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -56.86 -20.32 35.49 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.248 1.965 . . . . 0.0 114.718 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -69.04 -25.08 64.3 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.863 0.865 . . . . 0.0 112.76 177.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.3 t70 -83.76 -12.76 55.3 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 80.3 mt -56.18 -36.39 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 124.571 1.148 . . . . 0.0 110.465 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -66.01 -10.0 35.68 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.014 1.326 . . . . 0.0 113.863 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 20.8 tp60 -84.64 -29.6 25.59 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.104 -0.998 . . . . 0.0 112.596 177.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 3.2 p-90 . . . . . 0 N--CA 1.473 0.705 0 C-N-CA 123.735 0.814 . . . . 0.0 111.907 176.655 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 45.2 mmtm . . . . . 0 N--CA 1.473 0.711 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -63.3 -42.35 99.04 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.652 0.66 . . . . 0.0 110.474 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -62.07 -33.4 74.33 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.213 1.005 . . . . 0.0 112.497 176.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 71.5 mt -64.27 -41.31 96.99 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 120.1 1.318 . . . . 0.0 111.451 175.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.8 mt -64.7 -51.47 66.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.054 0.541 . . . . 0.0 109.736 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -55.35 -55.16 34.69 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.396 1.078 . . . . 0.0 111.299 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -34.42 77.79 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -177.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -68.91 -44.84 72.34 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.103 0.865 . . . . 0.0 110.52 176.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 7.6 tp -62.65 -39.69 94.69 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.609 0.641 . . . . 0.0 110.896 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 58.0 t -60.29 -32.21 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 CA-C-N 119.449 1.022 . . . . 0.0 110.95 175.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 9.3 tp -71.37 -31.71 67.64 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 120.793 -1.192 . . . . 0.0 112.138 175.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.61 -28.91 69.7 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 120.211 1.369 . . . . 0.0 109.938 174.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.9 mt -72.55 -52.9 13.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.707 0.803 . . . . 0.0 109.584 175.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.0 t60 -55.02 -54.39 43.67 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 122.902 0.481 . . . . 0.0 110.531 177.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -57.22 -25.3 58.86 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -178.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -90.01 -31.42 17.21 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.467 1.031 . . . . 0.0 113.323 175.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 76.9 mttt -80.54 -39.59 27.5 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.4 1.48 . . . . 0.0 112.231 179.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 51.9 t -62.76 -51.25 67.86 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 127.635 2.374 . . . . 0.0 112.048 178.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.0 pt20 . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -179.947 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 45.0 m80 . . . . . 0 N--CA 1.471 0.617 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 36.0 t -66.09 -50.15 65.07 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.74 1.216 . . . . 0.0 108.948 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -54.99 -34.66 63.6 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.264 1.426 . . . . 0.0 111.824 174.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.8 m -71.83 -59.56 2.69 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.526 1.13 . . . . 0.0 111.446 176.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.46 -37.79 79.1 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.771 -0.633 . . . . 0.0 112.522 -178.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -63.83 -34.34 77.71 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 120.505 1.502 . . . . 0.0 113.1 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -71.17 -37.66 72.19 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.011 0.524 . . . . 0.0 110.519 175.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 91.6 t -65.67 -47.04 87.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 122.934 0.493 . . . . 0.0 110.623 176.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.78 -43.38 85.51 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.784 0.833 . . . . 0.0 111.156 178.12 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 33.7 m-80 -68.22 -17.64 64.36 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 176.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 62.7 t60 -90.11 -47.81 7.58 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.815 0.846 . . . . 0.0 109.497 173.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -57.28 -28.44 63.01 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.339 1.856 . . . . 0.0 113.293 -178.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 7.5 p -66.88 -27.05 67.2 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.488 1.115 . . . . 0.0 112.542 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 68.8 m80 -102.51 -22.2 14.07 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.059 1.744 . . . . 0.0 113.443 178.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 19.4 t -64.18 142.86 58.26 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.442 1.497 . . . . 0.0 112.692 -179.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -117.72 -12.77 10.22 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.651 1.58 . . . . 0.0 113.814 -179.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -91.44 -27.59 18.2 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.976 0.91 . . . . 0.0 112.058 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 55.69 -114.16 4.58 Favored Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.219 0.914 . . . . 0.0 112.605 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 82.2 tttt -62.18 -20.49 64.2 Favored 'General case' 0 N--CA 1.479 0.994 0 O-C-N 121.316 -1.109 . . . . 0.0 112.803 177.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.5 -1.96 57.36 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.917 1.287 . . . . 0.0 113.466 176.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 17.5 t -63.64 141.96 58.57 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 122.058 0.932 . . . . 0.0 109.599 177.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -80.54 -3.9 51.91 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -175.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 96.5 t -91.67 115.01 29.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 172.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.89 -39.51 68.81 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -176.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -65.84 -38.89 90.09 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.675 0.79 . . . . 0.0 112.517 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 40.7 t -66.69 -55.06 16.88 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.382 1.473 . . . . 0.0 110.163 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.72 -26.12 63.61 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.005 0.922 . . . . 0.0 113.393 177.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.4 m -81.93 -46.49 13.97 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 124.214 1.006 . . . . 0.0 111.535 175.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 66.8 m -61.98 -36.05 80.31 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.375 1.07 . . . . 0.0 112.284 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -61.16 -31.98 71.71 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.747 0.819 . . . . 0.0 112.16 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -68.91 -29.68 68.0 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.4 0.68 . . . . 0.0 111.714 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.1 mm -71.17 -46.74 64.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 18.9 mm -60.99 -38.45 79.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 124.96 1.304 . . . . 0.0 110.974 177.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 70.5 m -62.15 -21.91 65.44 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.283 1.033 . . . . 0.0 113.271 177.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.2 t60 -65.28 -60.21 3.23 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.474 1.034 . . . . 0.0 110.683 178.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 52.6 m95 -60.15 -24.13 64.46 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 177.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 61.8 mtpt -74.53 -35.95 63.15 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.95 0.9 . . . . 0.0 112.748 178.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.03 -32.72 10.81 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 8.9 t -82.29 132.92 35.22 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.522 1.529 . . . . 0.0 110.979 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.2 p -129.98 0.47 4.76 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.352 1.461 . . . . 0.0 114.427 -177.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -80.09 151.95 29.58 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.831 1.252 . . . . 0.0 113.093 -178.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 40.6 p-80 -86.41 -29.22 23.04 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.694 0.798 . . . . 0.0 111.444 173.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.8 t0 -100.27 70.05 1.5 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.46 1.904 . . . . 0.0 111.511 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 41.7 t -127.88 135.18 27.1 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 126.615 1.966 . . . . 0.0 109.22 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -58.56 -25.08 72.98 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 122.814 2.343 . . . . 0.0 114.204 -178.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.2 t -92.19 -52.49 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 119.682 1.128 . . . . 0.0 111.732 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 10.4 m -68.76 -40.25 79.85 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -175.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -53.42 -57.95 14.83 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-O 117.414 -1.279 . . . . 0.0 112.866 -178.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -59.93 -34.11 95.4 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 121.918 1.745 . . . . 0.0 113.565 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.5 mt -70.24 -47.13 62.74 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.977 0.808 . . . . 0.0 111.924 178.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -64.6 -34.75 79.0 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.982 0.913 . . . . 0.0 110.886 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.8 t30 -70.12 -43.15 71.6 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.254 1.421 . . . . 0.0 111.77 176.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.623 0 C-N-CA 123.939 0.896 . . . . 0.0 112.46 178.343 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 90.5 m . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 119.946 -0.073 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -60.08 -27.49 67.04 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.619 0.767 . . . . 0.0 112.967 176.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 24.2 m -68.01 -34.72 77.05 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.611 0.764 . . . . 0.0 112.663 178.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.31 -28.73 18.56 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 174.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 2.6 tt -43.24 -60.06 1.83 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.4 1.88 . . . . 0.0 113.318 -177.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 50.1 p-90 -63.0 -12.49 26.25 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -173.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 16.1 pttp -111.94 -50.25 2.93 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -177.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 66.2 mt -120.08 20.44 12.09 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 117.203 2.297 . . . . 0.0 117.203 -169.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 12.4 tp . . . . . 0 CA--C 1.551 1.019 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -173.943 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 93.0 mt . . . . . 0 CA--C 1.551 1.009 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.39 149.51 44.25 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.844 -1.16 . . . . 0.0 113.356 -177.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.14 179.66 4.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.31 1.844 . . . . 0.0 114.242 -175.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 6.1 p -79.92 160.13 69.55 Favored Pre-proline 0 CA--C 1.545 0.769 0 O-C-N 121.464 -0.773 . . . . 0.0 109.452 169.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.37 -15.16 47.1 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 121.725 1.617 . . . . 0.0 113.009 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -85.61 -28.86 24.53 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.346 1.058 . . . . 0.0 111.452 176.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -67.71 -21.0 65.33 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.674 0.79 . . . . 0.0 112.243 177.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 97.2 mt -57.43 -35.84 50.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.993 0.917 . . . . 0.0 109.678 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -72.86 -10.0 59.31 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 179.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -78.24 -30.46 48.73 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.052 -1.03 . . . . 0.0 111.336 175.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 7.4 p-90 . . . . . 0 CA--C 1.542 0.667 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 177.704 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 81.0 mttt . . . . . 0 N--CA 1.471 0.616 0 CA-C-O 117.792 -1.099 . . . . 0.0 112.021 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 10.5 ptt-85 -64.52 -35.97 82.69 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.641 1.564 . . . . 0.0 111.655 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -63.07 -38.39 91.01 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.171 0.896 . . . . 0.0 111.267 173.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 97.6 mt -63.69 -38.88 92.79 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.714 0.688 . . . . 0.0 111.198 176.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -68.05 -51.96 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 118.928 0.785 . . . . 0.0 109.851 175.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -52.89 -53.64 46.19 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.226 1.01 . . . . 0.0 111.373 179.108 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -38.06 88.14 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 119.282 0.946 . . . . 0.0 112.503 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -70.13 -45.91 65.85 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.681 0.673 . . . . 0.0 111.119 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.0 tt -63.05 -43.05 99.71 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.587 0.755 . . . . 0.0 109.948 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 61.9 t -63.94 -24.34 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 120.737 -1.227 . . . . 0.0 111.131 174.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.44 -31.25 57.74 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.292 -1.505 . . . . 0.0 111.612 173.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.7 mp -59.86 -41.65 91.93 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 169.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.3 mp -67.26 -47.46 70.65 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 117.704 -1.141 . . . . 0.0 111.997 176.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 30.2 t60 -55.06 -55.01 35.84 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.746 1.157 . . . . 0.0 108.719 176.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.38 -45.92 66.0 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.147 0.979 . . . . 0.0 113.27 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -69.43 -39.26 77.94 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.513 -0.742 . . . . 0.0 112.817 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 49.1 mttp -74.9 -32.8 61.92 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.007 -1.058 . . . . 0.0 111.736 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 8.3 t -68.52 -42.14 78.93 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.253 1.821 . . . . 0.0 109.424 173.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 14.4 tt0 . . . . . 0 CA--C 1.544 0.742 0 C-N-CA 125.232 1.413 . . . . 0.0 110.056 172.237 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 19.7 m170 . . . . . 0 N--CA 1.471 0.59 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 5.1 t -64.94 -51.84 59.6 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.091 1.357 . . . . 0.0 109.228 175.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -52.02 -41.87 62.58 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.179 1.792 . . . . 0.0 111.774 175.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 5.1 m -66.99 -58.63 4.58 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.934 1.294 . . . . 0.0 111.252 176.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.2 mmt -62.67 -33.1 74.38 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -177.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -67.09 -30.39 70.4 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 121.138 1.79 . . . . 0.0 112.51 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -72.07 -36.81 69.65 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 122.875 0.47 . . . . 0.0 110.264 172.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 71.2 t -62.61 -46.94 95.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 123.076 0.55 . . . . 0.0 110.13 175.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.23 -41.29 92.8 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.253 1.021 . . . . 0.0 112.002 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -63.6 -39.55 94.66 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.013 0.525 . . . . 0.0 111.762 175.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.8 -50.75 27.03 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.268 0.627 . . . . 0.0 111.15 176.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 30.1 ttp -57.54 -34.9 69.64 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.318 1.847 . . . . 0.0 114.378 -175.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 13.0 t -74.35 -16.1 60.92 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 120.06 1.3 . . . . 0.0 112.544 175.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -98.84 -30.64 12.29 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.53 1.532 . . . . 0.0 112.039 176.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 36.4 t -61.95 145.15 53.79 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.418 1.887 . . . . 0.0 112.279 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -121.33 -5.39 9.37 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.406 1.482 . . . . 0.0 114.718 -177.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -88.95 -15.5 34.12 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.486 1.039 . . . . 0.0 113.211 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 58.69 -126.9 43.9 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 121.38 -0.825 . . . . 0.0 112.007 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -66.48 -10.06 40.64 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -94.26 0.35 55.59 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.573 1.149 . . . . 0.0 113.445 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.1 t -59.17 140.77 55.57 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.331 1.062 . . . . 0.0 110.383 177.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 55.1 mm-40 -77.94 -9.0 58.87 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.853 1.261 . . . . 0.0 113.319 -176.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 10.9 t -93.94 124.13 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.491 1.116 . . . . 0.0 108.652 175.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.63 -50.36 65.88 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -176.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -62.4 -32.85 73.73 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -178.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 49.7 t -68.61 -59.37 3.17 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.937 0.789 . . . . 0.0 109.992 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.73 68.67 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.647 0.779 . . . . 0.0 112.419 178.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 19.8 m -69.32 -51.9 32.57 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.314 -0.866 . . . . 0.0 112.08 176.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 36.7 m -62.9 -33.64 75.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.853 1.206 . . . . 0.0 112.066 178.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -59.65 -34.15 72.45 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.474 -0.766 . . . . 0.0 111.872 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -65.93 -27.83 68.47 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 118.924 0.784 . . . . 0.0 111.697 175.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 11.6 mt -76.73 -48.02 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.171 0.989 . . . . 0.0 109.886 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 20.4 mm -59.25 -38.02 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 124.191 0.996 . . . . 0.0 110.741 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 22.3 t -58.46 -29.34 66.1 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.799 1.239 . . . . 0.0 112.8 176.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 10.8 t60 -61.53 -55.89 26.07 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.295 -0.878 . . . . 0.0 110.453 176.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 51.7 m95 -61.3 -31.96 71.8 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 178.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -67.23 -34.76 78.15 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 118.606 -0.711 . . . . 0.0 112.824 178.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.6 p30 -100.1 -30.76 11.77 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 11.1 t -78.58 125.7 29.73 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.775 1.23 . . . . 0.0 112.095 -178.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 54.4 p -111.32 1.66 17.23 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.858 1.663 . . . . 0.0 113.941 -178.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 64.7 mtm180 -85.35 162.07 19.22 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.346 1.458 . . . . 0.0 114.084 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 15.3 t-160 -106.67 -37.96 6.27 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.656 1.582 . . . . 0.0 108.425 170.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -85.75 69.88 10.64 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.094 1.758 . . . . 0.0 111.097 175.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 44.3 t -131.62 136.79 29.07 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 126.898 2.079 . . . . 0.0 109.224 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -55.29 -28.38 62.15 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.903 2.402 . . . . 0.0 114.566 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.9 t -92.14 -52.14 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 119.461 1.028 . . . . 0.0 111.941 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 4.9 m -68.39 -34.89 76.83 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 115.203 1.556 . . . . 0.0 115.203 -174.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -54.8 -58.9 12.22 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-O 117.678 -1.153 . . . . 0.0 113.083 -178.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.23 -31.83 93.56 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.983 1.789 . . . . 0.0 113.402 179.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.72 -48.09 60.78 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.706 0.802 . . . . 0.0 111.988 178.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -67.22 -25.19 65.99 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.115 0.966 . . . . 0.0 111.993 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 18.9 t30 -77.46 -40.37 43.43 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.112 1.365 . . . . 0.0 111.699 175.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.671 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -179.198 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 86.2 m . . . . . 0 N--CA 1.474 0.733 0 CA-C-O 119.893 -0.099 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -60.29 -27.31 67.19 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.661 -0.649 . . . . 0.0 112.462 174.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 53.7 m -71.54 -31.23 66.8 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.43 0.692 . . . . 0.0 112.802 178.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.1 t70 -90.15 -28.62 18.81 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.438 1.095 . . . . 0.0 112.966 175.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.1 tt -44.39 -60.1 2.1 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.926 2.09 . . . . 0.0 113.314 -178.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.8 p-90 -70.94 -4.81 26.57 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -112.02 -59.97 1.92 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.736 1.754 . . . . 0.0 115.736 -177.419 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 7.0 mp -120.23 14.27 12.12 Favored 'General case' 0 CA--C 1.554 1.135 0 N-CA-C 116.372 1.99 . . . . 0.0 116.372 -174.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 4.4 tt . . . . . 0 CA--C 1.552 1.048 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -178.437 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 29.5 tp . . . . . 0 CA--C 1.556 1.175 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 13.3 tpt -76.81 150.88 36.1 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -175.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.9 mp -125.04 159.91 30.25 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 125.602 1.561 . . . . 0.0 111.992 177.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.3 m -66.63 152.16 95.5 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 170.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -64.02 -11.49 27.57 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 122.25 1.967 . . . . 0.0 115.788 -174.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -80.08 -18.02 51.1 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.406 -0.809 . . . . 0.0 112.236 177.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -84.85 -9.97 57.61 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.481 1.112 . . . . 0.0 112.232 177.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 95.8 mt -58.55 -35.25 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.658 1.183 . . . . 0.0 109.711 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -65.58 -11.24 42.38 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.077 1.351 . . . . 0.0 113.167 177.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -82.94 -25.37 32.44 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.604 1.162 . . . . 0.0 112.286 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.3 p-90 . . . . . 0 CA--C 1.542 0.649 0 C-N-CA 124.517 1.127 . . . . 0.0 113.677 178.321 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 57.8 mtpt . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 119.397 -0.335 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 42.3 mtm105 -63.73 -38.16 90.07 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 118.617 -0.706 . . . . 0.0 111.665 175.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -58.08 -36.72 73.25 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 119.082 0.855 . . . . 0.0 111.492 173.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 55.6 mt -64.17 -45.0 90.34 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.646 0.657 . . . . 0.0 110.937 176.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -58.23 -51.11 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-N 118.142 0.428 . . . . 0.0 110.102 177.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -57.34 -53.08 62.23 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.531 1.133 . . . . 0.0 111.414 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.98 -33.29 75.47 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.458 1.026 . . . . 0.0 112.847 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -67.86 -46.19 72.45 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.315 0.962 . . . . 0.0 109.305 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 12.0 tp -61.78 -39.65 92.41 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.949 1.3 . . . . 0.0 111.861 177.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 96.1 t -60.29 -32.52 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.056 1.298 . . . . 0.0 110.331 174.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.4 tp -73.65 -29.49 62.36 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 120.86 -1.15 . . . . 0.0 112.779 175.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.37 -29.93 69.24 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 120.102 1.319 . . . . 0.0 109.56 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.5 mt -71.67 -53.68 12.8 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.483 -0.761 . . . . 0.0 109.768 175.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 12.4 t60 -54.62 -53.62 52.24 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.381 0.673 . . . . 0.0 110.925 178.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -59.91 -21.94 61.75 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -178.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -87.53 -32.99 19.11 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.119 0.872 . . . . 0.0 111.958 174.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 39.2 mttm -84.16 -41.5 16.97 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.043 1.337 . . . . 0.0 113.346 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 34.5 t -56.73 -45.74 81.76 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.382 1.873 . . . . 0.0 111.212 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 13.5 pt20 . . . . . 0 CA--C 1.547 0.845 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 176.387 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 72.8 m80 . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.4 t -62.27 -49.15 76.82 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.242 1.017 . . . . 0.0 110.379 178.021 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 31.5 tpt180 -55.21 -37.58 67.32 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.916 1.286 . . . . 0.0 111.96 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 52.0 m -68.84 -55.77 10.1 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.672 0.789 . . . . 0.0 111.389 177.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.9 mmt -64.45 -35.25 80.33 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -64.74 -33.29 75.62 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.711 1.596 . . . . 0.0 112.335 178.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -70.72 -40.89 72.52 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.49 0.716 . . . . 0.0 110.298 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 78.6 t -62.61 -47.54 92.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 123.353 0.661 . . . . 0.0 110.566 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.13 -42.83 95.63 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.182 0.993 . . . . 0.0 112.575 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -65.08 -30.33 71.28 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 177.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 64.8 t60 -78.32 -52.48 8.56 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.577 0.751 . . . . 0.0 110.3 174.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.6 ttp -55.6 -35.84 66.25 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.1 1.76 . . . . 0.0 113.698 -176.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 6.0 t -71.44 -11.46 60.9 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.101 1.319 . . . . 0.0 113.55 178.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -112.9 -22.74 10.48 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.365 1.466 . . . . 0.0 112.791 176.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 39.0 t -56.91 138.19 54.22 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.475 1.51 . . . . 0.0 112.452 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -103.48 -16.55 15.53 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.672 1.589 . . . . 0.0 113.699 -178.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -95.68 -31.18 13.36 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.34 1.056 . . . . 0.0 112.678 -178.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.76 -108.06 0.65 Allowed Glycine 0 CA--C 1.536 1.35 0 C-N-CA 124.561 1.076 . . . . 0.0 112.917 178.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 67.3 mttm -58.37 -25.08 61.62 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 121.446 -1.032 . . . . 0.0 113.13 177.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -96.09 -0.69 49.96 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.335 1.454 . . . . 0.0 114.005 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.2 t -60.07 144.24 50.08 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 122.341 1.067 . . . . 0.0 111.007 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -80.01 -8.77 59.53 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.611 1.165 . . . . 0.0 113.036 -177.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.9 t -89.56 117.41 32.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 173.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.58 -40.73 72.39 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -177.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -64.06 -38.37 90.82 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.664 0.786 . . . . 0.0 112.915 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 51.9 t -68.03 -57.14 6.64 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.458 1.503 . . . . 0.0 110.285 178.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.35 -28.09 62.85 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.296 1.039 . . . . 0.0 113.084 177.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 68.7 m -79.32 -49.77 11.91 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.739 0.816 . . . . 0.0 112.268 176.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.6 m -61.61 -33.98 74.86 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.498 -0.751 . . . . 0.0 111.962 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -58.75 -31.87 68.73 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.014 0.926 . . . . 0.0 112.546 176.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -68.74 -35.3 76.94 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.074 0.852 . . . . 0.0 111.592 176.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 7.9 mt -68.84 -45.23 81.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 123.846 0.858 . . . . 0.0 109.668 176.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 18.1 mm -62.44 -40.75 89.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.151 0.98 . . . . 0.0 110.911 175.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 70.8 m -61.09 -26.66 67.81 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.968 0.907 . . . . 0.0 113.106 178.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.5 t60 -62.14 -56.59 17.26 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.688 1.131 . . . . 0.0 109.889 177.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 41.5 m95 -60.19 -30.63 69.49 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 178.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -72.8 -28.13 62.4 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 178.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -100.14 -34.97 9.82 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.3 t -74.39 134.16 42.44 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.413 1.485 . . . . 0.0 111.225 -178.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 61.6 p -123.22 -9.65 8.11 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -176.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -78.91 159.81 27.56 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 0.0 113.499 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 39.2 p-80 -93.14 -25.22 17.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.695 1.198 . . . . 0.0 111.324 172.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 17.5 t0 -106.84 86.13 2.27 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.615 1.966 . . . . 0.0 110.797 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 50.9 t -138.69 135.87 18.25 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 126.842 2.057 . . . . 0.0 108.7 179.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -58.76 -26.55 80.45 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 123.049 2.5 . . . . 0.0 114.627 -177.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 39.4 t -92.07 -48.97 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.636 1.107 . . . . 0.0 111.643 176.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.5 m -69.96 -43.98 70.43 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -175.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.03 -54.31 48.62 Favored Pre-proline 0 CA--C 1.552 1.021 0 O-C-N 120.904 -1.123 . . . . 0.0 112.845 -178.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -65.8 -4.41 9.88 Favored 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 122.91 2.406 . . . . 0.0 114.996 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.6 mt -100.0 -47.61 4.94 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.91 1.284 . . . . 0.0 109.911 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -58.59 -36.86 74.65 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.204 1.402 . . . . 0.0 111.918 176.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 16.6 p30 -83.93 -10.02 58.27 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 179.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.584 0 C-N-CA 124.947 1.299 . . . . 0.0 113.619 -178.664 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.523 0 CA-C-O 121.35 0.416 . . . . 0.0 113.986 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.4 p -75.48 -17.06 60.23 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 22.3 p80 -146.28 168.36 21.27 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.3 1.84 . . . . 0.0 111.668 179.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 26.7 ptt? -104.92 155.95 18.47 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.053 1.341 . . . . 0.0 112.415 178.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -88.99 -4.17 58.51 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.442 1.097 . . . . 0.0 113.431 177.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -43.97 -45.38 18.99 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 115.054 1.501 . . . . 0.0 115.054 -178.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -60.38 -15.03 33.05 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 123.296 2.664 . . . . 0.0 115.076 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -113.32 -25.81 8.66 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.434 1.893 . . . . 0.0 112.966 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 89.5 p -106.77 -14.12 15.08 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 -177.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 9.9 t70 -111.52 121.83 39.05 Favored Pre-proline 0 CA--C 1.554 1.111 0 CA-C-N 120.227 1.376 . . . . 0.0 112.742 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -64.49 -14.4 44.1 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 123.575 2.85 . . . . 0.0 115.489 -177.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 7.4 t -74.62 -19.76 60.17 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.173 0.897 . . . . 0.0 112.624 177.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 7.6 p -123.8 -23.08 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 125.282 1.433 . . . . 0.0 114.028 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -55.32 122.51 44.03 Favored Pre-proline 0 CA--C 1.552 1.057 0 CA-C-N 119.599 1.091 . . . . 0.0 112.126 176.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 7.0 Cg_endo -107.11 67.05 0.01 OUTLIER 'Trans proline' 0 CA--C 1.559 1.75 1 C-N-CA 125.302 4.001 . . . . 0.0 113.744 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -70.0 165.17 32.12 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.129 2.553 . . . . 0.0 113.827 -178.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 6.2 tt -67.58 147.14 53.15 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.863 1.265 . . . . 0.0 111.809 177.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 34.1 t -110.75 160.2 16.94 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.246 1.818 . . . . 0.0 112.045 178.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -60.72 -26.41 67.15 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.029 -1.044 . . . . 0.0 113.372 178.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -83.9 -14.14 51.8 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.489 0.716 . . . . 0.0 112.807 177.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 34.5 m -61.08 -51.9 67.19 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.801 0.728 . . . . 0.0 110.575 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -60.02 -27.37 66.84 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 177.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 67.0 m -74.53 -34.49 63.01 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 178.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.7 t70 -90.25 -27.43 19.49 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.426 1.09 . . . . 0.0 113.229 176.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -42.9 -54.38 4.22 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.731 2.412 . . . . 0.0 112.966 -178.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 42.1 p-90 -75.3 -4.84 41.5 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -175.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 87.1 mttt -107.91 -60.32 1.73 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -177.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 26.0 mt -120.14 12.14 11.79 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -169.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.5 tt -51.96 136.07 37.51 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 125.191 1.396 . . . . 0.0 114.028 -176.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -77.47 158.83 32.62 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.915 3.077 . . . . 0.0 112.325 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -76.15 10.06 2.17 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 116.201 1.926 . . . . 0.0 116.201 -178.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 46.9 p-10 -116.19 16.69 15.88 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.869 1.668 . . . . 0.0 114.13 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -65.58 151.51 46.3 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 123.865 0.866 . . . . 0.0 112.537 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 34.5 m -115.42 -1.14 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 115.974 1.842 . . . . 0.0 115.974 -176.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 50.8 tp -77.27 -11.37 59.82 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -179.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 19.8 m -35.08 100.04 0.18 Allowed Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 128.672 2.789 . . . . 0.0 115.62 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -66.58 126.53 15.63 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.473 2.782 . . . . 0.0 111.074 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 75.3 mt -92.15 142.57 26.39 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 123.456 0.703 . . . . 0.0 111.779 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -56.0 -22.16 37.54 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.516 2.811 . . . . 0.0 114.93 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 43.3 p -73.24 -17.48 61.34 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.559 1.544 . . . . 0.0 113.837 177.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -127.31 -23.41 3.54 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.183 1.393 . . . . 0.0 114.318 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -71.73 137.07 47.46 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.228 1.011 . . . . 0.0 111.564 178.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.84 47.43 0.63 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.801 1.64 . . . . 0.0 113.603 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 37.6 t70 -66.13 -18.63 65.47 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.096 1.358 . . . . 0.0 112.722 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -62.32 -21.22 65.1 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.893 1.277 . . . . 0.0 113.458 177.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 86.5 mt -89.8 16.77 7.48 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.464 1.906 . . . . 0.0 112.861 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.27 152.75 32.7 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -174.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 90.9 mt -125.19 179.96 4.84 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 129.209 3.004 . . . . 0.0 113.557 -177.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 88.0 p -100.11 152.58 37.87 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.85 1.66 . . . . 0.0 106.999 169.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_exo -56.48 -23.78 49.41 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.569 2.179 . . . . 0.0 114.889 -178.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.2 t70 -71.42 -29.15 64.56 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.945 0.898 . . . . 0.0 112.98 178.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 15.5 t70 -76.58 -15.0 59.96 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 93.8 mt -58.13 -35.38 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 O-C-N 121.435 -0.791 . . . . 0.0 109.947 175.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -69.14 -9.85 54.83 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.75 1.22 . . . . 0.0 113.391 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -83.73 -29.06 27.81 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.285 1.034 . . . . 0.0 111.715 177.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -96.78 -37.37 10.3 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.847 0.859 . . . . 0.0 112.498 176.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -109.52 109.66 20.53 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 105.088 -2.189 . . . . 0.0 105.088 169.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 3.1 m -75.57 140.92 42.97 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 116.202 1.926 . . . . 0.0 116.202 -170.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -120.1 143.83 47.94 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.389 2.276 . . . . 0.0 106.616 169.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -60.7 129.37 89.69 Favored Pre-proline 0 CA--C 1.552 1.042 0 O-C-N 121.009 -1.057 . . . . 0.0 113.629 -175.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -75.5 -21.19 15.2 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 123.319 2.68 . . . . 0.0 112.524 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 174.96 171.21 38.84 Favored Glycine 0 CA--C 1.54 1.604 0 C-N-CA 127.537 2.494 . . . . 0.0 110.594 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -65.15 -18.83 62.43 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.419 2.746 . . . . 0.0 113.82 -179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -94.47 -3.32 50.22 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.829 1.652 . . . . 0.0 114.204 179.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 64.32 43.28 97.12 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 119.067 0.849 . . . . 0.0 113.681 -178.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 4.9 p -60.54 103.59 0.26 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.87 1.268 . . . . 0.0 110.873 178.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 26.9 p -68.76 158.03 35.15 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.587 1.555 . . . . 0.0 114.535 -175.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 18.7 p90 -145.53 168.38 20.74 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.874 1.67 . . . . 0.0 111.681 -175.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 58.0 m-20 -53.22 -37.25 61.85 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 120.89 -1.131 . . . . 0.0 113.069 -177.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -65.98 -8.21 40.94 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 125.332 1.444 . . . . 0.0 115.867 178.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 39.7 p -128.4 -34.02 2.08 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 118.902 1.351 . . . . 0.0 112.763 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -93.72 -36.26 12.4 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.695 1.369 . . . . 0.0 114.695 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 24.9 m -93.68 -42.64 9.06 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.93 0.892 . . . . 0.0 111.934 -178.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -131.25 82.66 0.32 Allowed Glycine 0 CA--C 1.534 1.271 0 C-N-CA 125.415 1.483 . . . . 0.0 111.004 177.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.69 159.03 18.18 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 124.512 3.475 . . . . 0.0 115.682 -177.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 38.5 p -58.85 -21.29 56.65 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.726 1.61 . . . . 0.0 114.432 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -80.15 -4.31 52.45 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.975 1.31 . . . . 0.0 114.095 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -65.63 143.9 98.75 Favored Pre-proline 0 CA--C 1.546 0.802 0 O-C-N 121.25 -0.906 . . . . 0.0 111.618 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -60.68 -33.49 93.22 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.742 2.295 . . . . 0.0 113.281 -178.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -68.37 -32.42 72.49 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.184 -0.947 . . . . 0.0 112.377 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -62.55 -37.96 88.18 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 118.793 0.724 . . . . 0.0 110.524 174.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -64.99 -39.5 93.57 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.819 0.848 . . . . 0.0 111.34 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -59.0 -41.0 86.62 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.132 0.878 . . . . 0.0 111.11 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 94.3 mt -64.84 -38.44 90.97 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.683 0.793 . . . . 0.0 111.848 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -65.5 -53.83 35.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 CA-C-N 119.066 0.848 . . . . 0.0 109.454 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -52.29 -52.06 55.05 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.184 0.994 . . . . 0.0 111.563 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -35.53 80.46 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -179.11 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 14.0 tp60 -74.21 -44.05 54.75 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.044 0.838 . . . . 0.0 110.88 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.8 tt -59.63 -46.25 89.56 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.863 1.265 . . . . 0.0 110.435 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 92.4 t -58.24 -32.13 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.008 0.822 . . . . 0.0 111.221 175.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.58 -26.15 61.6 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.827 -1.17 . . . . 0.0 113.854 175.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.8 mp -63.6 -32.59 74.11 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 120.104 1.32 . . . . 0.0 108.911 173.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 4.1 mt -69.14 -50.42 48.09 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.708 1.203 . . . . 0.0 109.564 175.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 17.9 t60 -55.79 -53.55 55.28 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 122.603 0.361 . . . . 0.0 110.365 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -58.31 -27.29 63.96 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -86.28 -28.36 23.81 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.996 0.816 . . . . 0.0 112.885 176.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 40.9 mttm -86.06 -36.21 19.81 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.017 1.327 . . . . 0.0 112.223 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 49.5 t -60.85 -48.4 82.0 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 127.067 2.147 . . . . 0.0 111.051 177.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -61.12 -34.96 75.8 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.322 -0.861 . . . . 0.0 112.335 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -72.25 -37.86 69.03 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.64 1.176 . . . . 0.0 112.069 177.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.7 -39.77 85.69 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.914 1.285 . . . . 0.0 110.78 176.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -68.68 -35.87 77.77 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 118.388 0.54 . . . . 0.0 111.137 175.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -66.72 -36.48 82.58 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.135 -0.978 . . . . 0.0 111.28 176.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -74.13 -27.25 60.77 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.648 1.179 . . . . 0.0 113.646 177.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 58.8 t-20 -137.54 101.06 4.38 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.538 1.135 . . . . 0.0 112.083 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . -71.82 -7.16 65.14 Favored Glycine 0 CA--C 1.54 1.599 0 N-CA-C 115.515 0.966 . . . . 0.0 115.515 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -81.43 -13.31 58.38 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 119.107 1.454 . . . . 0.0 112.796 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 26.9 m -118.15 162.19 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 126.062 1.745 . . . . 0.0 112.318 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 84.8 mtp180 -121.51 147.75 45.38 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.561 1.545 . . . . 0.0 111.413 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -65.02 165.96 10.15 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.262 1.425 . . . . 0.0 113.665 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 16.4 m -49.31 145.93 4.15 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.224 2.21 . . . . 0.0 116.409 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 67.1 m -93.5 -3.45 52.9 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.339 1.455 . . . . 0.0 111.193 171.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 41.5 tp -64.66 115.04 16.96 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 127.897 2.479 . . . . 0.0 109.238 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -59.74 -32.25 95.36 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.592 2.195 . . . . 0.0 113.841 -176.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -69.4 -37.09 77.33 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.588 -0.695 . . . . 0.0 112.578 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.7 t -67.61 -50.44 58.16 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.3 1.44 . . . . 0.0 109.258 175.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -55.49 -40.83 72.21 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.123 1.369 . . . . 0.0 111.585 174.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.3 m -64.74 -56.53 13.08 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.526 1.13 . . . . 0.0 111.044 177.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.7 mmt -64.25 -36.81 85.31 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.79 -32.08 73.41 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.909 1.686 . . . . 0.0 112.667 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -71.48 -41.4 69.37 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.165 0.586 . . . . 0.0 110.398 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 76.1 t -62.56 -48.06 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.467 0.707 . . . . 0.0 110.839 177.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.71 -44.63 90.44 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.918 0.887 . . . . 0.0 111.635 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -67.74 -17.43 64.55 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 177.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 58.2 t60 -88.75 -49.75 6.65 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.857 0.863 . . . . 0.0 109.512 173.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.2 ttp -56.77 -28.15 60.76 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.273 1.829 . . . . 0.0 113.591 -177.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.9 p -67.77 -27.7 66.99 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.569 1.148 . . . . 0.0 112.783 175.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -105.26 -17.55 14.42 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.775 1.63 . . . . 0.0 113.853 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 30.4 t -62.1 146.97 48.92 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.24 1.416 . . . . 0.0 112.218 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -116.79 -13.72 10.75 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.53 1.532 . . . . 0.0 113.881 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -94.81 -27.24 15.87 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.096 0.959 . . . . 0.0 112.373 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.34 -112.89 2.58 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.619 1.105 . . . . 0.0 113.007 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -61.78 -18.18 58.9 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 121.392 -1.064 . . . . 0.0 113.309 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.26 -0.25 44.35 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.45 1.5 . . . . 0.0 113.644 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 15.4 t -59.69 144.01 49.15 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 122.473 1.13 . . . . 0.0 110.779 179.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 56.4 mm-40 -78.52 -8.39 58.51 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.5 1.12 . . . . 0.0 113.053 -176.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 90.8 t -91.05 115.04 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 173.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.34 -36.88 66.76 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -177.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -67.49 -32.63 73.59 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.374 1.07 . . . . 0.0 112.809 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 47.9 t -74.73 -55.42 5.87 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.357 1.463 . . . . 0.0 109.72 177.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -54.91 -45.81 74.8 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.261 1.025 . . . . 0.0 112.624 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 23.8 p -63.9 -46.33 85.36 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 177.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 62.8 m -63.17 -33.22 75.01 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 118.859 0.754 . . . . 0.0 112.039 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -63.7 -30.8 71.86 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 118.168 -0.92 . . . . 0.0 112.674 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -63.98 -37.98 89.4 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.213 1.37 . . . . 0.0 110.692 173.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.9 mt -66.99 -42.49 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.205 1.002 . . . . 0.0 110.365 178.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 19.4 mm -66.09 -36.74 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 123.599 0.76 . . . . 0.0 110.911 176.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 54.1 m -66.11 -24.08 66.62 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.422 1.089 . . . . 0.0 113.251 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -62.35 -59.03 5.58 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.243 0.928 . . . . 0.0 110.852 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 56.5 m95 -60.61 -26.22 66.84 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 48.1 mttp -72.95 -33.75 66.1 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.869 0.868 . . . . 0.0 113.144 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.7 p30 -100.05 -29.56 12.45 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 6.3 t -79.05 133.92 36.78 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.439 1.096 . . . . 0.0 112.315 -178.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 74.2 p -130.12 2.14 4.74 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.658 1.583 . . . . 0.0 114.311 -178.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -78.31 155.78 29.98 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.203 1.401 . . . . 0.0 113.612 -178.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -88.56 -33.11 17.83 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.875 0.87 . . . . 0.0 110.646 171.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 19.8 t0 -103.03 80.24 1.84 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.851 2.06 . . . . 0.0 111.478 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 42.8 t -132.19 134.97 25.69 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 126.995 2.118 . . . . 0.0 107.958 177.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -59.96 -22.9 70.86 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 122.252 1.968 . . . . 0.0 113.52 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 5.0 t -92.14 -51.49 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 119.409 1.004 . . . . 0.0 111.634 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 19.6 m -65.68 -44.06 87.36 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -177.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.52 -56.4 27.27 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.149 -175.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -63.34 -30.65 73.25 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 121.789 1.675 . . . . 0.0 113.068 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 97.8 mt -69.84 -44.16 70.45 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.47 1.032 . . . . 0.0 111.288 176.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -64.74 -35.06 79.86 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.192 0.997 . . . . 0.0 111.184 175.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 57.4 t30 -68.12 -40.3 82.56 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.458 1.103 . . . . 0.0 111.065 175.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -72.76 -37.47 67.66 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.378 1.071 . . . . 0.0 112.763 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 89.7 p -87.77 31.58 0.76 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.474 1.91 . . . . 0.0 114.34 -179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 26.4 t0 -75.01 55.21 0.7 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.571 1.948 . . . . 0.0 112.669 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -71.61 43.29 0.09 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 128.15 2.58 . . . . 0.0 116.246 -176.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 48.8 mtm105 . . . . . 0 N--CA 1.477 0.917 0 C-N-CA 125.947 1.699 . . . . 0.0 111.941 178.736 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.313 0 CA-C-O 121.179 0.322 . . . . 0.0 113.859 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.7 m -57.11 -19.55 20.42 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -178.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -78.25 -14.31 59.49 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.877 1.271 . . . . 0.0 113.745 178.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 46.9 tpp -84.88 149.38 25.71 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.811 1.244 . . . . 0.0 112.306 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -79.9 169.27 18.13 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.815 1.246 . . . . 0.0 113.283 178.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -127.68 147.53 63.07 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.049 1.339 . . . . 0.0 112.204 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -71.97 152.99 57.98 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.348 2.699 . . . . 0.0 112.88 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -139.07 152.37 47.49 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.887 1.675 . . . . 0.0 110.835 178.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 56.8 m -135.8 153.01 51.65 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.163 1.385 . . . . 0.0 112.352 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 14.7 t70 -74.53 130.71 81.3 Favored Pre-proline 0 CA--C 1.553 1.089 0 C-N-CA 123.949 0.899 . . . . 0.0 111.416 178.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -82.16 -18.15 7.53 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 123.398 2.732 . . . . 0.0 115.279 -177.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 33.9 m -83.93 -31.13 25.79 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -176.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 8.4 p -76.63 147.98 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.269 1.028 . . . . 0.0 111.839 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -133.63 151.92 78.04 Favored Pre-proline 0 CA--C 1.547 0.858 0 C-N-CA 125.282 1.433 . . . . 0.0 111.102 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.32 -48.08 19.3 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.127 2.551 . . . . 0.0 116.447 -178.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -84.2 158.82 13.19 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 122.878 2.385 . . . . 0.0 112.558 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 8.9 tt -80.36 139.27 36.63 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.332 0.653 . . . . 0.0 110.548 175.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 29.2 t -121.75 161.3 22.86 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.419 1.888 . . . . 0.0 109.124 174.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 32.5 tp60 -61.68 -24.02 66.48 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.691 -1.255 . . . . 0.0 112.216 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -89.31 -6.61 56.58 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 176.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 95.9 m -58.32 -58.06 10.15 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.631 1.105 . . . . 0.0 111.07 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -60.19 -28.48 68.0 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.61 0.764 . . . . 0.0 112.924 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 42.5 m -70.19 -34.2 72.66 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.853 0.861 . . . . 0.0 112.631 178.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -90.1 -26.61 20.14 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.593 1.157 . . . . 0.0 113.365 175.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.2 tt -45.41 -60.04 2.37 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 126.913 2.085 . . . . 0.0 113.498 -176.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 40.0 p-90 -66.72 -10.52 47.71 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -173.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 9.1 ptmm? -112.12 -57.72 2.23 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 47.2 mt -116.05 13.96 15.95 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 -171.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.9 tt -55.06 135.98 67.47 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 125.701 1.6 . . . . 0.0 113.703 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.23 170.59 20.03 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.935 3.09 . . . . 0.0 113.667 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -67.42 2.17 1.87 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 -178.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 15.3 t30 -140.04 134.18 31.04 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.402 1.481 . . . . 0.0 110.444 177.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -149.72 163.56 37.62 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.017 0.927 . . . . 0.0 112.567 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 35.0 m -108.48 -17.29 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 125.481 1.513 . . . . 0.0 114.307 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.45 -1.81 56.25 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.574 1.55 . . . . 0.0 113.428 -178.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 15.4 m -57.88 109.87 2.11 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.391 1.877 . . . . 0.0 114.074 -177.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -67.65 134.87 34.08 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.311 2.674 . . . . 0.0 111.59 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 11.1 mp -77.85 131.13 71.11 Favored Pre-proline 0 CA--C 1.546 0.794 0 CA-C-O 118.216 -0.897 . . . . 0.0 111.661 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -54.78 -33.92 82.73 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 123.483 2.788 . . . . 0.0 114.388 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 52.6 p -71.31 -13.23 61.81 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.259 1.424 . . . . 0.0 113.962 178.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -124.69 10.11 8.36 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.763 2.025 . . . . 0.0 112.027 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.49 156.89 38.56 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -175.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.57 23.8 3.34 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 128.473 2.709 . . . . 0.0 112.949 178.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 35.3 t70 -60.28 -24.73 65.17 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.261 1.424 . . . . 0.0 114.414 -176.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -68.45 -16.4 63.89 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 113.674 0.991 . . . . 0.0 113.674 178.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 24.0 tp -105.45 7.73 33.23 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.939 1.696 . . . . 0.0 112.521 179.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 62.1 mmm -67.3 159.5 29.11 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.732 1.753 . . . . 0.0 115.732 -177.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 96.3 mt -125.06 170.51 11.1 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 127.666 2.386 . . . . 0.0 112.766 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 30.7 t -86.36 146.65 42.67 Favored Pre-proline 0 CA--C 1.543 0.696 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 169.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.8 Cg_exo -54.14 -21.45 22.14 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.89 2.394 . . . . 0.0 115.087 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 32.7 t70 -73.27 -22.07 60.46 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.342 1.057 . . . . 0.0 113.006 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -78.92 -17.44 55.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.062 0.945 . . . . 0.0 112.994 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.65 -34.26 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 125.134 1.374 . . . . 0.0 110.667 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -68.41 -10.03 52.43 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.702 1.201 . . . . 0.0 113.814 178.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 52.6 tp60 -82.35 -39.11 23.24 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.093 -1.004 . . . . 0.0 111.373 177.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.255 3.9 p-90 -90.9 -26.35 19.36 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -117.72 109.73 16.98 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 104.225 -2.509 . . . . 0.0 104.225 169.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.18 147.07 27.08 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -171.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 23.3 mp0 -75.9 168.36 20.17 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.772 1.229 . . . . 0.0 111.386 176.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 13.6 t70 -59.9 136.46 90.38 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 124.082 0.953 . . . . 0.0 112.631 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.01 -20.49 57.33 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.822 3.015 . . . . 0.0 115.364 -178.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 65.06 -143.62 46.68 Favored Glycine 0 CA--C 1.543 1.814 0 O-C-N 121.317 -0.865 . . . . 0.0 112.538 -178.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -78.45 -6.11 15.3 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 123.953 3.102 . . . . 0.0 115.574 -177.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -136.76 -44.65 0.59 Allowed 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -177.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 64.67 20.78 66.47 Favored Glycine 0 CA--C 1.54 1.61 0 CA-C-N 119.338 0.972 . . . . 0.0 115.326 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 20.7 m -50.71 -37.69 42.96 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 -176.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 62.2 m -57.51 -26.41 61.27 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.524 1.53 . . . . 0.0 114.433 -178.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -64.68 -23.34 67.22 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.007 0.821 . . . . 0.0 112.961 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -67.72 -28.65 67.83 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.248 -0.907 . . . . 0.0 111.461 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -73.54 -12.59 80.36 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 125.336 1.446 . . . . 0.0 114.759 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 3.7 t -124.97 4.38 8.0 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.365 1.466 . . . . 0.0 113.197 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -61.82 -21.42 64.61 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.952 1.301 . . . . 0.0 113.877 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 33.0 p -73.05 -15.26 61.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.485 1.514 . . . . 0.0 112.777 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -155.25 81.32 0.17 Allowed Glycine 0 CA--C 1.535 1.335 0 C-N-CA 125.994 1.759 . . . . 0.0 111.159 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.24 155.26 30.33 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 124.117 3.211 . . . . 0.0 113.315 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 33.1 p -49.89 -36.37 27.1 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.883 1.438 . . . . 0.0 114.883 -178.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -76.44 -4.28 41.62 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.498 1.519 . . . . 0.0 114.969 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 13.7 t70 -65.9 138.05 96.25 Favored Pre-proline 0 CA--C 1.549 0.93 0 O-C-N 121.12 -0.987 . . . . 0.0 111.219 178.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 81.3 Cg_exo -49.57 -35.23 36.71 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.546 2.83 . . . . 0.0 115.373 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -67.87 -25.3 65.45 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -90.19 -39.17 12.98 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.29 1.436 . . . . 0.0 111.232 173.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 6.9 mmp_? -58.47 -42.98 88.7 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.957 0.903 . . . . 0.0 111.544 176.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -64.43 -28.65 69.82 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 177.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 98.7 mt -69.92 -37.86 76.06 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.534 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -63.13 -52.75 55.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 174.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -52.51 -55.71 20.22 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.949 0.9 . . . . 0.0 111.412 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -34.26 77.41 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -178.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -69.47 -44.87 70.29 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.485 1.039 . . . . 0.0 110.365 177.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 5.1 tt -60.07 -43.8 95.21 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.603 1.161 . . . . 0.0 110.017 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 85.4 t -58.94 -31.43 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.1 0.864 . . . . 0.0 111.525 175.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 4.4 tp -72.26 -29.61 64.07 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.137 1.335 . . . . 0.0 112.816 175.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -60.97 -33.83 73.82 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 120.394 1.452 . . . . 0.0 109.14 174.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 7.0 mt -66.7 -51.84 51.47 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.307 1.043 . . . . 0.0 109.998 175.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 31.4 t60 -57.3 -57.35 13.0 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 119.19 -0.433 . . . . 0.0 110.291 177.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -51.79 -41.21 61.51 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.419 1.088 . . . . 0.0 113.548 -178.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -75.32 -35.99 61.13 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 36.9 mttm -73.31 -46.84 47.2 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.954 0.902 . . . . 0.0 110.844 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 35.3 t -55.79 -45.51 78.19 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 127.123 2.169 . . . . 0.0 111.151 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -52.16 -51.42 58.1 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.782 1.633 . . . . 0.0 112.659 175.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -88.55 -16.47 32.52 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 113.985 1.106 . . . . 0.0 113.985 -174.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -33.6 69.34 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 125.406 1.483 . . . . 0.0 112.161 175.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.09 -29.98 65.97 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.817 -0.552 . . . . 0.0 111.687 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -61.68 -27.6 68.8 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.005 0.922 . . . . 0.0 112.534 179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -78.39 -9.94 59.49 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.835 1.254 . . . . 0.0 114.112 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -124.74 -50.92 1.71 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.582 1.153 . . . . 0.0 114.075 -177.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 75.16 3.22 68.89 Favored Glycine 0 CA--C 1.54 1.641 0 N-CA-C 117.088 1.595 . . . . 0.0 117.088 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -125.64 -32.49 2.86 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.012 1.906 . . . . 0.0 114.271 -178.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 27.3 m -70.47 153.83 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 O-C-N 121.215 -0.928 . . . . 0.0 112.217 179.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -82.97 158.0 22.75 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.355 1.062 . . . . 0.0 112.212 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -76.95 174.7 10.3 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.784 1.234 . . . . 0.0 113.567 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -62.9 160.81 13.96 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.409 1.884 . . . . 0.0 114.936 -177.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 62.5 m -105.5 -7.05 18.89 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.711 1.604 . . . . 0.0 113.704 178.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 4.4 mp -77.74 130.53 73.21 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 119.046 0.839 . . . . 0.0 112.207 -179.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -68.51 -37.05 13.71 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.563 2.175 . . . . 0.0 111.341 178.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 37.7 m80 -71.23 -31.09 67.14 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.949 0.9 . . . . 0.0 112.745 178.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.5 t -66.42 -51.84 52.7 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.806 1.243 . . . . 0.0 109.019 175.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -55.87 -38.86 70.69 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.806 1.242 . . . . 0.0 111.367 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 33.1 m -66.16 -57.14 8.29 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.959 0.904 . . . . 0.0 111.538 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.2 mmt -64.35 -36.33 83.79 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -177.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -64.71 -28.9 69.91 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 120.738 1.608 . . . . 0.0 112.773 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -74.06 -39.74 63.27 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.129 0.572 . . . . 0.0 110.449 173.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 92.8 t -63.01 -44.84 99.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 121.753 -0.592 . . . . 0.0 110.744 176.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.54 -44.8 95.71 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.957 0.903 . . . . 0.0 110.576 177.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -63.52 -31.4 72.55 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.127 0.876 . . . . 0.0 113.202 175.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 74.5 t60 -74.73 -50.64 16.74 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.324 -0.86 . . . . 0.0 109.303 175.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.7 ttp -58.65 -30.95 67.71 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.32 1.848 . . . . 0.0 114.127 -177.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 25.0 p -70.22 -27.85 64.81 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 119.958 1.254 . . . . 0.0 112.307 174.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 78.6 t60 -96.83 -24.02 16.1 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.032 1.733 . . . . 0.0 113.556 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 20.0 t -60.06 148.68 34.87 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.373 1.469 . . . . 0.0 113.182 -177.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -113.87 -14.59 12.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.303 1.841 . . . . 0.0 113.503 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -103.9 -31.98 9.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.453 1.101 . . . . 0.0 112.536 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.55 -107.78 0.58 Allowed Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.559 1.076 . . . . 0.0 113.601 177.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 64.6 tttp -59.29 -25.51 64.17 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.034 -1.274 . . . . 0.0 112.48 177.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -94.97 -0.23 54.05 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.453 1.501 . . . . 0.0 113.833 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.1 t -61.71 143.64 55.87 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 122.407 1.099 . . . . 0.0 110.581 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.8 mm-40 -80.15 -6.14 57.24 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.513 1.125 . . . . 0.0 113.373 -176.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 16.8 t -92.82 124.53 45.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.748 1.219 . . . . 0.0 108.653 175.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.59 -46.25 70.3 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -176.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.56 -31.88 71.4 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 -178.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 51.2 t -67.65 -57.48 6.32 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.914 0.886 . . . . 0.0 109.859 178.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -61.76 -15.53 41.93 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.7 m -89.05 -55.61 3.61 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.341 1.057 . . . . 0.0 112.121 176.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.2 m -61.34 -31.98 71.86 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.478 1.036 . . . . 0.0 111.989 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -61.43 -32.75 72.72 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.548 -0.72 . . . . 0.0 111.987 175.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -66.26 -32.28 73.6 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.503 1.047 . . . . 0.0 111.481 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 12.3 mt -71.18 -46.83 64.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.252 1.021 . . . . 0.0 109.675 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 23.2 mm -60.87 -44.06 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 123.942 0.897 . . . . 0.0 110.687 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 44.9 m -57.56 -22.44 44.69 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 178.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.0 t60 -63.31 -53.06 58.71 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.636 1.107 . . . . 0.0 110.277 176.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 64.6 m95 -65.05 -27.91 69.12 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -68.72 -33.02 73.22 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.579 0.752 . . . . 0.0 112.31 175.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -100.04 -35.64 9.63 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 -177.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.2 t -80.53 137.18 36.4 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.352 1.461 . . . . 0.0 112.555 -176.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 22.1 m -129.99 -19.77 3.19 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.476 1.511 . . . . 0.0 113.274 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -68.39 140.78 55.84 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.514 1.525 . . . . 0.0 112.048 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -77.81 -38.11 47.16 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.222 0.609 . . . . 0.0 112.387 177.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 24.0 t70 -86.98 69.95 10.28 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.055 1.742 . . . . 0.0 111.745 179.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.8 t -124.17 135.22 26.14 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 126.543 1.937 . . . . 0.0 109.763 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -58.89 -25.47 77.11 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.964 2.443 . . . . 0.0 114.405 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.5 t -92.21 -51.16 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 119.748 1.158 . . . . 0.0 111.726 176.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.8 m -69.6 -39.64 77.14 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -175.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.5 tt -56.44 -55.65 40.31 Favored Pre-proline 0 CA--C 1.547 0.852 0 O-C-N 120.893 -1.129 . . . . 0.0 112.76 -178.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -61.44 -28.79 84.24 Favored 'Trans proline' 0 C--N 1.353 0.765 0 CA-C-N 121.609 1.61 . . . . 0.0 113.264 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 91.2 mt -70.15 -45.53 66.59 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.807 1.185 . . . . 0.0 111.401 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -63.84 -33.27 75.32 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.191 0.597 . . . . 0.0 111.229 176.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 59.1 t30 -72.81 -40.63 65.67 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.79 1.236 . . . . 0.0 111.833 176.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -73.68 -27.03 61.01 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.044 1.338 . . . . 0.0 113.892 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 47.8 t -58.53 134.02 56.34 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.113 0.965 . . . . 0.0 112.993 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 24.6 t70 -77.24 -2.76 36.31 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.63 1.172 . . . . 0.0 113.521 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 62.2 mttm -70.93 -0.65 9.7 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.257 1.423 . . . . 0.0 114.756 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 72.2 mtm-85 . . . . . 0 N--CA 1.479 1.006 0 C-N-CA 127.595 2.358 . . . . 0.0 110.973 176.666 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.392 0 N-CA-C 114.804 0.682 . . . . 0.0 114.804 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.1 p -85.54 -5.33 59.29 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.857 1.663 . . . . 0.0 114.223 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -64.06 147.95 50.94 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.729 1.612 . . . . 0.0 113.104 -179.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 56.8 ttm -76.04 145.89 39.85 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.471 1.108 . . . . 0.0 111.718 178.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -73.54 155.43 39.17 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.991 0.916 . . . . 0.0 113.279 178.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -146.67 -43.33 0.01 OUTLIER Pre-proline 0 CA--C 1.551 1.005 0 N-CA-C 114.841 1.423 . . . . 0.0 114.841 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -56.68 143.1 90.64 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 122.95 2.434 . . . . 0.0 114.667 -178.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -115.9 158.59 22.76 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.88 1.672 . . . . 0.0 111.523 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 22.6 p -72.15 -53.96 11.13 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.069 0.947 . . . . 0.0 112.327 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 39.8 t0 -157.63 122.09 2.27 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 125.617 1.567 . . . . 0.0 110.294 177.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.75 -26.35 79.63 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 123.269 2.646 . . . . 0.0 115.177 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 66.4 m -137.2 100.77 4.35 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.563 1.545 . . . . 0.0 110.585 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 24.6 m -80.65 -28.93 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -178.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -137.74 60.87 26.81 Favored Pre-proline 0 CA--C 1.553 1.09 0 C-N-CA 124.658 1.183 . . . . 0.0 112.587 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.31 -29.23 38.82 Favored 'Trans proline' 0 CA--C 1.553 1.451 0 C-N-CA 122.691 2.26 . . . . 0.0 117.501 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -80.48 157.45 22.19 Favored 'Trans proline' 0 C--N 1.358 1.052 0 CA-C-N 123.957 2.449 . . . . 0.0 113.132 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 8.1 tt -83.27 136.01 34.54 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.276 1.03 . . . . 0.0 111.18 177.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 41.9 t -90.38 144.43 25.83 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.465 1.106 . . . . 0.0 110.957 176.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -58.0 -24.4 58.03 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.842 0.857 . . . . 0.0 113.247 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -64.26 -23.13 67.19 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.024 0.93 . . . . 0.0 111.964 176.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 20.9 m -66.75 -60.18 2.91 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.746 0.819 . . . . 0.0 109.909 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -60.26 -31.37 70.15 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.772 0.829 . . . . 0.0 112.738 174.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 54.0 m -69.45 -32.8 71.96 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.1 t70 -90.08 -29.52 18.29 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.74 1.216 . . . . 0.0 113.058 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -45.2 -58.14 3.46 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.843 2.057 . . . . 0.0 113.508 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -69.99 -9.76 56.29 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -112.06 -51.78 2.83 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 116.835 2.161 . . . . 0.0 116.835 -176.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 55.4 mt -117.04 20.19 13.92 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -170.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 7.5 tp -51.6 136.01 34.01 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.911 1.685 . . . . 0.0 115.012 -174.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -69.72 163.92 36.45 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.472 2.781 . . . . 0.0 111.498 175.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -69.77 -11.27 60.73 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.971 1.841 . . . . 0.0 115.971 -177.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 27.4 m120 -128.81 119.09 23.88 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.57 1.148 . . . . 0.0 111.1 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -158.31 150.26 21.61 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.273 1.429 . . . . 0.0 111.096 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 34.0 m -133.54 20.95 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 125.096 1.359 . . . . 0.0 114.334 -178.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 4.3 tt -66.56 -47.33 73.16 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.713 1.205 . . . . 0.0 112.704 -178.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 29.1 p -74.56 152.66 87.5 Favored Pre-proline 0 N--CA 1.473 0.704 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -177.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -70.88 149.25 59.41 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.247 2.631 . . . . 0.0 112.051 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 90.1 mt -79.21 157.12 76.01 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 124.599 1.159 . . . . 0.0 110.688 176.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -53.43 -29.1 47.28 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.543 2.829 . . . . 0.0 115.278 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 51.3 p -72.15 -14.06 61.72 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.329 1.452 . . . . 0.0 114.21 177.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -134.95 15.35 3.57 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.213 1.805 . . . . 0.0 113.447 -179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.33 160.99 31.46 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.727 1.211 . . . . 0.0 113.149 -179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 71.7 mtm -90.92 31.85 1.04 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.173 1.389 . . . . 0.0 113.076 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -64.98 -17.62 64.57 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -178.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -66.63 -17.77 65.01 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 121.385 -0.822 . . . . 0.0 112.106 174.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 83.7 mt -111.32 11.43 21.63 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.992 2.117 . . . . 0.0 112.338 178.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 5.6 tpt -62.98 135.41 57.28 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -173.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.5 tt -124.99 144.88 50.15 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.391 2.276 . . . . 0.0 111.379 -177.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 52.2 m -73.24 151.53 90.08 Favored Pre-proline 0 N--CA 1.475 0.811 0 C-N-CA 124.946 1.299 . . . . 0.0 113.141 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -60.78 -23.92 77.65 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.574 2.849 . . . . 0.0 115.252 -177.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -78.71 -23.76 45.33 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.47 -0.769 . . . . 0.0 112.315 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -83.48 -9.86 58.71 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.61 1.564 . . . . 0.0 112.526 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 89.2 mt -57.87 -32.16 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 119.131 0.878 . . . . 0.0 109.46 173.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -69.74 -9.92 56.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.372 1.069 . . . . 0.0 113.476 177.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -77.89 -28.78 49.98 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.109 0.964 . . . . 0.0 111.7 177.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.4 p-90 -102.06 -35.54 8.9 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.068 0.947 . . . . 0.0 112.853 177.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 16.8 m-30 -111.13 109.6 19.74 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 169.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 6.7 t -125.26 168.45 13.47 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.19 1.396 . . . . 0.0 113.583 179.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -97.22 176.54 5.88 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.375 1.87 . . . . 0.0 111.794 176.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 10.3 t70 -65.68 124.57 87.76 Favored Pre-proline 0 CA--C 1.555 1.136 0 O-C-N 120.765 -1.209 . . . . 0.0 110.284 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -77.87 -11.16 16.75 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.327 2.685 . . . . 0.0 115.473 -175.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 55.54 -123.54 30.56 Favored Glycine 0 CA--C 1.543 1.791 0 CA-C-O 118.943 -0.921 . . . . 0.0 112.825 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -68.27 -16.67 44.31 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.37 2.714 . . . . 0.0 113.901 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 29.3 t70 -87.74 4.39 44.38 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.781 1.232 . . . . 0.0 112.978 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -61.14 -12.59 31.23 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 125.383 1.468 . . . . 0.0 116.471 -178.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 25.4 p -62.53 -27.09 68.92 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.183 1.492 . . . . 0.0 113.684 178.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 90.3 m -91.47 -2.99 57.06 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.293 1.437 . . . . 0.0 113.408 177.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -96.85 125.32 41.21 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -176.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 55.5 t-20 -148.42 -103.03 0.08 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.575 1.95 . . . . 0.0 108.441 177.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -66.5 -15.23 63.55 Favored Glycine 0 CA--C 1.542 1.751 0 CA-C-N 119.482 1.037 . . . . 0.0 112.768 173.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 1.8 p -75.38 -10.78 59.76 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 129.292 3.037 . . . . 0.0 113.387 175.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -96.44 150.81 20.18 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.094 1.358 . . . . 0.0 112.007 178.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 29.3 m -74.39 132.92 42.42 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.891 0.877 . . . . 0.0 111.039 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 143.81 -56.34 0.55 Allowed Glycine 0 CA--C 1.539 1.582 0 CA-C-O 118.448 -1.196 . . . . 0.0 115.043 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -56.48 136.47 75.96 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.881 3.054 . . . . 0.0 114.894 -177.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 41.9 p -105.85 -5.85 19.43 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.945 1.698 . . . . 0.0 113.767 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -74.46 -9.48 58.62 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.6 1.334 . . . . 0.0 114.6 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 10.3 t70 -100.6 109.88 58.75 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.944 1.298 . . . . 0.0 111.657 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.75 -28.32 9.76 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.029 2.486 . . . . 0.0 113.685 -179.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -62.91 -47.92 81.18 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.794 0.838 . . . . 0.0 111.142 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -58.13 -47.59 82.82 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.401 -0.812 . . . . 0.0 110.476 176.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 27.3 ttp-105 -57.04 -51.29 69.84 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.535 1.134 . . . . 0.0 112.509 178.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -67.41 -29.69 69.26 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.112 0.869 . . . . 0.0 112.766 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 60.4 mt -66.37 -42.13 88.46 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.941 0.791 . . . . 0.0 111.192 174.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.4 mt -64.22 -51.23 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.527 1.058 . . . . 0.0 109.569 175.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -53.88 -52.13 61.45 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.533 0.733 . . . . 0.0 111.558 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -37.05 85.68 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.176 0.898 . . . . 0.0 113.099 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 16.1 tp60 -69.82 -44.08 70.69 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.794 0.724 . . . . 0.0 111.045 178.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.0 tt -63.45 -41.91 98.64 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.471 0.709 . . . . 0.0 110.231 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 94.5 t -59.8 -32.21 49.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 119.398 0.999 . . . . 0.0 111.15 174.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 1.6 tp -71.2 -26.31 62.9 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.913 -1.117 . . . . 0.0 112.995 175.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.33 -29.13 70.22 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 120.597 1.544 . . . . 0.0 109.612 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.3 mt -73.37 -53.63 10.28 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.734 1.213 . . . . 0.0 108.906 175.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 15.4 t60 -54.98 -56.06 23.95 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 122.887 0.475 . . . . 0.0 110.792 177.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -55.99 -23.49 32.9 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -90.07 -33.6 16.24 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.144 -0.972 . . . . 0.0 113.112 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 42.4 mttm -82.34 -31.13 30.02 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.441 1.497 . . . . 0.0 112.693 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.1 t -68.98 -51.91 34.52 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.227 2.211 . . . . 0.0 111.488 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -54.45 -30.85 54.09 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 121.062 -1.024 . . . . 0.0 113.405 178.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -67.09 -24.02 65.9 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.821 1.248 . . . . 0.0 113.08 177.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -36.42 84.16 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.771 1.169 . . . . 0.0 112.109 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -78.15 -35.01 49.43 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.444 1.098 . . . . 0.0 110.965 177.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 15.6 tp60 -66.73 -36.21 81.92 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.491 -0.755 . . . . 0.0 110.96 175.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -78.91 -24.7 43.91 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.651 1.18 . . . . 0.0 113.443 178.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 60.2 t-20 -144.47 108.13 4.66 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.512 1.125 . . . . 0.0 112.605 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . -72.33 -9.19 72.41 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 115.433 0.933 . . . . 0.0 115.433 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -81.17 -13.24 58.82 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.061 1.431 . . . . 0.0 112.869 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 30.5 m -126.26 165.66 23.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 126.233 1.813 . . . . 0.0 112.006 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -119.29 158.53 25.88 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.966 1.707 . . . . 0.0 111.999 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -80.31 178.01 8.58 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.736 1.214 . . . . 0.0 111.667 176.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 2.2 m -51.91 146.09 8.91 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 116.328 1.973 . . . . 0.0 116.328 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 68.7 p -97.68 -4.63 36.93 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.677 1.991 . . . . 0.0 111.197 170.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 3.4 tt -59.77 115.8 14.27 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 128.393 2.677 . . . . 0.0 108.67 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -51.03 -43.44 47.93 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.678 2.918 . . . . 0.0 116.054 -174.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 75.7 m80 -73.68 -29.36 62.26 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.9 t -68.03 -50.23 56.65 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 174.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -56.06 -37.2 68.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.577 1.551 . . . . 0.0 111.563 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 24.1 m -68.26 -58.18 4.82 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.511 1.124 . . . . 0.0 111.296 176.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -39.14 91.09 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.564 -0.732 . . . . 0.0 112.729 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -63.27 -33.77 76.22 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.483 1.492 . . . . 0.0 112.956 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -70.83 -41.06 72.01 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.118 0.567 . . . . 0.0 110.582 174.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 70.1 t -63.84 -47.28 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.381 0.672 . . . . 0.0 110.989 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.58 -43.99 89.65 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.998 0.919 . . . . 0.0 111.237 179.034 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -68.39 -17.07 64.14 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 176.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 56.6 t60 -89.99 -48.33 7.28 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.916 0.886 . . . . 0.0 109.963 174.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.7 ttp -56.41 -27.77 57.46 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.377 1.871 . . . . 0.0 113.392 -178.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 12.4 p -69.53 -24.27 63.71 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.976 1.31 . . . . 0.0 113.037 175.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 66.0 m80 -108.96 -17.77 13.84 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.261 1.824 . . . . 0.0 114.093 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.9 t -61.19 149.05 38.74 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.542 1.537 . . . . 0.0 112.72 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -118.38 -15.15 9.72 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.891 1.676 . . . . 0.0 113.747 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -98.8 -28.89 13.28 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.325 1.05 . . . . 0.0 112.802 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.13 -111.24 1.89 Allowed Glycine 0 CA--C 1.536 1.376 0 C-N-CA 124.336 0.969 . . . . 0.0 113.112 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.7 mttt -61.28 -20.82 63.32 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 121.22 -1.164 . . . . 0.0 113.226 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.95 -0.6 50.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.637 1.575 . . . . 0.0 113.537 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.5 t -63.95 141.53 58.73 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.114 0.959 . . . . 0.0 109.935 177.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -80.33 -5.14 55.86 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.208 1.003 . . . . 0.0 113.675 -175.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 84.1 t -89.21 112.98 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 172.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.55 -38.76 64.14 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -69.31 -30.98 69.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.481 1.113 . . . . 0.0 113.423 -178.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 41.5 t -73.1 -54.82 7.54 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.135 1.374 . . . . 0.0 108.997 176.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.83 -25.59 65.11 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 90.1 p -82.24 -48.88 10.73 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.386 0.993 . . . . 0.0 112.151 175.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 69.8 m -61.59 -33.59 74.14 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.372 -0.83 . . . . 0.0 112.259 178.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 43.9 tpt85 -61.63 -29.99 70.41 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.486 -0.759 . . . . 0.0 112.934 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -71.0 -32.61 69.47 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.019 0.927 . . . . 0.0 111.212 176.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 27.9 mt -70.78 -44.76 75.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 124.156 0.982 . . . . 0.0 109.227 176.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 22.7 mm -61.79 -36.71 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.984 0.914 . . . . 0.0 110.947 174.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 61.0 m -63.02 -23.56 67.51 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.676 0.79 . . . . 0.0 113.121 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 6.8 t60 -63.63 -58.35 7.2 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.331 0.969 . . . . 0.0 110.694 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 56.2 m95 -61.69 -23.19 65.94 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 177.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 94.4 mttt -76.49 -35.57 58.31 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.937 0.895 . . . . 0.0 112.768 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -100.03 -30.31 12.04 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 179.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.6 t -76.14 136.52 39.81 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.099 1.359 . . . . 0.0 111.469 -179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.8 p -127.72 -6.98 5.64 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -176.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 -81.76 147.22 29.55 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.353 1.061 . . . . 0.0 113.335 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.7 p-80 -81.67 -27.8 33.86 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.738 0.815 . . . . 0.0 110.534 171.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 16.1 p-10 -98.69 69.93 1.88 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.487 2.315 . . . . 0.0 111.94 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 54.0 t -127.14 134.71 26.43 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 126.533 1.933 . . . . 0.0 109.248 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -57.0 -26.97 71.3 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 123.099 2.533 . . . . 0.0 114.551 -178.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 8.1 t -92.14 -52.96 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-N 119.441 1.019 . . . . 0.0 111.59 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.4 m -67.22 -39.11 86.22 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -174.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.1 tt -54.24 -57.79 16.71 Favored Pre-proline 0 CA--C 1.547 0.844 0 CA-C-O 117.804 -1.093 . . . . 0.0 113.209 -177.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.53 -31.25 92.14 Favored 'Trans proline' 0 C--N 1.352 0.736 0 CA-C-N 121.644 1.623 . . . . 0.0 113.041 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.13 -49.87 46.33 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.01 0.924 . . . . 0.0 112.44 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -65.52 -28.92 69.52 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.108 0.867 . . . . 0.0 111.862 176.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 9.4 t30 -71.87 -43.1 66.02 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.71 1.204 . . . . 0.0 111.949 175.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -76.89 -28.08 55.22 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -179.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 47.5 t -58.7 139.93 55.43 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 -175.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 36.9 t70 -76.61 -13.87 60.03 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.849 1.259 . . . . 0.0 111.843 174.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.06 -1.41 57.86 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.508 1.523 . . . . 0.0 112.976 177.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 . . . . . 0 N--CA 1.477 0.899 0 C-N-CA 126.612 1.965 . . . . 0.0 111.862 178.366 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.381 0 N-CA-C 114.709 0.643 . . . . 0.0 114.709 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.0 m -58.28 -19.52 35.12 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.884 1.674 . . . . 0.0 114.848 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 41.1 m80 -80.43 -10.64 59.74 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.085 1.354 . . . . 0.0 113.972 178.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 50.7 tpp -72.78 142.77 48.09 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.341 1.056 . . . . 0.0 112.097 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -148.93 139.07 22.24 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.162 1.385 . . . . 0.0 110.757 178.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -152.8 153.07 29.6 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.575 1.55 . . . . 0.0 110.87 178.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -58.05 129.17 31.79 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.017 2.478 . . . . 0.0 114.168 -178.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -128.22 1.3 5.78 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.797 1.639 . . . . 0.0 114.045 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 61.6 p -97.05 -0.34 47.38 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.976 1.71 . . . . 0.0 114.725 -178.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 15.9 t70 -66.91 126.39 92.36 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 124.319 1.047 . . . . 0.0 112.535 -179.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -86.23 -16.22 4.17 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.542 2.828 . . . . 0.0 114.846 -178.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 27.6 m -83.72 -26.01 30.12 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 -175.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 10.2 p -71.06 145.92 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 124.324 1.05 . . . . 0.0 112.193 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -134.93 153.83 78.85 Favored Pre-proline 0 CA--C 1.549 0.904 0 C-N-CA 125.443 1.497 . . . . 0.0 111.644 179.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -58.5 -44.52 36.81 Favored 'Trans proline' 0 CA--C 1.547 1.162 0 C-N-CA 123.503 2.802 . . . . 0.0 118.193 -177.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -81.11 163.27 20.18 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.897 2.398 . . . . 0.0 114.619 -176.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 8.0 tt -74.91 144.23 43.39 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.76 1.224 . . . . 0.0 111.284 176.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 39.4 t -99.93 146.54 26.56 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.254 1.422 . . . . 0.0 112.247 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 9.1 pm0 -59.43 -24.36 63.43 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -63.06 -27.1 69.17 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.556 -0.715 . . . . 0.0 112.065 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 90.8 m -67.83 -60.0 2.86 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.357 1.063 . . . . 0.0 110.122 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.19 -30.88 69.64 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 175.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 22.9 t -70.13 -33.65 72.09 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.5 t70 -90.15 -26.13 20.33 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.849 -1.157 . . . . 0.0 113.437 174.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -42.63 -58.02 2.47 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.891 2.076 . . . . 0.0 113.106 -179.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 45.3 p-90 -70.52 -11.91 61.23 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -172.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 50.4 pttt -112.03 -60.27 1.88 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -177.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 58.2 mt -120.21 18.59 12.28 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 116.65 2.092 . . . . 0.0 116.65 -172.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 5.4 tt -52.58 133.67 45.12 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 125.266 1.426 . . . . 0.0 113.595 -178.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.26 163.22 38.7 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 124.357 3.371 . . . . 0.0 114.209 -177.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 30.7 mp0 -59.67 -15.99 23.34 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 126.026 1.731 . . . . 0.0 115.203 -177.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 55.2 t30 -134.82 138.19 44.02 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.441 1.496 . . . . 0.0 110.844 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -150.34 151.42 32.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.56 1.544 . . . . 0.0 110.571 178.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 8.8 p -67.98 -29.24 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 55.5 tp -92.0 110.1 21.45 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.324 1.05 . . . . 0.0 111.012 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 22.7 t -115.23 99.82 52.84 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 124.076 0.95 . . . . 0.0 110.103 172.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -83.94 105.02 1.12 Allowed 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.507 2.805 . . . . 0.0 111.06 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 82.4 mt -75.05 152.92 86.54 Favored Pre-proline 0 CA--C 1.546 0.811 0 O-C-N 121.415 -0.803 . . . . 0.0 112.275 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.75 -28.87 68.88 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 123.225 2.617 . . . . 0.0 114.172 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 40.2 p -75.19 -22.06 58.27 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.647 1.579 . . . . 0.0 113.228 176.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -95.01 -29.76 14.45 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.283 1.833 . . . . 0.0 111.538 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -64.95 155.06 35.71 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.333 1.453 . . . . 0.0 112.754 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 65.5 mtm -90.15 28.49 1.4 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.559 1.543 . . . . 0.0 113.744 -178.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 35.1 t70 -56.71 -22.06 32.38 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -178.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.1 t70 -63.77 -18.01 63.63 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 121.126 -0.984 . . . . 0.0 112.88 176.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 22.7 tp -111.07 12.43 22.0 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 127.077 2.151 . . . . 0.0 111.923 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 7.7 tpt -71.95 154.65 41.06 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -176.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 25.7 mt -124.26 169.81 11.39 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.503 2.321 . . . . 0.0 112.546 -176.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.2 m -76.92 151.44 82.06 Favored Pre-proline 0 CA--C 1.544 0.729 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 169.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -60.07 -14.59 29.13 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 123.086 2.524 . . . . 0.0 115.264 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.0 t70 -78.96 -19.17 52.36 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 120.916 -1.115 . . . . 0.0 112.978 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -81.65 -13.31 58.08 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.356 1.062 . . . . 0.0 113.081 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 91.3 mt -54.84 -36.93 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.471 1.509 . . . . 0.0 111.495 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -76.1 -9.91 59.0 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -84.53 -25.09 29.01 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.138 0.975 . . . . 0.0 113.526 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -72.27 -44.19 63.17 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.556 1.071 . . . . 0.0 112.301 -178.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -80.2 109.83 15.04 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 178.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 1.2 m -74.86 137.31 41.71 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.068 0.947 . . . . 0.0 113.053 -174.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -79.4 163.76 24.56 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.048 1.339 . . . . 0.0 112.338 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -68.78 145.89 97.16 Favored Pre-proline 0 CA--C 1.551 0.986 0 O-C-N 121.363 -0.836 . . . . 0.0 112.467 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -72.16 -24.28 20.33 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.116 2.544 . . . . 0.0 114.06 -179.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 70.43 -124.2 12.76 Favored Glycine 0 CA--C 1.544 1.849 0 CA-C-O 118.55 -1.139 . . . . 0.0 111.83 -178.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -72.28 -24.17 20.06 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.152 2.568 . . . . 0.0 115.265 -177.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 4.2 p30 -154.36 147.33 24.54 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.776 1.171 . . . . 0.0 113.416 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -83.99 15.42 38.19 Favored Glycine 0 CA--C 1.532 1.146 0 N-CA-C 116.747 1.459 . . . . 0.0 116.747 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 63.2 m -67.18 111.16 3.78 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 119.756 1.778 . . . . 0.0 109.317 177.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 20.0 p -72.07 160.44 32.48 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.018 1.727 . . . . 0.0 114.252 -175.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 29.5 p90 -147.35 -177.63 5.8 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.959 1.703 . . . . 0.0 112.327 -173.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 9.5 t30 -52.93 125.73 18.05 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 120.868 -1.145 . . . . 0.0 111.648 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . 94.95 -40.97 2.59 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.365 1.459 . . . . 0.0 113.072 -177.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 78.5 p -85.69 -47.25 9.96 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 118.994 1.397 . . . . 0.0 111.408 178.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -64.4 -29.02 70.09 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.603 1.161 . . . . 0.0 110.857 173.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 3.5 m -68.46 -20.67 64.63 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 126.736 2.014 . . . . 0.0 112.374 178.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 175.82 95.32 0.1 OUTLIER Glycine 0 CA--C 1.537 1.426 0 CA-C-O 118.464 -1.187 . . . . 0.0 114.01 178.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -63.62 179.21 1.03 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 124.076 3.184 . . . . 0.0 113.323 176.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 35.1 p -56.33 -26.41 52.3 Favored 'General case' 0 N--CA 1.482 1.172 0 O-C-N 120.768 -1.208 . . . . 0.0 114.171 178.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -90.66 -0.36 57.66 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.417 1.487 . . . . 0.0 114.28 178.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.22 125.01 91.9 Favored Pre-proline 0 CA--C 1.55 0.944 0 O-C-N 120.868 -1.145 . . . . 0.0 112.061 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.02 -34.78 13.08 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.753 2.302 . . . . 0.0 113.779 -177.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -67.53 -37.88 83.38 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 120.933 -1.104 . . . . 0.0 111.337 179.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -59.12 -39.27 81.78 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.256 -0.902 . . . . 0.0 110.697 174.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -42.37 93.79 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.783 0.833 . . . . 0.0 111.136 174.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -58.84 -40.36 83.99 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.037 0.835 . . . . 0.0 111.289 174.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.8 -36.68 83.94 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 118.395 -0.812 . . . . 0.0 111.676 177.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -67.36 -55.14 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 119.216 0.916 . . . . 0.0 109.479 174.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -49.68 -52.33 31.85 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.687 1.195 . . . . 0.0 111.51 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 4.0 pp0? -65.22 -36.77 85.18 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 112.924 0.712 . . . . 0.0 112.924 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -69.69 -46.0 67.03 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.061 0.846 . . . . 0.0 110.139 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.11 -41.44 96.7 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.756 1.222 . . . . 0.0 111.156 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 83.8 t -60.15 -32.45 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-N 119.44 1.018 . . . . 0.0 110.937 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.37 -29.14 62.44 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.17 -0.956 . . . . 0.0 113.18 176.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -62.15 -37.45 85.26 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.445 1.02 . . . . 0.0 108.692 171.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.2 mt -65.59 -49.17 69.78 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.659 0.784 . . . . 0.0 110.077 177.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 28.5 t60 -56.58 -54.58 44.25 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 118.702 -0.666 . . . . 0.0 110.228 177.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.36 -46.27 66.09 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 118.603 0.638 . . . . 0.0 112.035 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -64.51 -45.2 88.26 Favored 'General case' 0 C--N 1.345 0.373 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 58.4 mttm -69.4 -25.34 64.09 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.688 1.195 . . . . 0.0 113.054 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.8 t -80.68 -52.26 7.75 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 127.11 2.164 . . . . 0.0 110.654 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -59.93 -41.06 90.97 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.202 -1.561 . . . . 0.0 112.791 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.25 -32.02 69.67 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 121.47 -0.769 . . . . 0.0 112.33 175.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -66.49 -39.23 88.62 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.85 1.26 . . . . 0.0 110.695 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 7.8 tm-20 -70.96 -46.73 61.87 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 174.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -57.66 -34.39 69.33 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.879 0.871 . . . . 0.0 112.79 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -69.52 -13.93 62.6 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.692 1.197 . . . . 0.0 113.96 177.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -115.9 -47.65 2.78 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.55 1.54 . . . . 0.0 113.196 -178.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 76.26 -0.12 64.52 Favored Glycine 0 CA--C 1.539 1.533 0 N-CA-C 117.206 1.642 . . . . 0.0 117.206 178.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -122.6 -32.58 3.56 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 119.925 1.862 . . . . 0.0 114.284 -178.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 27.1 m -70.92 154.63 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.985 0.914 . . . . 0.0 112.873 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 58.1 ttt85 -85.01 134.76 34.22 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.704 1.202 . . . . 0.0 111.052 178.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -81.84 172.22 13.58 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.297 1.039 . . . . 0.0 112.743 178.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 2.4 m -53.65 138.38 34.97 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.579 1.552 . . . . 0.0 114.542 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 61.7 p -89.05 -9.54 50.82 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.627 1.571 . . . . 0.0 111.689 172.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 30.0 tp -59.68 112.4 5.24 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 128.468 2.707 . . . . 0.0 110.298 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -55.03 -38.37 93.43 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.378 2.719 . . . . 0.0 114.886 -176.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -69.44 -34.41 74.39 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.5 t -68.38 -50.42 53.12 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.906 1.282 . . . . 0.0 109.035 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -55.29 -39.07 69.43 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.028 1.331 . . . . 0.0 111.582 174.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 21.5 m -67.39 -57.43 6.59 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.459 1.104 . . . . 0.0 111.063 176.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.9 mmt -62.03 -37.07 83.54 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -177.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -65.23 -37.14 86.34 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.319 1.418 . . . . 0.0 113.053 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -65.14 -39.06 92.48 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 122.653 0.381 . . . . 0.0 110.539 175.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 96.9 t -65.12 -48.08 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 123.058 0.543 . . . . 0.0 110.459 175.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -39.35 92.23 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.161 0.984 . . . . 0.0 112.449 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 43.9 m-20 -61.31 -39.05 89.06 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.461 0.704 . . . . 0.0 111.501 175.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.2 t60 -78.75 -50.08 11.96 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.197 0.999 . . . . 0.0 111.733 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -56.84 -32.88 66.21 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.832 1.653 . . . . 0.0 114.116 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 6.6 t -72.71 -15.07 61.69 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 119.91 1.232 . . . . 0.0 112.818 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 81.7 t60 -105.27 -28.99 10.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.897 1.679 . . . . 0.0 112.639 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 30.4 t -58.5 144.77 41.32 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.105 1.762 . . . . 0.0 112.836 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -117.9 -12.25 10.18 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.602 1.561 . . . . 0.0 113.726 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -91.21 -27.16 18.65 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.209 1.004 . . . . 0.0 112.175 178.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.48 -112.33 2.32 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.764 1.173 . . . . 0.0 112.75 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.3 mttt -61.49 -19.57 62.21 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 121.588 -0.948 . . . . 0.0 113.417 178.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.85 -2.44 47.43 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.179 1.391 . . . . 0.0 113.625 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 18.1 t -59.93 144.46 48.93 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 122.323 1.058 . . . . 0.0 110.737 178.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -79.03 -8.3 58.83 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.463 1.105 . . . . 0.0 113.17 -176.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 97.6 t -89.99 115.01 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 173.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.66 -38.84 70.14 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -176.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -67.39 -37.99 83.99 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.796 0.838 . . . . 0.0 112.461 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 43.0 t -66.08 -56.63 10.55 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.687 1.595 . . . . 0.0 109.536 176.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -56.84 -31.44 64.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.389 1.076 . . . . 0.0 112.968 177.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.5 m -77.01 -49.89 14.36 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.027 0.931 . . . . 0.0 112.351 177.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 70.8 m -60.08 -36.0 76.42 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 121.529 -0.732 . . . . 0.0 111.6 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -58.87 -33.03 70.01 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.132 0.973 . . . . 0.0 112.782 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -67.09 -32.75 74.12 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 118.876 0.762 . . . . 0.0 111.671 177.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 1.7 mt -76.39 -45.42 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 123.289 0.636 . . . . 0.0 109.816 177.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 35.7 mm -60.57 -37.66 75.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.268 1.027 . . . . 0.0 110.735 176.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 22.7 t -58.14 -29.9 65.91 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.328 1.051 . . . . 0.0 112.252 176.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.3 t60 -63.94 -52.84 57.89 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.161 0.891 . . . . 0.0 109.995 176.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 39.1 m95 -61.74 -30.28 70.67 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 10.7 mtpm? -70.88 -28.61 64.69 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.458 0.703 . . . . 0.0 112.758 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -100.11 -38.12 8.67 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.951 1.464 . . . . 0.0 114.951 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.6 t -78.23 134.64 37.55 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.474 1.51 . . . . 0.0 112.929 -176.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 79.9 p -130.09 -1.67 4.6 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.646 1.578 . . . . 0.0 114.242 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 22.9 ttt-85 -83.07 145.68 29.13 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.193 1.397 . . . . 0.0 112.683 -177.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 41.9 p-80 -78.06 -30.11 49.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.509 0.724 . . . . 0.0 112.35 176.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 20.7 t0 -103.1 84.16 2.31 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.044 1.738 . . . . 0.0 111.316 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 46.8 t -139.67 135.79 17.06 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 126.85 2.06 . . . . 0.0 108.468 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -57.47 -27.48 76.44 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.17 2.58 . . . . 0.0 115.383 -176.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 16.6 t -92.14 -49.86 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 CA-C-N 119.805 1.184 . . . . 0.0 111.387 176.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 4.1 m -69.54 -39.91 77.17 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -174.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.1 tt -55.09 -57.02 21.88 Favored Pre-proline 0 N--CA 1.475 0.804 0 CA-C-O 117.748 -1.12 . . . . 0.0 112.934 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.54 -31.08 91.94 Favored 'Trans proline' 0 C--N 1.354 0.824 0 CA-C-N 121.682 1.636 . . . . 0.0 113.082 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.8 mt -70.55 -45.13 66.04 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.211 0.914 . . . . 0.0 111.601 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 60.1 mttm -60.99 -37.65 83.25 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.423 1.089 . . . . 0.0 110.898 175.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 20.4 t30 -73.3 -41.56 63.42 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.354 1.461 . . . . 0.0 112.745 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -73.06 -34.14 66.07 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.05 0.94 . . . . 0.0 113.453 -179.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 32.1 t -71.26 138.79 49.7 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 118.414 0.552 . . . . 0.0 112.409 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 25.7 t70 -85.84 -6.69 59.05 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.397 0.679 . . . . 0.0 112.155 176.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 28.4 tptp -80.39 52.78 1.68 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.28 2.232 . . . . 0.0 110.701 178.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 11.0 ptm85 . . . . . 0 N--CA 1.476 0.828 0 C-N-CA 126.639 1.976 . . . . 0.0 112.897 -176.953 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.442 0 N-CA-C 114.178 0.431 . . . . 0.0 114.178 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.7 p -153.71 168.05 27.57 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.167 1.387 . . . . 0.0 111.975 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -61.71 -18.54 60.07 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 49.6 ttm -67.32 -21.86 65.64 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.96 1.304 . . . . 0.0 113.44 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -81.61 -15.59 54.19 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.014 -1.054 . . . . 0.0 113.403 178.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -63.45 -55.74 32.68 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-O 117.542 -1.218 . . . . 0.0 113.282 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.54 -24.89 62.91 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 122.065 1.843 . . . . 0.0 112.492 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -77.68 -13.35 59.93 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.538 1.135 . . . . 0.0 112.582 176.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 68.1 m -90.72 -16.97 27.54 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.781 1.232 . . . . 0.0 113.141 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -139.22 45.82 0.99 Allowed Pre-proline 0 CA--C 1.558 1.285 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -68.97 -15.71 40.28 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.406 2.737 . . . . 0.0 114.045 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 17.7 m -76.81 -1.27 27.37 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.593 1.557 . . . . 0.0 114.895 -178.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 13.7 p -138.54 149.45 24.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.275 1.43 . . . . 0.0 111.891 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -125.47 111.39 25.81 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 125.263 1.425 . . . . 0.0 109.934 179.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -56.22 -43.98 50.97 Favored 'Trans proline' 0 CA--C 1.55 1.32 0 C-N-CA 123.747 2.965 . . . . 0.0 117.253 -179.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -77.05 160.02 33.6 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 122.504 2.136 . . . . 0.0 113.68 -178.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 6.9 tt -73.78 137.22 43.76 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.843 1.257 . . . . 0.0 111.58 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 36.9 t -88.22 146.34 25.41 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.672 1.189 . . . . 0.0 111.407 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 12.3 tm0? -53.54 -34.51 58.45 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.691 1.196 . . . . 0.0 113.618 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -71.04 -14.11 62.22 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.117 0.967 . . . . 0.0 113.385 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 19.3 m -61.7 -57.26 12.67 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.925 -1.11 . . . . 0.0 109.871 178.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.6 m-85 -60.28 -29.15 68.63 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.408 0.683 . . . . 0.0 112.277 174.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 35.9 m -68.01 -34.62 76.85 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.231 0.923 . . . . 0.0 112.916 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.4 t70 -90.03 -30.29 17.84 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.218 1.007 . . . . 0.0 113.136 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.1 tt -43.4 -58.38 2.6 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.105 2.162 . . . . 0.0 113.168 -178.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 44.5 p-90 -71.08 -11.45 60.96 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 -173.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -110.1 -60.08 1.84 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 116.312 1.967 . . . . 0.0 116.312 -175.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 77.9 mt -120.28 16.78 12.3 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 116.665 2.098 . . . . 0.0 116.665 -172.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 6.1 tt -54.68 130.6 64.56 Favored Pre-proline 0 CA--C 1.554 1.127 0 C-N-CA 125.243 1.417 . . . . 0.0 113.349 -178.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -79.42 -179.95 5.83 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 125.016 3.81 . . . . 0.0 114.26 -177.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -65.69 -10.04 33.02 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 115.586 1.699 . . . . 0.0 115.586 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 50.1 t30 -136.02 134.0 38.04 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.105 1.362 . . . . 0.0 110.799 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -146.74 158.0 43.81 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.546 1.138 . . . . 0.0 112.219 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 29.2 m -70.46 -25.4 26.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.853 1.261 . . . . 0.0 114.176 179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 1.6 tt -97.6 111.52 23.76 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.879 1.271 . . . . 0.0 109.191 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 66.3 m -115.0 99.97 53.02 Favored Pre-proline 0 N--CA 1.475 0.785 0 C-N-CA 124.236 1.014 . . . . 0.0 112.165 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -79.97 169.11 18.25 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.934 3.089 . . . . 0.0 111.912 177.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 24.4 tp -144.63 136.97 13.3 Favored Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 124.886 1.275 . . . . 0.0 111.064 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -54.59 -35.42 86.24 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.273 2.649 . . . . 0.0 113.963 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 14.7 m -64.79 -13.64 56.2 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.812 1.245 . . . . 0.0 113.803 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -111.98 2.58 16.96 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.219 1.808 . . . . 0.0 112.623 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.56 142.91 48.45 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.217 -0.927 . . . . 0.0 112.312 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 65.2 mtm -87.39 48.75 1.69 Allowed 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.389 1.476 . . . . 0.0 112.774 -179.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 32.6 t70 -59.36 -22.61 61.59 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.446 1.098 . . . . 0.0 113.396 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -64.71 -19.96 66.06 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.176 1.39 . . . . 0.0 113.517 175.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 85.8 mt -115.5 -0.38 13.09 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.199 1.799 . . . . 0.0 113.756 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 68.0 mmm -66.03 148.07 52.37 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -177.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.05 178.18 5.67 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.688 1.995 . . . . 0.0 111.372 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 74.4 m -89.02 152.85 48.82 Favored Pre-proline 0 CA--C 1.546 0.791 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 169.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.74 -18.56 49.14 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 122.546 2.164 . . . . 0.0 115.781 -176.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -76.47 -17.08 59.48 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.04 -1.038 . . . . 0.0 112.596 177.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -82.79 -12.44 57.48 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.313 1.045 . . . . 0.0 112.535 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 96.4 mt -59.07 -35.88 59.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.869 1.268 . . . . 0.0 110.753 178.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -73.32 -9.8 59.08 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.811 1.244 . . . . 0.0 113.265 178.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -79.6 -20.72 46.19 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.964 0.906 . . . . 0.0 111.138 175.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.8 p-90 -109.92 -49.68 3.06 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.437 1.095 . . . . 0.0 113.033 177.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -81.08 109.83 16.02 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 170.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 4.2 m -122.67 138.62 54.55 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.237 1.015 . . . . 0.0 112.9 -171.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -97.82 170.65 8.82 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.578 1.551 . . . . 0.0 111.011 176.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 9.9 t70 -62.5 120.38 58.85 Favored Pre-proline 0 CA--C 1.556 1.191 0 O-C-N 120.93 -1.106 . . . . 0.0 110.39 178.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -83.37 -4.13 10.91 Favored 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 123.461 2.774 . . . . 0.0 115.181 -175.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 58.65 -118.78 14.88 Favored Glycine 0 CA--C 1.541 1.709 0 CA-C-O 118.805 -0.997 . . . . 0.0 112.359 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -75.72 -8.92 19.59 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 123.723 2.949 . . . . 0.0 113.984 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -101.42 -174.75 2.67 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.607 1.563 . . . . 0.0 112.419 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 76.83 -7.47 34.29 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 125.088 1.328 . . . . 0.0 115.948 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 64.4 p -80.14 -0.97 38.23 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.78 1.632 . . . . 0.0 114.479 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 84.7 m -61.09 -23.68 65.66 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.986 1.714 . . . . 0.0 113.61 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -136.67 167.68 20.95 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.176 1.79 . . . . 0.0 110.628 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 26.9 m120 -74.88 -60.39 2.31 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.54 -0.725 . . . . 0.0 111.942 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -55.44 -36.2 63.05 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.16 0.886 . . . . 0.0 115.176 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 39.5 p -69.3 -10.43 57.81 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.271 1.028 . . . . 0.0 113.741 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -119.35 -33.01 4.21 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.369 1.468 . . . . 0.0 113.888 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 74.7 p -84.13 -29.83 26.39 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 168.55 83.78 0.05 OUTLIER Glycine 0 CA--C 1.534 1.233 0 C-N-CA 124.237 0.923 . . . . 0.0 112.108 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -55.5 -38.49 93.99 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.523 2.816 . . . . 0.0 115.215 -176.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 35.5 p -86.33 4.68 38.1 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.58 1.552 . . . . 0.0 115.179 -177.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -70.11 -18.81 63.26 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 15.9 t70 -76.49 129.37 79.93 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 123.935 0.894 . . . . 0.0 112.093 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.7 -38.29 14.28 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.092 2.528 . . . . 0.0 114.465 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -65.56 -35.13 79.94 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.128 -0.983 . . . . 0.0 110.659 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -62.92 -34.89 78.41 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.302 -0.874 . . . . 0.0 111.495 175.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 96.9 mtm-85 -69.12 -33.28 73.22 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.427 -0.796 . . . . 0.0 111.181 174.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -65.36 -33.24 75.5 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 118.826 0.739 . . . . 0.0 111.367 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.44 -36.36 83.49 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 118.872 0.76 . . . . 0.0 111.052 175.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -67.01 -52.96 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 118.551 0.614 . . . . 0.0 109.63 175.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -51.94 -56.07 16.44 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.848 0.859 . . . . 0.0 111.443 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -36.05 83.05 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.0 tp60 -70.96 -41.76 70.63 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 119.234 0.925 . . . . 0.0 110.393 178.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.9 tt -62.18 -40.86 97.47 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.578 0.751 . . . . 0.0 109.919 177.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 97.1 t -59.62 -33.37 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.13 0.877 . . . . 0.0 110.942 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.0 tp -73.23 -25.55 60.78 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.875 1.216 . . . . 0.0 113.835 175.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -62.72 -30.19 71.23 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.788 1.176 . . . . 0.0 109.044 172.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.3 mt -72.95 -54.38 8.81 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.118 0.967 . . . . 0.0 108.513 174.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 20.4 t60 -49.4 -55.87 11.55 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.678 0.672 . . . . 0.0 111.273 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -57.65 -22.96 48.75 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -90.04 -24.65 21.12 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -88.0 -41.54 13.05 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 119.843 1.201 . . . . 0.0 112.211 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 25.4 t -59.59 -41.61 90.65 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.107 1.363 . . . . 0.0 111.108 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -61.99 -27.71 69.06 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 120.651 -1.281 . . . . 0.0 113.055 174.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -83.2 -30.07 28.03 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.738 1.215 . . . . 0.0 112.18 178.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -57.52 -38.6 74.92 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.561 1.144 . . . . 0.0 110.026 174.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -69.43 -51.36 37.09 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.381 1.072 . . . . 0.0 111.279 175.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 16.2 tp60 -63.97 -35.08 79.53 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -70.77 -24.6 62.62 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.269 1.028 . . . . 0.0 113.104 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -100.18 -42.55 6.65 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.496 1.518 . . . . 0.0 112.957 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 84.06 -4.83 82.08 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 125.686 1.612 . . . . 0.0 116.879 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -125.23 -36.94 2.45 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 119.943 1.872 . . . . 0.0 114.136 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 32.7 m -73.64 158.08 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.059 0.944 . . . . 0.0 113.307 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -107.1 172.58 6.75 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.142 1.777 . . . . 0.0 112.403 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -68.95 169.55 11.45 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.327 1.451 . . . . 0.0 113.354 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 16.5 p -70.05 176.02 4.08 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 125.589 1.556 . . . . 0.0 113.756 179.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 74.1 p -85.23 -2.59 58.21 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -178.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 41.1 tp -80.42 117.84 69.61 Favored Pre-proline 0 CA--C 1.553 1.076 0 C-N-CA 125.128 1.371 . . . . 0.0 111.521 -178.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.25 -29.27 47.0 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 122.145 1.896 . . . . 0.0 112.823 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 39.0 m80 -64.72 -32.65 74.42 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.291 -0.881 . . . . 0.0 113.053 178.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 30.8 t -64.16 -50.05 69.71 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.643 1.177 . . . . 0.0 109.752 176.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -53.92 -43.58 69.87 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.222 1.409 . . . . 0.0 111.015 174.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 19.4 m -64.02 -55.34 22.99 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.699 0.8 . . . . 0.0 111.787 176.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.7 mmt -65.0 -34.64 78.92 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -67.37 -34.94 78.33 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 121.142 1.792 . . . . 0.0 112.081 178.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -66.19 -37.82 86.54 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.214 0.461 . . . . 0.0 110.46 174.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 78.7 t -64.96 -52.17 57.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 123.49 0.716 . . . . 0.0 110.448 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.11 -44.86 87.91 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.722 1.209 . . . . 0.0 112.666 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 37.7 m-20 -66.41 -20.39 66.05 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.562 0.745 . . . . 0.0 112.653 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 63.7 t60 -90.17 -50.92 5.72 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.362 1.065 . . . . 0.0 109.933 172.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.1 ttp -54.99 -34.53 63.49 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.646 1.978 . . . . 0.0 113.474 -177.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 14.8 t -64.12 -27.33 69.01 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 119.276 0.944 . . . . 0.0 112.403 177.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 41.6 m80 -98.28 -26.25 14.58 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.362 1.465 . . . . 0.0 113.302 177.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 49.6 t -63.38 132.49 51.63 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.509 1.523 . . . . 0.0 112.889 -178.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -106.67 -14.15 15.1 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.38 1.472 . . . . 0.0 113.717 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -84.31 -32.96 24.04 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.283 0.947 . . . . 0.0 111.216 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.55 -106.55 0.32 Allowed Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.066 1.317 . . . . 0.0 113.188 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.74 -21.56 63.11 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.753 -0.851 . . . . 0.0 113.2 177.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -97.86 -2.66 40.31 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.639 1.576 . . . . 0.0 113.571 177.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.8 t -60.13 144.59 49.44 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 122.304 1.049 . . . . 0.0 110.612 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -81.26 -10.06 59.66 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.962 1.305 . . . . 0.0 113.234 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 98.2 t -89.16 115.98 29.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 174.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.32 -41.46 72.44 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -64.08 -42.16 97.05 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.478 0.711 . . . . 0.0 112.389 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.7 t -63.12 -53.37 54.52 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.033 1.333 . . . . 0.0 109.974 176.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -56.06 -38.86 71.21 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.97 0.908 . . . . 0.0 112.375 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 25.5 m -67.06 -53.37 31.68 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.975 0.91 . . . . 0.0 113.135 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.8 m -59.34 -26.95 65.48 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.162 0.892 . . . . 0.0 112.823 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.6 -31.5 71.57 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 118.335 -0.841 . . . . 0.0 112.229 175.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -65.93 -38.67 89.25 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.921 1.237 . . . . 0.0 110.89 174.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 9.4 mt -68.39 -48.15 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.129 0.972 . . . . 0.0 110.323 179.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 16.8 mm -62.13 -36.29 73.49 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 123.918 0.887 . . . . 0.0 111.232 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 71.9 m -61.63 -23.71 66.22 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 176.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.7 t60 -64.58 -56.46 13.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.584 1.084 . . . . 0.0 110.268 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 55.5 m95 -61.21 -29.35 69.77 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -70.28 -30.29 67.27 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.939 0.896 . . . . 0.0 112.782 177.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -100.06 -38.91 8.36 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.2 t -80.07 133.4 36.11 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.483 1.513 . . . . 0.0 112.611 -176.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 71.7 p -130.0 1.61 4.78 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.929 1.692 . . . . 0.0 113.893 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -75.91 154.71 35.79 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.273 1.429 . . . . 0.0 113.299 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 18.8 t60 -88.26 -39.2 14.61 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.588 0.755 . . . . 0.0 110.365 172.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 20.1 t0 -94.96 80.49 3.66 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.915 1.686 . . . . 0.0 111.374 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.5 t -134.97 135.45 23.11 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.736 2.014 . . . . 0.0 109.123 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -59.05 -25.18 76.87 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.751 2.3 . . . . 0.0 114.153 -178.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.7 t -92.16 -52.97 9.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 119.817 1.189 . . . . 0.0 111.618 176.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 9.0 m -68.61 -37.73 80.02 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.235 1.569 . . . . 0.0 115.235 -174.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -56.27 -57.53 22.17 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-O 117.63 -1.176 . . . . 0.0 112.8 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -61.08 -31.62 90.9 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 121.933 1.755 . . . . 0.0 113.411 179.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 93.3 mt -68.13 -48.49 65.25 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.888 0.767 . . . . 0.0 111.175 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -63.95 -35.79 81.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.753 0.821 . . . . 0.0 111.37 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 49.4 t30 -64.51 -46.72 81.72 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.525 1.13 . . . . 0.0 110.894 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -69.01 -31.0 69.51 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.901 0.88 . . . . 0.0 112.515 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 9.9 m -96.25 26.68 4.13 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.555 1.942 . . . . 0.0 113.728 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 27.4 t0 -74.82 77.37 2.11 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.451 1.1 . . . . 0.0 111.178 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 21.2 pttp -58.31 -7.53 0.89 Allowed 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 128.623 2.769 . . . . 0.0 118.218 -175.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 . . . . . 0 N--CA 1.482 1.142 0 CA-C-N 119.952 1.251 . . . . 0.0 113.906 -178.45 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.381 0 N-CA-C 113.95 0.34 . . . . 0.0 113.95 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.5 t -143.29 151.21 40.26 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.949 1.299 . . . . 0.0 112.38 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -63.0 -27.14 69.21 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.508 1.123 . . . . 0.0 112.532 176.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 92.8 mmm -97.5 9.47 42.34 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.653 1.581 . . . . 0.0 113.542 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -70.01 128.95 38.12 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.07 -1.019 . . . . 0.0 112.481 -179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -154.72 152.54 25.95 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 125.52 1.528 . . . . 0.0 111.515 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.96 145.32 67.52 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.014 2.476 . . . . 0.0 111.763 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -75.4 -35.23 61.06 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 55.4 m -144.8 152.48 40.38 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.374 1.47 . . . . 0.0 112.041 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -146.09 142.01 17.21 Favored Pre-proline 0 CA--C 1.546 0.808 0 C-N-CA 125.702 1.601 . . . . 0.0 110.451 177.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 30.9 Cg_exo -64.79 -32.16 56.71 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.624 2.216 . . . . 0.0 114.412 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 41.6 m -84.4 65.4 8.89 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.813 1.645 . . . . 0.0 112.893 -177.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 10.3 p -140.32 139.49 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.662 1.185 . . . . 0.0 111.881 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -120.19 84.31 33.75 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 125.786 1.634 . . . . 0.0 110.093 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -62.67 -36.21 64.85 Favored 'Trans proline' 0 CA--C 1.549 1.238 0 C-N-CA 122.676 2.25 . . . . 0.0 117.411 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -84.51 154.69 12.13 Favored 'Trans proline' 0 C--N 1.355 0.891 0 CA-C-N 123.629 2.332 . . . . 0.0 113.177 -179.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 8.9 tt -71.0 141.0 50.99 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.974 0.909 . . . . 0.0 110.92 176.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 42.3 t -123.02 159.22 28.85 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 126.41 1.884 . . . . 0.0 109.408 175.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -60.52 -26.69 67.04 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 121.358 -0.839 . . . . 0.0 110.886 175.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -84.32 -11.55 56.17 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.064 1.346 . . . . 0.0 113.666 177.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 86.6 m -60.48 -60.04 4.43 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 119.718 1.145 . . . . 0.0 111.25 -178.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -60.11 -29.54 68.67 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.403 0.681 . . . . 0.0 112.602 176.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 70.5 m -71.04 -31.09 67.46 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.888 0.875 . . . . 0.0 113.215 178.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.1 t70 -90.05 -31.14 17.29 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.811 1.244 . . . . 0.0 112.826 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.8 tt -42.59 -60.02 1.69 Allowed 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 127.665 2.386 . . . . 0.0 113.489 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.4 p-90 -70.18 -11.36 60.84 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 115.272 1.582 . . . . 0.0 115.272 -174.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -111.5 -60.03 1.9 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 116.034 1.864 . . . . 0.0 116.034 -175.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 6.6 mp -120.18 20.21 12.07 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -174.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 3.0 tt -52.06 135.25 39.21 Favored Pre-proline 0 N--CA 1.476 0.829 0 C-N-CA 124.979 1.311 . . . . 0.0 114.137 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -66.19 164.62 27.21 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 124.035 3.157 . . . . 0.0 112.779 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -73.03 -2.94 23.15 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -177.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 49.9 t30 -129.36 134.13 47.73 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.567 1.547 . . . . 0.0 109.66 176.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -149.82 160.4 43.59 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.948 0.899 . . . . 0.0 112.664 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 10.0 p -111.67 -16.41 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 125.653 1.581 . . . . 0.0 113.475 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -87.49 33.9 0.7 Allowed 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.821 2.048 . . . . 0.0 112.095 -179.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 24.0 m -94.63 110.5 49.51 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 125.112 1.365 . . . . 0.0 112.626 -176.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -76.3 128.56 10.56 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.73 2.287 . . . . 0.0 111.098 179.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 21.1 tp -76.34 133.22 71.69 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.513 1.125 . . . . 0.0 111.77 -178.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -52.04 -32.75 49.99 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 123.808 3.005 . . . . 0.0 115.18 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 24.7 m -60.88 -19.85 60.96 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 23.3 mp0 -131.47 20.26 4.75 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.702 1.601 . . . . 0.0 111.894 177.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -75.62 156.48 34.85 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.73 17.68 3.24 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 128.49 2.716 . . . . 0.0 113.724 178.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 37.4 t70 -61.71 -22.68 65.57 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.566 1.546 . . . . 0.0 114.663 -176.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.1 t70 -65.57 -16.28 63.55 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 21.3 tp -108.5 14.57 24.55 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 126.139 1.775 . . . . 0.0 113.128 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 76.5 mmm -66.33 155.37 37.48 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 -177.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.07 167.18 15.12 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.071 2.148 . . . . 0.0 114.984 -178.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 88.2 p -91.58 162.26 32.02 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 127.202 2.201 . . . . 0.0 108.749 169.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -62.78 -24.56 74.6 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.023 1.815 . . . . 0.0 113.327 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.0 t70 -63.54 -29.12 70.43 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.756 0.823 . . . . 0.0 112.944 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 11.5 t70 -90.12 -17.58 27.42 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 75.5 mt -59.88 -38.33 75.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 CA-C-N 119.792 1.178 . . . . 0.0 110.942 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . 0.304 0.0 OUTLIER -67.98 -9.82 48.56 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 176.628 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -79.37 -29.84 42.3 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.105 -0.997 . . . . 0.0 111.77 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.27 15.0 p-90 -101.13 -13.0 18.35 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 178.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -134.5 109.84 8.98 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 105.866 -1.901 . . . . 0.0 105.866 169.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 2.7 m -125.18 150.02 47.36 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.003 0.921 . . . . 0.0 113.05 -174.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.67 178.92 7.81 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.923 1.289 . . . . 0.0 111.221 175.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 13.3 t70 -60.42 127.31 86.38 Favored Pre-proline 0 CA--C 1.557 1.23 0 O-C-N 120.854 -1.154 . . . . 0.0 111.427 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -81.47 1.63 9.13 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 124.074 3.183 . . . . 0.0 115.955 -175.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 85.22 170.56 47.31 Favored Glycine 0 CA--C 1.54 1.634 0 C-N-CA 125.449 1.499 . . . . 0.0 113.386 -177.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -64.87 -22.14 63.57 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.725 2.95 . . . . 0.0 113.907 -178.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -95.8 -2.16 48.17 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.451 1.501 . . . . 0.0 113.536 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 63.78 31.37 80.56 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 124.438 1.018 . . . . 0.0 114.312 -179.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 23.2 t -51.2 -54.79 22.25 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.788 1.294 . . . . 0.0 113.531 -176.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 77.6 m -69.87 -29.75 67.05 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.226 0.61 . . . . 0.0 112.537 179.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 58.0 t80 -68.97 -39.85 79.19 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.725 -0.609 . . . . 0.0 111.597 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -59.13 -25.93 64.29 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.422 -0.799 . . . . 0.0 112.046 176.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -79.31 -8.32 87.88 Favored Glycine 0 CA--C 1.54 1.642 0 C-N-CA 124.875 1.226 . . . . 0.0 114.853 175.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 4.7 t -136.1 0.1 2.57 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -178.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -56.18 -21.6 23.95 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.287 1.435 . . . . 0.0 114.821 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 10.7 t -69.87 -20.38 63.4 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.769 1.228 . . . . 0.0 112.696 176.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -160.55 78.95 0.17 Allowed Glycine 0 CA--C 1.537 1.425 0 C-N-CA 125.788 1.661 . . . . 0.0 111.297 178.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -60.03 166.01 9.51 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.356 3.37 . . . . 0.0 115.067 -177.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 44.4 p -52.45 -31.56 35.22 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 125.918 1.687 . . . . 0.0 114.891 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -89.2 -2.05 58.33 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 14.1 t70 -64.45 140.32 97.95 Favored Pre-proline 0 CA--C 1.55 0.962 0 O-C-N 121.22 -0.925 . . . . 0.0 111.88 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -50.77 -36.87 53.2 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 123.515 2.81 . . . . 0.0 115.446 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -67.06 -40.5 87.1 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.193 -0.942 . . . . 0.0 110.772 176.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 14.2 mptt -67.12 -40.13 86.76 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.96 0.904 . . . . 0.0 110.387 177.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -55.79 -43.93 77.3 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 119.615 1.098 . . . . 0.0 111.586 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -60.71 -38.56 85.46 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.699 0.8 . . . . 0.0 111.582 176.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 93.2 mt -66.3 -38.79 88.54 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.36 0.664 . . . . 0.0 111.637 177.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -62.29 -54.57 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 119.027 0.83 . . . . 0.0 109.754 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -53.63 -55.57 24.72 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.818 1.247 . . . . 0.0 111.095 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -33.36 75.65 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -69.75 -46.56 65.59 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.809 1.186 . . . . 0.0 109.781 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 5.9 tp -59.22 -41.95 89.84 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.56 0.744 . . . . 0.0 111.195 177.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 63.4 t -59.08 -31.89 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-N 119.996 1.271 . . . . 0.0 111.485 176.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 5.8 tp -72.49 -31.42 65.38 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.707 -1.245 . . . . 0.0 112.871 175.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.0 mp -60.48 -31.14 70.18 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 120.249 1.386 . . . . 0.0 109.603 172.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.6 mt -71.1 -51.7 23.6 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.546 0.738 . . . . 0.0 109.975 176.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 21.6 t60 -56.29 -55.8 28.93 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.264 0.625 . . . . 0.0 111.071 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -50.39 -41.74 52.5 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.717 1.207 . . . . 0.0 114.004 -175.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -73.93 -44.44 55.04 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.212 0.915 . . . . 0.0 112.569 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 44.4 mttm -65.73 -43.13 89.96 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.364 1.066 . . . . 0.0 111.229 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 42.2 t -62.21 -47.35 84.83 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.196 1.798 . . . . 0.0 110.388 175.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -54.57 -46.39 73.68 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.302 -0.874 . . . . 0.0 112.881 177.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 48.7 mtp180 -82.12 -17.93 44.71 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 -178.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -62.65 -33.06 74.28 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 120.926 1.693 . . . . 0.0 111.777 177.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.62 -46.85 74.52 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.396 1.078 . . . . 0.0 110.337 176.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -64.72 -32.82 74.67 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.328 1.051 . . . . 0.0 112.619 178.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -69.69 -12.97 62.05 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 178.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -127.82 -43.89 1.51 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.649 1.18 . . . . 0.0 114.182 -175.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 77.96 -12.38 17.84 Favored Glycine 0 CA--C 1.541 1.697 0 N-CA-C 117.091 1.597 . . . . 0.0 117.091 178.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -104.13 -37.34 7.36 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.619 1.71 . . . . 0.0 112.133 178.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 22.1 m -76.91 170.85 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 124.513 1.125 . . . . 0.0 111.382 175.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 65.4 ttt-85 -127.39 148.23 50.27 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.461 1.504 . . . . 0.0 111.905 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -77.96 179.86 6.5 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.257 1.423 . . . . 0.0 112.448 177.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 3.7 m -56.26 148.12 19.27 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 67.0 m -95.74 -4.85 43.31 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.718 1.607 . . . . 0.0 110.652 169.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 38.3 tp -63.22 114.72 13.68 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 128.646 2.779 . . . . 0.0 111.175 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -54.98 -40.0 88.05 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.103 2.536 . . . . 0.0 114.961 -177.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 32.6 m80 -66.09 -37.07 84.87 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.005 0.82 . . . . 0.0 112.995 179.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 43.5 t -67.15 -51.45 53.69 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.292 1.437 . . . . 0.0 109.656 177.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -57.11 -34.93 68.85 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.912 1.285 . . . . 0.0 111.6 174.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.5 m -69.21 -60.97 1.99 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.239 1.016 . . . . 0.0 110.908 175.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.1 mmt -59.4 -35.34 73.78 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -177.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -66.56 -34.47 77.98 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 120.659 1.572 . . . . 0.0 112.722 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -69.73 -37.36 76.47 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.914 -0.491 . . . . 0.0 110.311 173.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 59.3 t -64.78 -40.84 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-O 118.966 -0.54 . . . . 0.0 110.264 175.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.94 -43.78 94.78 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.908 1.283 . . . . 0.0 111.014 175.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -63.7 -36.6 84.37 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.222 0.609 . . . . 0.0 112.006 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 63.5 t60 -74.72 -52.55 11.27 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.741 0.816 . . . . 0.0 110.687 177.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.3 ttp -58.24 -33.27 69.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.741 1.616 . . . . 0.0 113.668 -176.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 3.9 t -75.45 -10.06 59.12 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 119.657 1.117 . . . . 0.0 113.275 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 46.6 m80 -117.37 -16.72 10.24 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.761 1.625 . . . . 0.0 113.717 177.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 38.1 t -57.57 144.72 36.2 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.466 1.506 . . . . 0.0 112.946 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -103.77 -15.12 15.82 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.046 1.738 . . . . 0.0 113.564 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -106.94 -34.0 7.34 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.329 1.052 . . . . 0.0 112.448 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.5 -105.73 0.24 Allowed Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.828 1.204 . . . . 0.0 114.096 177.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -60.09 -21.9 62.07 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 121.133 -1.216 . . . . 0.0 112.828 177.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -100.78 0.2 38.32 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.272 1.829 . . . . 0.0 113.522 176.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 12.5 t -63.67 143.28 57.97 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 122.261 1.029 . . . . 0.0 110.375 178.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -84.6 -6.48 59.37 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.761 1.224 . . . . 0.0 113.51 -176.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 88.0 t -83.96 120.91 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 173.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.66 -44.38 69.59 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 72.3 m80 -62.28 -42.3 99.23 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 50.2 t -64.91 -55.95 16.2 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.78 1.232 . . . . 0.0 111.311 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.61 -32.75 70.69 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.371 0.668 . . . . 0.0 112.482 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 74.2 m -73.63 -47.0 43.43 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.543 0.737 . . . . 0.0 111.549 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 69.6 m -62.27 -36.61 82.59 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.584 1.154 . . . . 0.0 112.1 178.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -61.65 -31.77 71.89 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.318 -0.864 . . . . 0.0 113.009 175.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -69.65 -28.53 65.97 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.146 0.884 . . . . 0.0 111.27 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.8 mm -70.83 -50.38 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 123.888 0.875 . . . . 0.0 109.645 174.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 12.9 mm -61.34 -42.22 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 124.949 1.299 . . . . 0.0 111.425 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 50.2 m -60.41 -20.81 61.03 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.431 0.901 . . . . 0.0 113.431 179.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.3 t60 -64.78 -55.9 16.89 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.474 1.034 . . . . 0.0 110.728 176.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 50.1 m95 -62.54 -24.72 67.66 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -74.08 -30.74 62.52 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.539 0.736 . . . . 0.0 112.461 176.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -100.05 -38.12 8.69 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.9 t -78.53 135.23 37.26 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.426 1.49 . . . . 0.0 112.373 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 79.7 p -129.97 2.17 4.81 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.518 1.527 . . . . 0.0 114.175 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -82.23 152.17 26.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.236 1.414 . . . . 0.0 113.499 -178.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 15.0 t60 -86.62 -37.92 17.59 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.862 0.865 . . . . 0.0 109.934 171.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 21.4 t0 -94.3 78.48 3.94 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.017 1.727 . . . . 0.0 111.336 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.8 t -132.67 135.44 26.11 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 126.819 2.047 . . . . 0.0 109.232 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -59.79 -24.24 75.1 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.798 2.332 . . . . 0.0 114.027 -178.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 8.1 t -92.22 -52.99 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-N 119.608 1.095 . . . . 0.0 111.855 176.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 15.2 m -68.97 -40.4 78.86 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -175.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.8 tt -55.92 -56.12 33.85 Favored Pre-proline 0 CA--C 1.545 0.785 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.571 -178.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -61.7 -30.15 84.7 Favored 'Trans proline' 0 C--N 1.355 0.873 0 CA-C-N 121.679 1.635 . . . . 0.0 113.287 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 91.2 mt -69.73 -45.7 67.58 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.873 1.215 . . . . 0.0 111.494 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -63.26 -35.85 81.72 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.917 0.887 . . . . 0.0 110.749 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 22.9 t30 -71.41 -40.12 70.68 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.004 1.322 . . . . 0.0 112.197 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -73.16 -27.95 61.95 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.804 1.242 . . . . 0.0 113.251 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 44.1 t -57.53 141.37 48.04 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.735 1.214 . . . . 0.0 113.192 -179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -85.23 -11.56 54.62 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.09 1.356 . . . . 0.0 112.166 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -81.74 63.81 6.17 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.874 1.669 . . . . 0.0 111.852 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 . . . . . 0 N--CA 1.48 1.033 0 C-N-CA 125.588 1.555 . . . . 0.0 112.339 -178.447 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.422 0 CA-C-O 121.854 0.697 . . . . 0.0 114.817 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.4 m -66.83 159.54 27.94 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.081 1.352 . . . . 0.0 113.086 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 27.0 m80 -57.06 -23.7 48.56 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 114.628 1.344 . . . . 0.0 114.628 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 26.5 mmt -77.52 -20.36 54.34 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.138 0.975 . . . . 0.0 112.603 176.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -99.04 -38.16 9.07 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.498 1.519 . . . . 0.0 111.282 177.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -126.21 76.57 72.42 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 125.713 1.605 . . . . 0.0 110.901 178.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -72.25 159.99 48.26 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.633 2.888 . . . . 0.0 112.977 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -143.98 141.83 30.38 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.571 1.548 . . . . 0.0 111.993 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 46.5 m -83.25 63.9 7.46 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.012 1.325 . . . . 0.0 112.245 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -139.26 139.03 21.69 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 124.908 1.283 . . . . 0.0 112.309 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.06 -20.8 16.4 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.024 2.483 . . . . 0.0 112.537 177.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 7.2 m -56.25 -19.59 14.68 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 127.096 2.158 . . . . 0.0 114.997 -178.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 7.8 p -77.1 -18.91 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 125.005 1.322 . . . . 0.0 112.925 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -76.44 124.97 88.09 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 124.194 0.998 . . . . 0.0 111.63 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -55.01 -48.91 18.6 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 122.977 2.451 . . . . 0.0 115.568 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -76.28 137.9 19.48 Favored 'Trans proline' 0 C--N 1.353 0.811 0 CA-C-N 121.997 1.749 . . . . 0.0 111.63 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 16.0 tp -75.66 143.18 42.35 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.377 0.671 . . . . 0.0 111.259 177.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 42.1 t -65.33 139.66 58.61 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.239 0.542 . . . . 0.0 111.127 176.055 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 28.1 mp0 -61.51 -23.42 65.91 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.555 1.142 . . . . 0.0 112.296 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -83.24 -15.49 50.14 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 99.4 m -60.9 -60.01 4.47 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.198 0.908 . . . . 0.0 111.791 -178.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -60.11 -29.3 68.52 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 177.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 69.8 m -70.55 -29.94 66.54 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.781 0.832 . . . . 0.0 112.911 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.9 t70 -90.22 -30.37 17.6 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.615 1.166 . . . . 0.0 113.156 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.5 tt -45.66 -59.96 2.46 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.88 2.072 . . . . 0.0 113.252 -177.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.4 p-90 -67.99 -8.5 37.94 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -174.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -111.99 -58.07 2.18 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 44.1 mt -120.15 19.95 12.13 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 116.061 1.874 . . . . 0.0 116.061 -171.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.1 tt -51.98 136.44 37.48 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.871 1.668 . . . . 0.0 114.999 -178.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -81.16 149.18 17.19 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 124.38 3.386 . . . . 0.0 113.085 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.61 -10.26 34.16 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 115.991 1.849 . . . . 0.0 115.991 -179.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 44.6 p-10 -92.69 -0.15 57.33 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -71.06 146.2 49.45 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 119.337 0.971 . . . . 0.0 111.985 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 28.4 m -113.34 6.95 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 -176.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 55.1 tp -79.32 58.22 2.53 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.107 1.363 . . . . 0.0 111.36 178.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 11.2 t -114.97 101.9 54.68 Favored Pre-proline 0 CA--C 1.54 0.571 0 C-N-CA 124.801 1.24 . . . . 0.0 111.734 -178.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -60.06 125.35 17.37 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 123.39 2.727 . . . . 0.0 110.88 178.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 85.6 mt -80.71 141.61 52.01 Favored Pre-proline 0 CA--C 1.545 0.754 0 CA-C-O 118.661 -0.685 . . . . 0.0 112.64 -177.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -53.9 -27.74 45.63 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.939 3.092 . . . . 0.0 115.043 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 56.0 p -66.0 -17.94 65.02 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.417 1.487 . . . . 0.0 114.029 177.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -133.77 16.35 3.93 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.593 1.957 . . . . 0.0 112.927 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -74.7 164.02 27.04 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.758 1.223 . . . . 0.0 113.858 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -105.8 28.75 7.23 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.212 2.205 . . . . 0.0 112.67 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -58.84 -22.14 58.26 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.048 1.339 . . . . 0.0 113.873 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -70.88 -21.22 62.42 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.072 1.349 . . . . 0.0 113.164 175.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 35.6 tp -105.59 -4.23 21.38 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.808 2.043 . . . . 0.0 112.623 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 47.9 mmm -62.19 153.24 30.95 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 -177.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 94.7 mt -125.21 155.96 39.23 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 127.336 2.254 . . . . 0.0 112.337 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 33.5 p -75.95 160.01 79.5 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 170.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -61.81 -17.43 55.11 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 121.83 1.687 . . . . 0.0 114.139 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 28.8 t70 -77.08 -25.76 52.67 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.216 1.006 . . . . 0.0 112.877 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -77.89 -14.11 59.66 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.859 0.864 . . . . 0.0 112.703 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 77.7 mt -58.41 -37.46 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.892 1.277 . . . . 0.0 110.615 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -68.14 -9.96 50.52 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.068 1.747 . . . . 0.0 113.113 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -86.71 -27.05 23.94 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.666 1.186 . . . . 0.0 112.561 178.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -98.48 -40.36 8.3 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.981 0.912 . . . . 0.0 112.349 174.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -90.37 109.62 20.73 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 104.128 -2.545 . . . . 0.0 104.128 169.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 2.7 m -74.47 123.9 25.58 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -170.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -120.07 174.37 6.52 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.829 2.052 . . . . 0.0 110.417 175.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -61.79 129.26 91.44 Favored Pre-proline 0 CA--C 1.552 1.023 0 O-C-N 120.999 -1.063 . . . . 0.0 112.015 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -78.7 -19.97 10.9 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.237 2.625 . . . . 0.0 115.296 -176.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 65.36 -165.0 36.51 Favored Glycine 0 CA--C 1.543 1.841 0 CA-C-N 118.519 0.6 . . . . 0.0 112.9 -175.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -66.2 -25.16 50.51 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.514 2.809 . . . . 0.0 115.004 -178.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 32.3 t70 -95.51 -29.71 14.23 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -174.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -84.7 15.56 41.22 Favored Glycine 0 CA--C 1.537 1.455 0 C-N-CA 124.621 1.105 . . . . 0.0 115.811 -178.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 78.6 p -65.41 3.67 0.65 Allowed 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 -177.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 95.5 m -58.52 -31.64 68.1 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 126.573 1.949 . . . . 0.0 113.793 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -143.66 -170.79 3.38 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.78 1.632 . . . . 0.0 111.043 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 47.4 t30 -79.75 71.8 6.42 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 172.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . 103.74 -166.92 15.98 Favored Glycine 0 CA--C 1.541 1.677 0 C-N-CA 126.715 2.103 . . . . 0.0 108.477 -169.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 80.0 p -87.59 -4.17 58.96 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 120.492 -1.593 . . . . 0.0 113.842 178.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -66.16 121.27 14.8 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.561 1.144 . . . . 0.0 112.183 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 24.8 p -66.64 -19.63 65.81 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.011 1.324 . . . . 0.0 113.093 177.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -168.4 158.19 30.78 Favored Glycine 0 CA--C 1.539 1.585 0 C-N-CA 127.987 2.708 . . . . 0.0 109.566 177.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -56.5 148.37 63.55 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.134 2.556 . . . . 0.0 114.349 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 12.1 t -61.34 -18.85 60.62 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.662 0.785 . . . . 0.0 113.034 178.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -70.36 -4.9 24.51 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.815 1.246 . . . . 0.0 113.971 176.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 13.0 t70 -77.54 137.52 63.38 Favored Pre-proline 0 CA--C 1.552 1.048 0 O-C-N 120.823 -1.173 . . . . 0.0 111.419 178.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -53.3 -33.54 66.14 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.35 2.7 . . . . 0.0 114.973 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -70.82 -16.87 62.76 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.877 0.871 . . . . 0.0 113.157 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -90.1 -43.58 10.38 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.857 1.263 . . . . 0.0 112.116 176.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -54.35 -43.86 71.65 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 120.039 1.29 . . . . 0.0 112.106 178.228 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -60.7 -31.2 70.48 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 96.4 mt -71.41 -41.16 69.92 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.2 0.909 . . . . 0.0 111.705 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.9 mt -64.22 -51.75 64.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -55.94 -54.64 42.26 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.636 1.174 . . . . 0.0 111.258 177.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -35.6 80.79 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -177.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -66.35 -46.25 77.43 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.765 1.166 . . . . 0.0 109.773 176.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 10.3 tp -59.94 -42.03 93.11 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.118 0.567 . . . . 0.0 111.017 176.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 84.3 t -60.93 -31.01 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.661 1.119 . . . . 0.0 111.285 175.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.6 tp -74.79 -28.18 60.62 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.228 1.376 . . . . 0.0 112.816 174.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 8.6 mp -61.31 -28.13 68.98 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 120.288 1.404 . . . . 0.0 108.934 171.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.9 mt -74.55 -58.7 3.12 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.079 -0.962 . . . . 0.0 108.926 174.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 25.2 t60 -47.6 -55.37 9.43 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.062 0.846 . . . . 0.0 110.438 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -51.0 -36.08 37.35 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.355 1.062 . . . . 0.0 113.74 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -83.62 -37.8 22.41 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 178.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -70.06 -37.32 75.48 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 119.848 1.204 . . . . 0.0 110.578 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 36.5 t -65.95 -43.04 89.12 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.813 2.045 . . . . 0.0 110.899 176.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -48.8 -36.77 17.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.631 1.172 . . . . 0.0 113.135 175.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -62.93 -26.24 68.72 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.123 0.969 . . . . 0.0 113.564 178.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.5 -34.54 75.68 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.715 1.143 . . . . 0.0 112.571 -179.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -82.55 -46.78 12.92 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.959 0.903 . . . . 0.0 110.647 177.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 16.2 tp60 -61.04 -34.05 74.26 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -80.93 -9.88 59.78 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -119.89 -45.12 2.49 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -176.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 77.16 -3.79 56.84 Favored Glycine 0 CA--C 1.542 1.754 0 N-CA-C 117.402 1.721 . . . . 0.0 117.402 178.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -117.61 -37.6 3.44 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.996 1.898 . . . . 0.0 113.211 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 33.7 m -71.24 165.26 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 124.186 0.994 . . . . 0.0 112.468 177.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 30.9 mmt180 -104.38 172.66 6.67 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.307 1.443 . . . . 0.0 112.814 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -73.63 168.65 18.9 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.93 1.292 . . . . 0.0 113.445 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 1.3 t -57.71 144.78 36.77 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.75 2.02 . . . . 0.0 113.445 -178.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 75.3 p -81.73 -11.97 58.81 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.719 1.208 . . . . 0.0 113.488 178.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 3.5 tt -73.74 114.75 35.29 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 126.073 1.749 . . . . 0.0 108.671 178.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -54.07 -41.79 72.5 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.047 2.498 . . . . 0.0 115.007 -175.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 54.2 m80 -69.43 -31.28 69.52 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 24.6 t -68.96 -53.13 22.45 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.532 1.133 . . . . 0.0 108.605 175.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 20.6 ttt85 -55.12 -32.45 62.06 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.517 1.527 . . . . 0.0 111.644 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.2 m -73.36 -59.06 2.89 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.17 1.388 . . . . 0.0 111.336 174.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.7 mmt -62.28 -36.25 81.5 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -65.15 -29.29 70.11 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 120.588 1.54 . . . . 0.0 112.711 178.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -74.9 -38.52 61.82 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.35 0.66 . . . . 0.0 110.447 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 84.1 t -63.17 -44.28 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.729 0.695 . . . . 0.0 110.011 175.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -47.65 84.06 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.189 0.996 . . . . 0.0 110.784 177.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -63.81 -22.96 67.17 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 176.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 71.5 t60 -83.94 -49.78 8.66 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.998 0.817 . . . . 0.0 109.632 174.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 34.8 ttp -57.57 -29.4 64.4 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.418 1.887 . . . . 0.0 113.559 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 20.2 p -69.85 -29.1 66.26 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 121.087 -1.008 . . . . 0.0 112.528 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -95.79 -26.34 15.7 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.894 1.678 . . . . 0.0 112.992 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 18.0 t -60.63 150.26 32.46 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.598 1.559 . . . . 0.0 112.873 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -121.25 -13.18 8.53 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.888 1.675 . . . . 0.0 113.638 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -95.57 -27.64 15.24 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.254 1.022 . . . . 0.0 112.421 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.55 -113.07 2.77 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 124.534 1.064 . . . . 0.0 113.132 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -63.46 -15.58 58.16 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.149 -1.206 . . . . 0.0 113.644 178.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -97.92 -1.71 42.28 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.242 1.417 . . . . 0.0 113.128 175.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 18.5 t -60.33 144.02 51.6 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 122.278 1.037 . . . . 0.0 110.839 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 58.1 mm-40 -78.88 -7.75 58.22 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.562 1.145 . . . . 0.0 113.0 -176.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 93.8 t -90.23 116.57 31.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 173.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.34 -38.6 68.97 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -65.93 -44.74 84.23 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.212 0.605 . . . . 0.0 112.247 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 40.4 t -59.94 -55.9 28.32 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.992 1.317 . . . . 0.0 110.728 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.95 -22.59 64.58 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.7 m -83.4 -51.56 7.29 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.882 0.873 . . . . 0.0 111.368 176.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 57.7 m -58.51 -35.98 73.1 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.269 -0.895 . . . . 0.0 112.354 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 37.3 tpt85 -63.7 -24.76 67.91 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.48 -0.762 . . . . 0.0 112.982 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -72.62 -30.4 64.31 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.015 0.825 . . . . 0.0 111.152 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.0 mm -70.51 -44.73 76.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 175.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 26.7 mm -60.22 -37.91 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.725 1.21 . . . . 0.0 110.645 176.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 67.4 m -61.64 -25.23 67.24 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.047 0.939 . . . . 0.0 113.324 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.2 t60 -62.84 -56.73 14.8 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.87 1.214 . . . . 0.0 110.838 179.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 51.8 m95 -62.85 -21.47 65.98 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 64.0 mttm -82.19 -26.77 33.07 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.331 1.052 . . . . 0.0 112.799 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -100.12 -43.64 6.26 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.955 1.302 . . . . 0.0 113.341 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 9.4 t -84.0 133.53 34.67 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.579 1.952 . . . . 0.0 110.958 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 69.4 p -129.97 -4.69 4.52 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.644 1.35 . . . . 0.0 114.644 -177.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 77.1 mtp85 -66.19 153.39 42.56 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.815 1.646 . . . . 0.0 113.64 -178.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -86.97 -26.45 23.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.444 0.698 . . . . 0.0 111.349 171.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 21.3 t0 -108.06 78.7 1.2 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.865 2.066 . . . . 0.0 111.433 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.0 t -136.48 136.01 21.49 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 127.289 2.236 . . . . 0.0 108.334 178.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -59.01 -24.28 72.62 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.763 2.309 . . . . 0.0 114.068 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.9 t -92.15 -52.01 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.694 1.134 . . . . 0.0 111.288 175.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 10.8 m -68.6 -42.1 78.63 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.974 1.472 . . . . 0.0 114.974 -175.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.2 tt -52.27 -57.48 15.18 Favored Pre-proline 0 CA--C 1.547 0.844 0 CA-C-O 117.802 -1.094 . . . . 0.0 113.316 -177.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -60.46 -31.65 92.79 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.78 1.654 . . . . 0.0 113.54 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.6 mt -73.25 -44.58 59.14 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.659 0.784 . . . . 0.0 112.255 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -58.94 -37.86 77.69 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.842 0.857 . . . . 0.0 110.305 174.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 38.5 t30 -73.37 -36.57 66.11 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.94 1.696 . . . . 0.0 113.385 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -84.87 -20.32 30.99 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -178.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 42.4 t -58.22 149.94 22.86 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -73.36 -11.8 60.61 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 177.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -108.39 20.39 18.67 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.774 1.63 . . . . 0.0 113.262 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 58.1 ttt-85 . . . . . 0 N--CA 1.48 1.028 0 C-N-CA 127.278 2.231 . . . . 0.0 112.429 179.882 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.497 0 N-CA-C 114.779 0.672 . . . . 0.0 114.779 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.3 t -149.35 153.45 37.45 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.942 1.697 . . . . 0.0 111.548 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 27.4 t60 -61.08 -23.36 65.42 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.768 0.827 . . . . 0.0 112.074 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 64.9 mtt -72.8 -21.76 60.93 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.301 1.04 . . . . 0.0 112.352 175.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -98.89 -36.91 9.62 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.404 1.482 . . . . 0.0 111.48 177.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -136.98 91.59 14.88 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.984 1.713 . . . . 0.0 109.808 178.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -77.29 58.31 6.2 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 124.553 3.502 . . . . 0.0 112.884 -177.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.08 169.74 16.9 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.897 1.279 . . . . 0.0 113.409 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 8.6 t -146.83 165.19 30.46 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.344 1.458 . . . . 0.0 111.371 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -138.8 144.22 40.81 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 125.681 1.593 . . . . 0.0 111.734 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -71.65 -27.09 18.86 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.073 2.515 . . . . 0.0 112.79 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 76.2 p -153.98 141.67 19.96 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.193 2.197 . . . . 0.0 110.011 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 9.1 p -142.75 6.42 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 C-N-CA 124.728 1.211 . . . . 0.0 113.578 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -126.55 81.89 67.51 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 125.819 1.648 . . . . 0.0 110.066 178.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.48 -25.94 20.71 Favored 'Trans proline' 0 CA--C 1.55 1.295 0 C-N-CA 123.18 2.586 . . . . 0.0 118.745 -176.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -74.09 150.8 43.51 Favored 'Trans proline' 0 C--N 1.356 0.949 0 CA-C-N 124.587 2.674 . . . . 0.0 113.238 -177.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 14.0 tp -79.11 138.53 37.97 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.059 0.944 . . . . 0.0 110.711 177.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 40.5 t -70.38 134.23 47.66 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.812 -0.555 . . . . 0.0 109.617 175.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 6.2 pm0 -60.63 -24.76 65.78 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -68.48 -15.69 63.63 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.584 0.754 . . . . 0.0 113.034 177.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 91.2 m -59.9 -60.13 4.32 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.764 0.826 . . . . 0.0 110.028 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.35 -29.37 68.85 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.157 0.983 . . . . 0.0 112.956 174.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 18.2 m -69.26 -33.92 73.98 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -90.18 -28.07 19.15 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.062 0.945 . . . . 0.0 112.985 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -44.76 -60.13 2.18 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 126.761 2.024 . . . . 0.0 113.932 -176.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -68.03 -10.24 52.16 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -171.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.67 -56.59 2.36 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -176.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 53.2 mt -119.99 11.4 11.74 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 -171.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.0 139.1 34.0 Favored Pre-proline 0 CA--C 1.552 1.03 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -177.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -72.95 164.69 34.87 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 124.663 3.575 . . . . 0.0 114.34 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -69.16 -11.78 61.1 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 178.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -122.78 118.91 29.11 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.19 1.396 . . . . 0.0 111.036 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 5.1 p30 -150.77 170.75 18.48 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 125.855 1.662 . . . . 0.0 110.907 177.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 33.4 m -111.81 11.09 8.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 N-CA-C 115.345 1.609 . . . . 0.0 115.345 -176.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 34.4 tp -110.23 -18.52 13.27 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 -176.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 47.1 m -42.31 105.41 0.41 Allowed Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 125.853 1.661 . . . . 0.0 114.795 -178.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -86.09 145.17 8.54 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 123.418 2.745 . . . . 0.0 111.567 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 83.2 mt -86.87 151.67 52.58 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 123.709 0.804 . . . . 0.0 112.314 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -55.2 -31.5 76.28 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.303 2.669 . . . . 0.0 113.95 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 15.8 m -67.13 -15.15 63.53 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.583 1.153 . . . . 0.0 113.152 176.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -108.05 0.33 21.69 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.557 2.343 . . . . 0.0 111.94 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -69.54 157.13 37.75 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -97.49 25.96 5.31 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 129.506 3.122 . . . . 0.0 112.917 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 38.5 t70 -66.19 -15.09 62.86 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.62 1.568 . . . . 0.0 114.555 -177.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 37.4 t70 -67.0 -14.55 63.01 Favored 'General case' 0 CA--C 1.551 1.003 0 O-C-N 120.764 -1.21 . . . . 0.0 112.566 175.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 27.8 tp -119.3 16.5 13.1 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.48 2.312 . . . . 0.0 112.195 -179.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.85 137.85 56.9 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -174.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -125.03 139.37 53.87 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 128.088 2.555 . . . . 0.0 111.994 -179.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 73.8 p -64.79 146.29 98.62 Favored Pre-proline 0 N--CA 1.473 0.725 0 C-N-CA 124.109 0.963 . . . . 0.0 113.237 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -60.79 -30.26 89.86 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.816 2.344 . . . . 0.0 114.393 -177.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.27 -22.57 66.31 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.526 -0.734 . . . . 0.0 112.623 176.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 13.6 t70 -90.06 -9.85 46.95 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 84.7 mt -55.92 -37.81 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-N 119.638 1.108 . . . . 0.0 111.035 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -64.07 -9.73 18.02 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.133 1.373 . . . . 0.0 113.961 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.4 tp60 -77.43 -37.87 50.8 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.079 -1.013 . . . . 0.0 111.323 174.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -88.18 -49.98 6.66 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.486 0.714 . . . . 0.0 111.979 178.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -92.81 109.76 21.19 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 103.316 -2.846 . . . . 0.0 103.316 169.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -72.77 112.55 8.91 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -171.077 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -78.14 147.31 34.64 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.264 1.026 . . . . 0.0 109.481 175.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -61.08 119.69 47.62 Favored Pre-proline 0 CA--C 1.551 0.989 0 O-C-N 121.144 -0.972 . . . . 0.0 112.196 -177.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -81.71 -6.18 12.46 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.508 2.805 . . . . 0.0 114.373 -178.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 67.07 -137.58 33.74 Favored Glycine 0 CA--C 1.542 1.758 0 O-C-N 121.307 -0.871 . . . . 0.0 111.714 -177.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -71.61 -19.29 28.24 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.251 2.634 . . . . 0.0 113.462 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 26.9 t0 -88.75 48.1 1.59 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.536 1.534 . . . . 0.0 112.121 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -66.27 4.17 2.86 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.967 1.746 . . . . 0.0 117.18 -177.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 33.3 m -54.78 -29.48 54.34 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.464 1.632 . . . . 0.0 113.979 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 82.1 m -60.62 -25.03 65.98 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.788 1.235 . . . . 0.0 113.482 178.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -58.82 -28.5 66.08 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.168 0.895 . . . . 0.0 112.648 177.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -65.52 -28.16 68.98 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 121.344 -0.848 . . . . 0.0 112.139 176.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -92.21 -37.82 5.85 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 125.035 1.302 . . . . 0.0 113.954 178.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 73.7 p -79.81 -17.32 53.62 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -178.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -60.53 -6.34 1.58 Allowed 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.815 1.783 . . . . 0.0 115.815 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 41.0 p -67.25 -22.25 65.68 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.564 1.146 . . . . 0.0 112.846 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 136.15 84.29 0.17 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 125.398 1.475 . . . . 0.0 112.647 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.4 -43.05 49.45 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.785 2.99 . . . . 0.0 113.177 -178.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 69.1 p -121.17 -4.9 9.48 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.599 1.56 . . . . 0.0 113.317 177.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -87.16 -21.57 25.86 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -178.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 9.7 t70 -85.99 128.95 56.05 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 123.735 0.814 . . . . 0.0 111.78 -179.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -54.06 -33.58 74.13 Favored 'Trans proline' 0 C--N 1.351 0.672 0 C-N-CA 123.377 2.718 . . . . 0.0 114.592 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -68.39 -21.62 64.68 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.099 0.959 . . . . 0.0 112.662 178.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -90.04 -43.99 10.15 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.083 1.353 . . . . 0.0 110.465 173.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -53.64 -44.3 69.47 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.092 0.957 . . . . 0.0 112.16 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -63.5 -30.98 72.02 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 177.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 75.9 mt -70.14 -40.93 74.5 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.618 0.767 . . . . 0.0 110.031 175.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.5 mt -60.65 -50.78 79.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.19 -53.18 57.04 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.413 1.085 . . . . 0.0 111.516 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -35.45 79.56 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -69.41 -46.77 66.05 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.951 0.796 . . . . 0.0 110.865 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.7 tt -58.81 -43.1 90.51 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.034 0.934 . . . . 0.0 110.379 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 60.2 t -61.56 -31.81 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.979 0.809 . . . . 0.0 111.515 175.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 33.6 tp -67.02 -37.55 84.34 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.606 -1.309 . . . . 0.0 111.976 174.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.93 -25.57 63.58 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 119.326 0.966 . . . . 0.0 110.955 176.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 7.0 mt -74.07 -55.12 6.49 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.734 0.814 . . . . 0.0 109.737 176.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 14.2 t60 -56.96 -50.48 72.51 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 119.192 -0.432 . . . . 0.0 110.898 178.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -60.01 -22.53 62.71 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -178.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -90.14 -31.06 17.25 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.975 -1.078 . . . . 0.0 112.927 173.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 58.1 mttm -80.09 -40.01 28.45 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.104 1.362 . . . . 0.0 112.6 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.5 t -63.06 -45.79 90.53 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.527 1.931 . . . . 0.0 111.44 177.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -61.19 -37.11 81.76 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.292 -0.88 . . . . 0.0 111.783 175.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.79 -43.55 79.47 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.425 1.09 . . . . 0.0 110.8 176.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -60.0 -42.43 94.24 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.897 1.679 . . . . 0.0 111.249 176.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -66.07 -47.74 73.27 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.777 0.831 . . . . 0.0 110.795 176.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -61.6 -37.49 84.11 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.856 1.262 . . . . 0.0 112.694 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -65.56 -33.09 75.1 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.464 1.105 . . . . 0.0 113.123 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -88.8 -50.3 6.31 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.119 0.967 . . . . 0.0 112.092 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 71.95 -2.03 28.29 Favored Glycine 0 CA--C 1.54 1.633 0 N-CA-C 117.011 1.564 . . . . 0.0 117.011 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -120.21 4.81 10.8 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 119.562 1.681 . . . . 0.0 113.932 -178.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 32.9 m -128.62 161.91 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 125.753 1.621 . . . . 0.0 112.417 179.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 41.1 ptt180 -93.8 170.1 9.81 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.62 1.568 . . . . 0.0 112.072 177.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -70.58 174.84 5.37 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.502 1.121 . . . . 0.0 113.048 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 22.4 p -68.83 174.88 3.98 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.362 1.865 . . . . 0.0 114.583 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 22.2 m -84.75 -1.35 56.17 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 115.113 1.523 . . . . 0.0 115.113 -177.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 62.2 tp -84.89 113.33 49.12 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 125.093 1.357 . . . . 0.0 110.836 -178.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -63.64 -31.73 69.76 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.325 2.017 . . . . 0.0 114.102 -177.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 35.9 m80 -70.56 -23.36 62.59 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 40.4 t -62.32 -46.74 87.35 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.27 1.028 . . . . 0.0 109.91 176.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -54.92 -35.22 63.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.36 1.464 . . . . 0.0 112.146 175.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 49.3 m -72.07 -60.18 2.36 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.614 0.765 . . . . 0.0 110.807 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 15.6 mmt -60.34 -34.03 73.25 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -64.88 -33.58 76.35 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 120.566 1.53 . . . . 0.0 112.675 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -72.14 -37.91 69.34 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.131 0.572 . . . . 0.0 110.197 174.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 66.9 t -62.45 -46.61 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 122.948 0.499 . . . . 0.0 110.696 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.0 -43.7 98.5 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.975 0.91 . . . . 0.0 111.799 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -64.86 -32.89 74.81 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 176.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 61.0 t60 -75.04 -52.07 11.99 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.728 0.811 . . . . 0.0 110.204 175.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 40.6 ttp -56.73 -31.16 64.26 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.524 1.93 . . . . 0.0 114.304 -177.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.7 t -77.98 -9.94 59.35 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 120.059 1.3 . . . . 0.0 112.99 176.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -118.93 -14.0 9.43 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.749 1.619 . . . . 0.0 113.916 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 43.5 t -56.61 144.65 31.16 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.684 1.594 . . . . 0.0 113.045 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -96.71 -13.84 22.45 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.003 1.721 . . . . 0.0 113.588 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -118.7 -30.68 5.05 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.268 1.027 . . . . 0.0 113.558 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.21 -107.58 0.6 Allowed Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.717 1.151 . . . . 0.0 113.436 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -61.62 -20.59 63.52 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 121.053 -1.263 . . . . 0.0 112.945 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -100.51 1.52 41.11 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.062 1.745 . . . . 0.0 113.561 176.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.5 t -63.54 139.86 58.81 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.262 1.025 . . . . 0.0 110.013 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -81.44 0.14 38.98 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -175.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 16.6 t -90.49 125.3 43.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.732 1.213 . . . . 0.0 109.159 176.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.38 -28.1 51.83 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -175.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -90.06 -18.63 25.57 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.686 1.735 . . . . 0.0 115.686 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 52.7 t -83.17 -59.86 2.33 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.126 1.37 . . . . 0.0 111.076 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.02 -29.53 65.38 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 4.7 p -73.57 -54.92 7.06 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 124.958 1.303 . . . . 0.0 111.822 176.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 53.0 m -59.4 -34.68 72.74 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.47 0.708 . . . . 0.0 111.692 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 45.1 tpt85 -62.86 -30.02 71.2 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -67.78 -34.7 77.31 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.307 0.958 . . . . 0.0 110.963 175.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 10.2 mt -67.82 -45.64 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 124.15 0.98 . . . . 0.0 109.731 176.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 15.0 mm -60.76 -36.74 73.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.918 0.887 . . . . 0.0 111.229 176.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.14 -21.17 66.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 177.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.0 t60 -64.11 -59.97 3.8 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.422 1.01 . . . . 0.0 110.726 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 62.4 m95 -60.62 -26.95 67.39 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 63.4 mttm -71.5 -34.76 70.41 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.831 0.852 . . . . 0.0 112.787 178.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.14 -32.31 10.97 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 178.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 9.6 t -78.21 133.78 37.69 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.444 1.498 . . . . 0.0 111.996 -178.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 71.5 p -130.09 -1.04 4.64 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.335 1.454 . . . . 0.0 114.492 -178.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -80.14 150.26 30.27 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.738 1.215 . . . . 0.0 112.685 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.1 p-80 -84.37 -36.13 22.69 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.329 0.652 . . . . 0.0 111.569 175.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.8 t0 -94.19 70.05 3.8 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.069 1.748 . . . . 0.0 111.854 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 47.7 t -122.99 134.2 24.94 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 126.329 1.852 . . . . 0.0 109.524 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -58.33 -25.64 73.68 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.927 2.418 . . . . 0.0 114.36 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 39.3 t -92.12 -52.55 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 119.209 0.913 . . . . 0.0 111.65 176.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 7.8 m -69.73 -36.97 76.31 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -175.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -57.36 -57.12 27.26 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 117.625 -1.178 . . . . 0.0 112.337 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -59.94 -30.9 92.82 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.778 1.652 . . . . 0.0 113.197 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 94.5 mt -70.28 -47.02 63.1 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.183 0.901 . . . . 0.0 111.869 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -63.64 -37.97 89.36 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.725 0.693 . . . . 0.0 110.635 176.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 34.3 t30 -65.47 -36.55 84.23 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.638 1.175 . . . . 0.0 112.267 176.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -79.32 -29.57 42.4 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.304 1.041 . . . . 0.0 113.325 178.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 28.3 t -67.84 134.37 50.78 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -177.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 34.9 t70 -100.74 1.32 40.25 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.853 1.261 . . . . 0.0 111.657 175.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -76.77 -7.16 54.87 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.649 1.58 . . . . 0.0 113.813 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 . . . . . 0 N--CA 1.477 0.924 0 C-N-CA 126.509 1.924 . . . . 0.0 111.998 178.452 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.375 0 CA-C-O 121.273 0.374 . . . . 0.0 113.994 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.7 p -81.29 155.29 26.12 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.891 1.276 . . . . 0.0 113.067 179.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 65.5 m80 -138.65 161.95 35.86 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.818 1.647 . . . . 0.0 111.865 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 76.9 mtm -133.25 157.02 46.48 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.537 1.535 . . . . 0.0 111.669 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -91.49 -23.32 20.01 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.894 1.278 . . . . 0.0 113.53 178.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -60.36 -46.21 97.56 Favored Pre-proline 0 CA--C 1.552 1.028 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -76.76 2.46 7.45 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 122.797 2.331 . . . . 0.0 114.379 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -86.38 12.66 9.64 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.008 1.323 . . . . 0.0 113.867 -178.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 64.9 p -66.45 158.95 28.16 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.441 1.496 . . . . 0.0 113.934 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -105.13 151.52 39.55 Favored Pre-proline 0 N--CA 1.469 0.508 0 C-N-CA 125.56 1.544 . . . . 0.0 112.997 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -63.47 121.18 8.87 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 122.83 2.354 . . . . 0.0 109.235 177.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 50.2 m -19.92 103.87 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 129.876 3.271 . . . . 0.0 114.865 -175.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 11.8 p -141.58 149.66 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 126.856 2.063 . . . . 0.0 110.78 -177.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -99.36 113.82 65.11 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.373 1.069 . . . . 0.0 111.421 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.42 -45.93 31.14 Favored 'Trans proline' 0 CA--C 1.549 1.251 0 C-N-CA 122.955 2.437 . . . . 0.0 115.185 178.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -85.83 162.58 10.52 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.217 2.611 . . . . 0.0 112.151 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 8.7 tt -98.48 132.3 44.03 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.174 0.99 . . . . 0.0 111.196 177.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 32.7 t -93.64 146.31 23.92 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.606 1.162 . . . . 0.0 110.967 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 9.4 pm0 -55.55 -27.98 52.21 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 -178.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -66.33 -19.3 65.77 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 6.2 m -63.57 -58.29 7.43 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.064 0.946 . . . . 0.0 110.832 -179.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -60.24 -31.14 69.92 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.527 0.731 . . . . 0.0 112.49 176.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 49.0 m -69.86 -29.32 66.52 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.863 0.756 . . . . 0.0 112.871 177.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.0 t70 -90.17 -29.76 18.05 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.776 1.231 . . . . 0.0 113.23 176.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.1 tt -45.49 -60.0 2.41 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.943 2.097 . . . . 0.0 113.42 -177.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.0 p-90 -69.6 -10.49 58.41 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -173.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -109.6 -53.77 2.63 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 115.748 1.759 . . . . 0.0 115.748 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 59.6 mt -119.9 11.61 11.86 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 116.263 1.949 . . . . 0.0 116.263 -172.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 7.0 tt -57.37 127.07 76.46 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 124.249 1.019 . . . . 0.0 111.279 178.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -76.55 171.05 18.76 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 124.056 3.171 . . . . 0.0 112.963 -178.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -69.24 11.21 0.24 Allowed 'General case' 0 CA--C 1.551 1.005 0 N-CA-C 116.784 2.142 . . . . 0.0 116.784 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 48.5 t30 -145.54 129.84 17.69 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.967 1.707 . . . . 0.0 110.019 177.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -150.36 159.65 44.3 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.365 1.066 . . . . 0.0 112.371 179.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 94.5 t -73.27 -35.92 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 124.887 1.275 . . . . 0.0 111.957 178.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 38.8 tp -83.96 109.57 17.73 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.494 0.718 . . . . 0.0 109.451 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 74.8 m -115.06 99.99 53.04 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 125.285 1.434 . . . . 0.0 110.634 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -62.16 150.7 85.77 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 123.74 2.96 . . . . 0.0 113.346 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 88.0 mt -134.83 115.22 12.18 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.96 1.304 . . . . 0.0 111.191 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -53.46 -31.8 59.84 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.928 3.086 . . . . 0.0 115.072 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 16.7 m -61.26 -17.16 52.09 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.074 1.35 . . . . 0.0 114.511 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -133.67 17.17 3.93 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.902 1.681 . . . . 0.0 112.913 179.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -79.83 157.2 27.08 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.598 1.159 . . . . 0.0 113.961 -178.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.24 20.85 3.05 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 127.064 2.145 . . . . 0.0 113.822 178.262 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -64.32 -18.6 64.77 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 -176.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 35.7 t70 -63.78 -18.05 63.69 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.937 0.895 . . . . 0.0 113.265 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 98.5 mt -99.64 5.31 45.87 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.102 1.761 . . . . 0.0 113.764 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 71.6 mmm -62.39 151.49 36.81 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.09 168.0 14.0 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.874 2.07 . . . . 0.0 110.866 178.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 59.4 m -75.49 145.6 79.51 Favored Pre-proline 0 CA--C 1.546 0.825 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 169.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -57.02 -18.66 29.35 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.755 2.303 . . . . 0.0 115.527 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -77.16 -24.29 51.52 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.531 1.133 . . . . 0.0 112.723 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 18.5 t70 -81.84 -9.91 59.47 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.028 0.931 . . . . 0.0 113.221 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 67.7 mt -55.88 -35.24 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.277 1.431 . . . . 0.0 110.283 175.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -67.06 -9.87 43.87 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.784 1.634 . . . . 0.0 113.643 178.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -82.28 -27.04 32.59 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.034 0.934 . . . . 0.0 111.7 176.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.3 p-90 -98.6 -42.27 7.34 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 118.106 -0.95 . . . . 0.0 112.316 176.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -96.91 109.89 22.52 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 169.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.32 151.01 46.6 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.322 1.049 . . . . 0.0 113.489 -175.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -101.22 153.47 19.59 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.115 1.366 . . . . 0.0 109.645 173.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 9.3 t0 -65.58 123.01 83.39 Favored Pre-proline 0 CA--C 1.554 1.112 0 O-C-N 121.238 -0.914 . . . . 0.0 111.693 -178.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -84.79 -4.03 9.85 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.98 3.12 . . . . 0.0 114.788 -176.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 89.3 -147.13 19.38 Favored Glycine 0 CA--C 1.544 1.855 0 C-N-CA 125.108 1.337 . . . . 0.0 113.045 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.84 -1.42 11.37 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 124.523 3.482 . . . . 0.0 115.173 -177.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 32.4 t70 -132.53 149.83 52.26 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.803 1.641 . . . . 0.0 111.387 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 77.98 -3.26 61.83 Favored Glycine 0 CA--C 1.538 1.503 0 C-N-CA 124.468 1.032 . . . . 0.0 115.503 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 53.5 p -81.42 20.82 0.83 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.524 1.93 . . . . 0.0 113.888 178.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 60.4 m -59.47 -19.55 48.63 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 127.164 2.186 . . . . 0.0 114.898 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -132.37 151.19 51.97 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.99 1.716 . . . . 0.0 110.047 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 45.1 p-10 -59.36 -38.67 81.02 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 120.887 -1.133 . . . . 0.0 112.262 178.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -61.52 -42.06 99.69 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.866 1.222 . . . . 0.0 113.156 177.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 82.8 p -80.15 -29.87 38.87 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 118.467 1.134 . . . . 0.0 112.478 177.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -71.22 -43.73 66.77 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.229 1.412 . . . . 0.0 114.182 -179.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 5.4 t -152.11 -3.33 0.26 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 115.929 1.826 . . . . 0.0 115.929 -177.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 58.81 57.59 19.07 Favored Glycine 0 CA--C 1.543 1.829 0 CA-C-N 119.57 1.077 . . . . 0.0 114.606 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -69.63 143.55 51.83 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 123.359 2.706 . . . . 0.0 112.76 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 74.0 p -95.93 7.64 45.81 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 126.046 1.739 . . . . 0.0 113.896 -179.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -73.23 -21.35 60.66 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.073 1.349 . . . . 0.0 114.414 -178.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 9.5 t70 -85.22 126.6 66.91 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 123.862 0.865 . . . . 0.0 111.432 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -64.36 -30.89 63.0 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.867 2.378 . . . . 0.0 113.927 -178.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -67.84 -23.63 65.18 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.045 0.938 . . . . 0.0 111.905 177.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -90.01 -49.72 6.43 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.095 1.358 . . . . 0.0 109.988 174.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -50.24 -43.76 53.1 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.77 1.628 . . . . 0.0 113.018 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -61.7 -32.61 72.83 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 177.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 83.2 mt -71.72 -39.34 70.18 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.345 1.058 . . . . 0.0 110.985 177.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 3.0 mt -62.79 -52.45 59.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.343 0.657 . . . . 0.0 109.583 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -56.18 -58.26 8.71 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.634 1.174 . . . . 0.0 111.218 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -35.78 81.72 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -177.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -65.62 -43.07 90.7 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.802 1.183 . . . . 0.0 110.332 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 8.0 tp -62.06 -39.89 93.92 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.25 0.62 . . . . 0.0 110.627 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 63.3 t -60.86 -34.3 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.131 0.878 . . . . 0.0 110.802 174.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 3.4 tp -71.48 -27.77 63.48 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 120.286 1.403 . . . . 0.0 112.853 175.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.9 mp -63.51 -29.2 70.51 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 120.523 1.51 . . . . 0.0 109.63 173.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.1 mt -75.55 -51.39 13.02 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.99 0.916 . . . . 0.0 108.739 174.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 30.6 t60 -53.31 -55.9 20.94 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 123.652 0.781 . . . . 0.0 110.827 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.97 -41.97 65.07 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.09 0.956 . . . . 0.0 113.338 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -72.34 -42.65 65.12 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.537 -0.727 . . . . 0.0 112.399 178.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 56.1 mttm -71.01 -36.47 72.43 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.638 1.175 . . . . 0.0 112.229 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 12.0 t -67.69 -41.44 83.61 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.44 1.896 . . . . 0.0 109.834 175.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -58.76 -43.55 90.35 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.357 1.063 . . . . 0.0 110.347 172.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 20.1 mmt180 -67.45 -36.13 80.59 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.356 -0.84 . . . . 0.0 113.02 175.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.35 -35.64 70.18 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.603 1.161 . . . . 0.0 110.914 174.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -77.81 -45.9 23.12 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 122.96 0.504 . . . . 0.0 110.944 175.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 16.4 tp60 -58.36 -33.05 69.13 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.782 0.833 . . . . 0.0 112.907 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -73.01 -10.02 59.35 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.625 1.17 . . . . 0.0 113.898 177.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -118.03 -48.4 2.55 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.561 1.544 . . . . 0.0 113.062 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 76.65 -1.55 61.61 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 117.387 1.715 . . . . 0.0 117.387 177.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -120.22 -32.02 4.25 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 120.046 1.923 . . . . 0.0 114.431 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 28.5 m -71.05 155.47 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -81.79 160.49 23.55 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.094 1.358 . . . . 0.0 111.562 176.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -74.4 175.04 8.07 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -177.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 2.2 t -56.94 155.18 8.37 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 127.256 2.223 . . . . 0.0 114.372 -178.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 11.1 t -76.26 -22.4 55.17 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.837 1.255 . . . . 0.0 112.794 178.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 38.4 mt -77.87 131.08 71.17 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 123.843 0.857 . . . . 0.0 113.005 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.09 -33.25 19.57 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 122.396 2.064 . . . . 0.0 110.551 175.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 41.2 m80 -66.57 -33.11 74.94 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.893 1.277 . . . . 0.0 113.032 178.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 40.7 t -67.55 -51.92 44.95 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.012 1.325 . . . . 0.0 109.678 177.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -57.15 -38.77 74.03 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.7 1.2 . . . . 0.0 111.123 174.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.9 m -65.98 -57.06 8.66 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.465 1.106 . . . . 0.0 111.596 177.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 15.0 mmt -63.41 -37.07 85.86 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 118.235 -0.888 . . . . 0.0 113.147 -177.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -65.34 -32.69 74.46 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 121.143 1.792 . . . . 0.0 112.084 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -69.92 -38.93 76.38 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.911 -0.493 . . . . 0.0 110.777 173.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 89.0 t -64.66 -42.73 95.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 118.791 0.723 . . . . 0.0 110.436 175.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.47 -45.98 84.21 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.344 1.057 . . . . 0.0 110.374 176.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -66.07 -21.54 66.37 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 177.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 60.3 t60 -86.43 -49.56 7.53 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.64 0.776 . . . . 0.0 109.697 174.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -58.31 -27.44 64.1 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.254 1.822 . . . . 0.0 113.532 -177.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 19.4 p -72.34 -26.54 61.96 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.519 1.128 . . . . 0.0 112.618 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 80.3 t60 -102.36 -21.83 14.22 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.06 1.744 . . . . 0.0 113.523 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 25.0 t -57.71 143.06 43.13 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.281 1.432 . . . . 0.0 113.144 -177.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -107.88 -15.7 14.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.999 1.72 . . . . 0.0 113.418 -178.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -103.23 -32.82 9.42 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.561 1.144 . . . . 0.0 112.281 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.56 -105.87 0.26 Allowed Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.979 1.276 . . . . 0.0 113.869 177.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -59.15 -22.13 60.45 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.31 -1.112 . . . . 0.0 112.943 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -102.59 1.78 35.24 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.398 1.879 . . . . 0.0 113.828 177.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 19.5 t -62.32 141.49 58.26 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.216 1.006 . . . . 0.0 110.575 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -81.74 -5.46 58.16 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.324 1.05 . . . . 0.0 113.333 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 97.8 t -86.86 115.57 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 172.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.09 -39.59 69.47 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -176.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.34 -40.89 96.78 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.659 0.784 . . . . 0.0 112.552 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.2 t -65.25 -57.16 9.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.469 1.508 . . . . 0.0 110.818 178.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -61.1 -27.65 68.52 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 68.5 m -76.85 -45.27 29.03 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.381 -0.825 . . . . 0.0 111.198 175.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 64.0 m -62.84 -35.98 81.71 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.239 1.016 . . . . 0.0 111.554 176.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 3.3 mmm-85 -61.81 -30.39 70.79 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -68.37 -29.56 68.3 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.363 0.983 . . . . 0.0 111.243 176.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 1.8 mm -73.28 -47.01 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 176.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 24.6 mm -61.15 -37.99 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.947 1.299 . . . . 0.0 111.571 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 49.1 m -62.78 -21.28 65.75 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.961 0.904 . . . . 0.0 113.222 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.6 t60 -66.24 -60.47 2.76 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.334 0.97 . . . . 0.0 110.448 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 67.2 m95 -59.6 -28.99 67.66 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 89.7 mttt -67.79 -36.09 79.83 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.652 0.781 . . . . 0.0 113.03 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.18 -31.82 11.2 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.1 t -79.22 135.19 36.71 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.198 1.399 . . . . 0.0 112.165 -177.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.7 p -130.1 -2.27 4.56 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.248 1.419 . . . . 0.0 114.644 -177.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -81.75 149.83 28.23 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.736 1.214 . . . . 0.0 112.876 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -84.56 -30.99 24.61 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.549 0.739 . . . . 0.0 111.493 174.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.3 t0 -97.33 69.93 2.28 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.228 1.811 . . . . 0.0 111.346 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.9 t -126.14 135.02 26.54 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 126.296 1.839 . . . . 0.0 109.723 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -57.76 -25.64 69.53 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 123.049 2.499 . . . . 0.0 114.606 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 14.7 t -92.23 -50.89 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 119.48 1.036 . . . . 0.0 111.795 176.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 6.9 m -70.44 -40.28 73.87 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -174.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.4 tt -54.43 -55.94 32.07 Favored Pre-proline 0 CA--C 1.547 0.862 0 CA-C-O 117.825 -1.083 . . . . 0.0 112.854 -178.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -60.92 -30.27 89.66 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.761 1.641 . . . . 0.0 113.454 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.88 -44.17 66.87 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.41 1.004 . . . . 0.0 111.645 177.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -64.97 -31.12 72.2 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.7 0.8 . . . . 0.0 111.35 175.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 32.4 t30 -75.98 -37.13 58.87 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.057 1.343 . . . . 0.0 112.074 176.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -74.45 -42.27 59.37 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.565 1.146 . . . . 0.0 113.53 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 10.6 t -85.59 157.6 20.33 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 122.093 0.949 . . . . 0.0 113.368 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 30.6 t70 -134.81 14.62 3.64 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.685 1.994 . . . . 0.0 111.099 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 22.0 pttm -74.02 -13.24 60.83 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 116.114 1.894 . . . . 0.0 116.114 -175.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 . . . . . 0 N--CA 1.476 0.85 0 C-N-CA 126.45 1.9 . . . . 0.0 110.857 177.769 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.611 0 N-CA-C 115.116 0.807 . . . . 0.0 115.116 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.3 t -149.43 149.06 30.2 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.585 1.554 . . . . 0.0 111.73 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -61.4 -24.22 66.36 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.839 0.856 . . . . 0.0 112.208 176.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 14.7 tpt -63.28 -22.54 66.94 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.567 1.147 . . . . 0.0 112.435 176.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -90.82 -3.43 57.39 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.221 1.408 . . . . 0.0 113.236 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -75.74 133.47 73.31 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 124.452 1.101 . . . . 0.0 111.79 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.05 103.15 1.33 Allowed 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.138 2.559 . . . . 0.0 112.084 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 46.2 mm-40 -130.76 4.1 4.54 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.7 1.6 . . . . 0.0 113.331 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 31.5 m -80.71 162.65 24.04 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.272 1.429 . . . . 0.0 112.779 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -137.34 148.69 63.02 Favored Pre-proline 0 CA--C 1.546 0.791 0 C-N-CA 125.521 1.528 . . . . 0.0 111.264 178.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -70.36 -17.05 35.11 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.131 2.554 . . . . 0.0 113.54 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 16.3 m -78.94 -0.2 30.01 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.699 1.6 . . . . 0.0 114.784 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 10.4 p -138.03 148.28 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 124.96 1.304 . . . . 0.0 112.144 -179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -152.14 158.51 33.68 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 125.717 1.607 . . . . 0.0 111.696 178.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -102.71 77.99 0.03 OUTLIER 'Trans proline' 0 CA--C 1.557 1.636 0 C-N-CA 125.289 3.993 . . . . 0.0 112.327 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -70.29 156.08 62.75 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.764 2.309 . . . . 0.0 113.453 -179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 42.2 tp -68.83 138.4 54.73 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.788 1.235 . . . . 0.0 110.463 176.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 17.4 t -93.87 150.92 19.96 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.448 0.699 . . . . 0.0 112.041 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -62.26 -25.86 68.07 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -87.87 -10.74 49.82 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 85.9 m -60.49 -58.42 8.56 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.287 0.949 . . . . 0.0 110.684 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -60.01 -27.09 66.59 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.6 0.76 . . . . 0.0 112.71 176.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 45.5 m -74.79 -30.62 61.5 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.931 0.892 . . . . 0.0 113.06 178.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.2 t70 -90.12 -29.38 18.34 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.581 1.152 . . . . 0.0 112.878 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -43.31 -60.15 1.81 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 127.515 2.326 . . . . 0.0 113.933 -177.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 51.7 p-90 -68.59 -9.79 51.87 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 -172.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -111.96 -56.83 2.34 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 -177.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 63.9 mt -120.02 14.26 12.3 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -170.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.8 tt -53.76 137.35 54.13 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 125.795 1.638 . . . . 0.0 113.842 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -78.26 165.68 25.38 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 124.197 3.265 . . . . 0.0 114.019 -178.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -65.58 -21.66 66.61 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.876 1.436 . . . . 0.0 114.876 -179.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -87.73 12.71 12.12 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -71.02 143.16 50.85 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 119.51 1.05 . . . . 0.0 112.458 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -130.67 17.09 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 124.9 1.28 . . . . 0.0 113.612 -177.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 8.0 tt -81.8 -15.45 54.12 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 120.405 -1.434 . . . . 0.0 113.741 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 5.9 t -57.58 129.21 80.65 Favored Pre-proline 0 CA--C 1.543 0.679 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -175.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.71 142.5 28.93 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 122.958 2.439 . . . . 0.0 110.066 174.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 88.4 mt -68.86 157.69 88.17 Favored Pre-proline 0 CA--C 1.547 0.836 0 O-C-N 121.636 -0.665 . . . . 0.0 111.792 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -55.29 -28.13 60.86 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 123.066 2.511 . . . . 0.0 114.174 178.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 44.0 p -77.63 -21.43 52.26 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.646 1.578 . . . . 0.0 113.191 175.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -95.4 -26.32 15.91 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.757 2.023 . . . . 0.0 111.961 178.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -59.84 139.29 57.44 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.178 1.391 . . . . 0.0 112.283 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 66.7 mtm -82.51 49.11 1.39 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.514 1.525 . . . . 0.0 113.75 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 38.7 t70 -73.13 -20.59 60.89 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.293 1.037 . . . . 0.0 112.678 178.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 37.4 t70 -68.59 -14.52 63.07 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 121.078 -1.013 . . . . 0.0 112.455 176.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 25.3 tp -119.26 16.67 13.14 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 127.477 2.311 . . . . 0.0 111.626 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.1 141.58 57.4 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -175.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.3 tt -125.16 142.39 51.52 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 128.657 2.783 . . . . 0.0 111.158 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 40.7 t -66.44 142.69 97.85 Favored Pre-proline 0 N--CA 1.477 0.878 0 C-N-CA 124.088 0.955 . . . . 0.0 112.372 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.66 -21.4 47.01 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.76 2.306 . . . . 0.0 115.445 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.7 t70 -75.78 -24.81 56.02 Favored 'General case' 0 CA--C 1.549 0.921 0 O-C-N 121.395 -0.815 . . . . 0.0 112.164 176.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -83.79 -9.72 58.59 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.371 1.869 . . . . 0.0 112.569 177.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 85.2 mt -56.02 -31.15 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.429 1.013 . . . . 0.0 109.678 174.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -67.85 -9.87 48.28 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.011 1.324 . . . . 0.0 113.703 176.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -80.78 -25.14 38.1 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.089 1.356 . . . . 0.0 111.803 177.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 4.5 p-90 -106.95 -28.23 10.19 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.6 1.16 . . . . 0.0 113.455 177.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -114.85 109.79 18.69 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 104.792 -2.299 . . . . 0.0 104.792 169.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.84 140.08 33.12 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -169.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -113.63 179.97 3.81 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.162 2.185 . . . . 0.0 111.0 175.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.32 126.23 90.01 Favored Pre-proline 0 CA--C 1.556 1.192 0 O-C-N 120.641 -1.287 . . . . 0.0 110.602 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -74.81 -19.59 18.2 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.286 2.657 . . . . 0.0 115.298 -176.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 62.11 -160.42 30.99 Favored Glycine 0 CA--C 1.545 1.928 0 CA-C-N 119.24 0.927 . . . . 0.0 113.226 -177.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -78.27 -11.64 16.0 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 123.735 2.957 . . . . 0.0 114.703 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -109.87 -13.63 14.42 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -177.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -73.88 35.83 0.89 Allowed Glycine 0 N--CA 1.475 1.256 0 C-N-CA 125.506 1.527 . . . . 0.0 116.505 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 61.5 m -69.27 109.29 4.04 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.599 1.2 . . . . 0.0 108.686 176.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 28.4 p -72.57 158.66 35.26 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.66 1.355 . . . . 0.0 114.66 -175.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 24.9 p90 -151.87 160.49 43.52 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.629 1.972 . . . . 0.0 110.801 -176.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -56.13 -28.07 56.5 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 -177.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -68.51 -20.17 73.47 Favored Glycine 0 CA--C 1.54 1.598 0 C-N-CA 124.618 1.104 . . . . 0.0 114.499 177.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 11.1 t -110.55 -39.53 4.88 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.925 1.29 . . . . 0.0 110.948 175.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -87.53 51.63 2.28 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.452 1.501 . . . . 0.0 111.124 175.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 37.4 p -64.4 -24.42 67.63 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.843 1.257 . . . . 0.0 112.403 178.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -172.02 148.12 10.59 Favored Glycine 0 CA--C 1.539 1.588 0 C-N-CA 127.746 2.593 . . . . 0.0 109.78 176.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -60.79 165.71 11.38 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 123.275 2.65 . . . . 0.0 113.624 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 48.3 p -56.81 -24.14 48.74 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -85.23 -2.68 58.31 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 125.452 1.501 . . . . 0.0 114.316 177.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 14.1 t70 -73.55 141.45 79.77 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 124.726 1.21 . . . . 0.0 113.276 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -50.84 -34.78 46.48 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.81 3.006 . . . . 0.0 115.152 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.68 -25.07 66.38 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.1 0.96 . . . . 0.0 112.994 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 54.0 mttp -90.11 -38.92 13.2 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.891 1.276 . . . . 0.0 110.958 173.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -54.56 -46.05 73.59 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.22 0.918 . . . . 0.0 111.876 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -62.3 -30.16 70.95 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 177.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.49 -38.82 71.15 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.658 0.783 . . . . 0.0 110.649 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.6 mt -64.32 -53.14 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -53.17 -51.98 60.28 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.399 1.08 . . . . 0.0 111.461 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.53 -34.51 78.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -179.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -71.0 -49.62 43.19 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.815 0.734 . . . . 0.0 110.136 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.5 tt -58.0 -44.8 87.43 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.116 1.366 . . . . 0.0 111.178 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 88.5 t -59.57 -32.94 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 119.457 1.026 . . . . 0.0 111.662 176.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 4.4 tp -74.41 -24.45 59.1 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.847 1.203 . . . . 0.0 113.086 175.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.2 mp -62.77 -31.14 72.05 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 120.546 1.521 . . . . 0.0 109.08 171.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 5.6 mt -70.02 -53.19 18.73 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.123 0.969 . . . . 0.0 109.476 175.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.4 t60 -54.82 -56.04 23.68 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.09 0.556 . . . . 0.0 110.717 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.28 -27.23 54.63 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -86.78 -26.38 24.15 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.467 1.03 . . . . 0.0 113.392 176.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 43.9 mttm -89.94 -36.3 15.08 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.186 1.794 . . . . 0.0 112.683 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.3 t -61.68 -47.96 82.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.957 2.103 . . . . 0.0 111.273 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -56.37 -23.58 38.69 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 177.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -69.59 -28.65 66.13 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.45 1.1 . . . . 0.0 112.503 176.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -36.72 84.79 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.972 0.805 . . . . 0.0 112.291 -178.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -85.42 -37.57 19.66 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.253 1.021 . . . . 0.0 111.24 177.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 15.6 tp60 -64.35 -33.41 75.78 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.298 -0.876 . . . . 0.0 112.076 178.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -88.54 -16.2 33.22 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.878 1.271 . . . . 0.0 114.263 178.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 62.6 t-20 -147.04 113.5 5.96 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.296 1.038 . . . . 0.0 112.458 -177.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . -74.45 -7.72 79.12 Favored Glycine 0 CA--C 1.538 1.52 0 N-CA-C 115.844 1.098 . . . . 0.0 115.844 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -89.54 -0.6 57.62 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 119.176 1.488 . . . . 0.0 113.365 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 24.7 m -131.33 166.44 28.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 126.519 1.928 . . . . 0.0 111.561 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -129.13 153.48 47.64 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.328 1.451 . . . . 0.0 112.24 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -78.14 172.19 13.91 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.798 1.239 . . . . 0.0 112.569 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 10.4 m -52.65 147.16 8.99 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 -178.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 69.1 p -97.55 -7.72 30.67 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.803 2.041 . . . . 0.0 111.428 170.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 30.7 tp -57.73 113.87 7.25 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 128.276 2.63 . . . . 0.0 109.664 177.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -52.21 -40.4 69.5 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.233 2.622 . . . . 0.0 115.245 -176.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 55.4 m80 -70.33 -34.02 72.18 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.7 t -69.18 -50.72 45.03 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.763 1.225 . . . . 0.0 108.967 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 19.0 tpp85 -55.9 -36.15 67.34 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.412 1.485 . . . . 0.0 111.733 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 8.2 m -69.46 -57.59 5.05 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.145 1.378 . . . . 0.0 111.171 176.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.6 mmt -64.33 -35.48 80.99 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -177.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -63.94 -32.35 73.86 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 120.889 1.677 . . . . 0.0 112.359 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -72.32 -42.39 65.47 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.372 0.669 . . . . 0.0 110.46 174.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 76.8 t -60.51 -47.78 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 123.221 0.608 . . . . 0.0 110.797 176.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.18 -45.16 94.08 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.557 1.143 . . . . 0.0 112.377 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 24.4 m-80 -63.31 -33.59 75.85 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 177.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 66.9 t60 -75.24 -49.42 19.38 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.221 0.609 . . . . 0.0 110.827 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.7 ttp -57.37 -31.21 65.55 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.93 1.692 . . . . 0.0 114.286 -176.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 13.1 t -77.85 -14.41 59.57 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.974 1.261 . . . . 0.0 112.535 176.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 84.3 t60 -99.86 -29.39 12.62 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.771 1.628 . . . . 0.0 111.774 175.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 19.0 t -60.78 152.38 27.14 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.548 1.939 . . . . 0.0 112.513 179.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -127.44 -10.46 5.72 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.381 1.472 . . . . 0.0 114.024 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -92.28 -25.23 18.69 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.071 0.948 . . . . 0.0 112.593 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 55.15 -115.64 5.91 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.259 0.933 . . . . 0.0 112.582 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 62.7 tttp -60.63 -21.28 62.57 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.356 -1.085 . . . . 0.0 112.998 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.07 -1.66 57.75 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.753 1.221 . . . . 0.0 113.628 177.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.9 t -64.65 141.49 58.75 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.056 0.932 . . . . 0.0 109.83 177.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -80.48 -5.21 56.28 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 90.4 t -89.51 113.69 26.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.64 -40.82 66.14 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -176.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -67.62 -30.46 70.04 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.63 1.172 . . . . 0.0 113.609 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.5 t -74.18 -55.53 5.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.068 1.347 . . . . 0.0 109.257 177.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.34 -25.81 66.1 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 85.1 p -81.72 -49.26 10.66 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.34 0.973 . . . . 0.0 111.852 175.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 50.1 m -60.07 -34.49 73.51 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.462 0.705 . . . . 0.0 112.234 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 48.0 tpt85 -61.1 -29.92 70.04 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.464 -0.772 . . . . 0.0 113.028 177.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -69.95 -33.31 71.94 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.712 0.805 . . . . 0.0 110.974 176.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 16.8 mt -69.03 -43.88 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 124.638 1.175 . . . . 0.0 109.373 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 16.9 mm -62.85 -38.12 81.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 123.993 0.917 . . . . 0.0 110.793 174.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 5.6 t -62.44 -27.38 69.06 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.131 0.972 . . . . 0.0 112.65 177.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.9 t60 -60.81 -55.95 26.99 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.292 0.951 . . . . 0.0 111.011 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 43.7 m95 -61.96 -28.72 69.75 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 92.3 mttt -73.3 -28.0 61.85 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.143 0.977 . . . . 0.0 112.794 178.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -100.09 -38.58 8.49 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.5 t -76.7 134.6 39.18 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.787 1.635 . . . . 0.0 112.835 -176.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.5 p -130.07 -0.51 4.67 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.535 1.534 . . . . 0.0 114.361 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -82.85 153.52 25.12 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.019 1.327 . . . . 0.0 113.255 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 16.2 t60 -86.45 -40.38 15.38 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.831 0.853 . . . . 0.0 111.13 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.3 t0 -91.48 69.91 5.89 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.604 1.561 . . . . 0.0 111.852 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.4 t -121.32 132.59 24.18 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 126.297 1.839 . . . . 0.0 109.22 178.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -59.9 -24.41 76.07 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.596 2.197 . . . . 0.0 114.378 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.6 t -92.2 -50.87 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 119.525 1.057 . . . . 0.0 111.476 175.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 12.9 m -69.92 -38.64 76.3 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.9 tt -54.19 -56.37 26.94 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-O 117.752 -1.118 . . . . 0.0 113.006 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -61.41 -30.1 86.56 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 121.77 1.647 . . . . 0.0 113.327 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 93.5 mt -70.95 -46.22 62.79 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.341 0.973 . . . . 0.0 111.736 177.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -62.89 -31.75 72.86 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.636 0.774 . . . . 0.0 111.019 176.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 18.8 t30 -74.35 -39.84 62.53 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.332 1.453 . . . . 0.0 112.137 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -80.27 -19.45 46.74 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 30.8 t -57.69 137.81 56.09 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.617 1.167 . . . . 0.0 113.7 -178.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 37.9 t70 -82.29 -11.37 58.66 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.573 1.549 . . . . 0.0 113.173 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -69.29 -32.34 71.44 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -178.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 . . . . . 0 N--CA 1.477 0.879 0 C-N-CA 126.122 1.769 . . . . 0.0 111.807 -179.389 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.317 0 N-CA-C 114.54 0.576 . . . . 0.0 114.54 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.2 t -61.23 -18.14 56.82 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.66 1.184 . . . . 0.0 113.707 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 25.5 p-80 -79.92 -11.21 59.82 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.071 1.748 . . . . 0.0 113.898 177.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 20.8 mmt -74.12 153.76 39.43 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.239 1.016 . . . . 0.0 112.547 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -79.7 -15.03 58.31 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 178.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -93.97 136.29 23.89 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 125.454 1.501 . . . . 0.0 111.08 178.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -53.17 131.9 45.3 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.416 2.744 . . . . 0.0 113.571 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -86.15 54.37 3.12 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.017 1.327 . . . . 0.0 111.915 -179.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 33.8 m -66.74 162.05 22.22 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.855 1.662 . . . . 0.0 113.293 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -63.14 143.5 97.61 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 123.914 0.886 . . . . 0.0 112.581 179.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -73.74 -20.36 20.15 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 123.492 2.795 . . . . 0.0 114.014 -179.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 19.9 m -157.16 140.01 15.15 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.469 1.908 . . . . 0.0 110.299 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 28.6 m -138.27 154.82 28.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 126.317 1.847 . . . . 0.0 111.329 179.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -133.36 80.88 56.93 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 124.801 1.24 . . . . 0.0 110.784 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -56.11 -46.07 33.61 Favored 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 123.573 2.849 . . . . 0.0 116.533 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -75.77 155.53 39.43 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 122.151 1.901 . . . . 0.0 112.531 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.06 143.32 52.32 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.768 1.227 . . . . 0.0 112.003 177.206 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 18.3 m -72.48 127.76 33.54 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.732 1.213 . . . . 0.0 110.538 177.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -58.01 -22.42 49.63 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.708 1.744 . . . . 0.0 115.708 -176.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -62.6 -21.85 65.94 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.587 -0.696 . . . . 0.0 112.137 175.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 15.3 m -67.84 -60.15 2.74 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.228 1.011 . . . . 0.0 110.218 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -60.07 -30.47 69.24 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.497 0.719 . . . . 0.0 112.289 174.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 50.6 m -70.16 -32.73 70.84 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.7 t70 -90.18 -29.87 17.97 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.098 0.959 . . . . 0.0 112.857 176.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.3 tt -41.46 -58.31 1.93 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 127.484 2.314 . . . . 0.0 113.497 -178.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 48.4 p-90 -71.77 -9.9 58.98 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -173.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.06 -60.16 1.9 Allowed 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 116.504 2.039 . . . . 0.0 116.504 -179.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 48.2 mt -120.16 19.72 12.17 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -170.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.0 tt -51.86 140.35 29.95 Favored Pre-proline 0 CA--C 1.553 1.069 0 C-N-CA 126.045 1.738 . . . . 0.0 114.487 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -68.94 159.66 53.01 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 124.032 3.154 . . . . 0.0 113.547 -179.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -62.89 -9.77 10.92 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 -177.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 49.9 t30 -128.14 134.7 49.12 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.717 1.607 . . . . 0.0 110.114 178.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -149.46 165.56 31.76 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.196 0.998 . . . . 0.0 112.835 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 28.6 m -122.19 -17.38 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.712 1.605 . . . . 0.0 114.248 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 47.2 tp -74.55 -8.78 57.45 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.019 1.328 . . . . 0.0 113.407 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 12.7 m -48.32 107.47 0.76 Allowed Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 128.021 2.528 . . . . 0.0 114.578 -178.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.52 124.98 15.71 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 123.555 2.837 . . . . 0.0 111.505 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 25.9 tp -73.1 127.9 88.6 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 124.936 1.295 . . . . 0.0 112.571 -176.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -54.36 -34.92 82.58 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 123.591 2.861 . . . . 0.0 114.425 178.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 14.8 m -66.05 -13.23 59.62 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.819 1.248 . . . . 0.0 113.818 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -126.63 21.76 7.03 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.756 2.022 . . . . 0.0 111.581 179.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -66.74 159.83 27.06 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -178.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -111.61 30.37 7.02 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.599 2.36 . . . . 0.0 112.371 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 37.8 t70 -58.81 -22.53 58.7 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.641 1.176 . . . . 0.0 114.013 -178.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.28 -20.09 63.93 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.221 1.008 . . . . 0.0 112.797 175.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 94.6 mt -106.39 -0.77 23.94 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.804 1.642 . . . . 0.0 113.426 178.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 68.4 mmm -65.94 149.73 49.76 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.685 1.13 . . . . 0.0 113.502 -178.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.87 175.72 7.1 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.975 1.71 . . . . 0.0 111.436 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 74.5 p -78.72 151.16 76.68 Favored Pre-proline 0 CA--C 1.544 0.729 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 169.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.58 -12.23 27.2 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.188 2.592 . . . . 0.0 115.136 -179.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -95.55 -18.97 20.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.29 1.036 . . . . 0.0 112.974 177.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.68 -9.97 59.59 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.074 -1.016 . . . . 0.0 112.404 177.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 77.3 mt -54.81 -31.86 25.12 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 125.979 1.712 . . . . 0.0 110.8 175.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -66.09 -10.08 37.13 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.487 1.515 . . . . 0.0 113.544 177.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.1 tm0? -76.75 -33.85 58.09 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.001 -1.062 . . . . 0.0 111.488 177.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -98.69 -36.03 9.98 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 117.918 -1.039 . . . . 0.0 113.124 178.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -100.38 109.77 21.96 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 105.074 -2.195 . . . . 0.0 105.074 169.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.74 138.08 33.01 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -172.27 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -120.03 169.25 10.37 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.05 1.74 . . . . 0.0 110.792 176.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 13.9 t70 -63.58 130.38 94.31 Favored Pre-proline 0 CA--C 1.555 1.149 0 O-C-N 120.989 -1.069 . . . . 0.0 111.543 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -77.44 -5.54 15.66 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.707 2.938 . . . . 0.0 115.373 -176.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 87.69 -150.07 22.16 Favored Glycine 0 CA--C 1.542 1.746 0 C-N-CA 124.801 1.191 . . . . 0.0 113.458 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -75.89 -0.09 9.85 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 124.454 3.436 . . . . 0.0 115.149 -177.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 26.4 t70 -132.36 152.77 51.29 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.552 1.541 . . . . 0.0 112.016 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -76.11 54.04 3.07 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 125.543 1.544 . . . . 0.0 114.255 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 51.0 m -61.32 -28.26 69.08 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.664 1.185 . . . . 0.0 113.082 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 81.3 m -123.46 148.27 46.35 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.816 2.047 . . . . 0.0 110.436 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 7.2 p90 -153.92 174.06 15.12 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.633 1.573 . . . . 0.0 111.447 -177.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 50.9 p-10 -53.32 -28.76 30.11 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.953 1.464 . . . . 0.0 114.953 -178.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -73.43 -24.11 75.74 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 124.956 1.265 . . . . 0.0 114.276 177.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 40.7 p -104.03 -31.55 9.64 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.107 1.363 . . . . 0.0 112.285 177.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -121.77 88.54 2.95 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 127.137 2.175 . . . . 0.0 109.705 178.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 23.6 p -69.16 -69.49 0.33 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.392 1.477 . . . . 0.0 114.482 -176.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 175.84 92.38 0.08 OUTLIER Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.585 1.088 . . . . 0.0 112.429 -178.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.96 -24.97 50.93 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 124.108 3.205 . . . . 0.0 115.91 -176.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 36.3 p -80.89 -13.1 59.23 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.298 1.439 . . . . 0.0 114.481 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -137.26 -24.49 1.08 Allowed 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 -177.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.09 116.93 41.03 Favored Pre-proline 0 CA--C 1.551 1.01 0 CA-C-N 119.55 1.068 . . . . 0.0 111.12 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -62.02 -38.55 56.55 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 122.894 2.396 . . . . 0.0 114.094 -177.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -66.77 -45.4 78.62 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.66 -0.65 . . . . 0.0 110.602 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 81.7 mttt -56.59 -49.55 74.56 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.062 0.846 . . . . 0.0 110.425 175.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -57.16 -45.6 83.49 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.543 0.737 . . . . 0.0 111.889 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -60.02 -41.8 92.97 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 118.842 0.746 . . . . 0.0 111.725 175.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.17 -40.05 90.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.746 0.819 . . . . 0.0 112.152 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.5 mt -64.0 -52.03 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 119.504 1.047 . . . . 0.0 109.714 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -53.51 -56.95 12.67 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.217 1.007 . . . . 0.0 111.171 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.87 -36.56 84.75 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -69.53 -42.99 73.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.724 1.147 . . . . 0.0 110.656 178.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 8.2 tp -61.51 -40.09 93.36 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.545 0.738 . . . . 0.0 110.395 176.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 95.8 t -60.52 -32.43 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 119.204 0.911 . . . . 0.0 110.929 174.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.8 tp -72.72 -27.58 62.14 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 120.055 1.298 . . . . 0.0 113.306 174.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -61.88 -33.73 74.73 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 120.412 1.46 . . . . 0.0 108.815 173.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.3 mt -68.89 -51.12 43.5 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.174 0.99 . . . . 0.0 110.046 175.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 19.6 t60 -56.79 -55.85 29.09 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.392 177.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -50.8 -45.8 59.47 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -70.19 -35.3 73.84 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 43.9 mttm -77.73 -38.45 47.09 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.22 1.008 . . . . 0.0 111.745 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 49.6 t -60.8 -46.65 89.7 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.47 2.308 . . . . 0.0 109.587 175.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -54.14 -53.74 49.16 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.974 1.71 . . . . 0.0 111.062 173.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -66.11 -38.75 88.98 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 178.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.63 -40.1 82.4 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.241 1.416 . . . . 0.0 111.517 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -72.35 -46.86 53.65 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.068 0.394 . . . . 0.0 109.946 176.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 16.2 tp60 -59.16 -31.99 69.48 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.773 0.829 . . . . 0.0 112.945 179.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -71.01 -14.96 62.52 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.012 1.325 . . . . 0.0 113.913 177.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -116.9 -47.19 2.71 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.264 1.426 . . . . 0.0 113.4 -177.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 73.38 -1.01 45.33 Favored Glycine 0 CA--C 1.542 1.741 0 N-CA-C 117.103 1.601 . . . . 0.0 117.103 178.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -115.8 -42.85 3.05 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.675 1.738 . . . . 0.0 112.925 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 34.2 m -66.55 152.21 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.816 0.846 . . . . 0.0 112.427 178.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? -84.3 146.97 27.46 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.067 0.947 . . . . 0.0 110.981 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -78.87 171.39 15.25 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 123.999 0.92 . . . . 0.0 112.497 178.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 1.3 m -53.42 147.19 11.06 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.229 1.812 . . . . 0.0 114.66 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 47.6 m -86.48 -3.47 59.02 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.899 1.279 . . . . 0.0 111.734 173.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 30.1 tp -71.64 113.05 16.53 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 126.689 1.996 . . . . 0.0 110.385 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -62.98 -29.28 75.53 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 121.711 1.608 . . . . 0.0 111.851 179.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 36.3 m80 -69.24 -42.21 75.96 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 117.747 -1.12 . . . . 0.0 113.941 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . 0.322 0.8 OUTLIER -72.81 -35.15 67.28 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 120.326 1.421 . . . . 0.0 111.207 178.1 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -60.21 -40.85 91.6 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.752 1.221 . . . . 0.0 110.611 171.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.9 m -65.11 -55.37 19.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.688 1.195 . . . . 0.0 110.667 176.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.7 mmt -62.78 -39.2 93.46 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.604 0.965 . . . . 0.0 113.604 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -64.7 -29.61 70.6 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 120.794 1.634 . . . . 0.0 113.133 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -72.67 -39.42 67.11 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.01 0.524 . . . . 0.0 110.483 173.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 90.5 t -63.41 -45.83 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.194 0.598 . . . . 0.0 110.188 175.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.92 -42.86 90.69 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.983 1.313 . . . . 0.0 112.104 178.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -63.01 -32.79 74.23 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.224 0.609 . . . . 0.0 112.385 176.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 65.2 t60 -79.61 -49.31 12.36 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.642 0.777 . . . . 0.0 110.768 176.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 31.3 ttp -56.55 -34.04 66.7 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.717 1.607 . . . . 0.0 113.904 -176.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 10.2 t -73.21 -13.06 61.08 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 120.181 1.355 . . . . 0.0 113.085 176.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 58.9 m80 -107.1 -24.79 11.83 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.478 1.511 . . . . 0.0 112.595 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.4 t -61.59 150.06 37.33 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.538 1.535 . . . . 0.0 112.343 178.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -128.89 -8.86 4.93 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.87 1.668 . . . . 0.0 113.641 -179.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.76 -28.22 21.85 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.242 0.928 . . . . 0.0 111.86 178.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.65 -109.66 1.0 Allowed Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.952 1.263 . . . . 0.0 112.761 178.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -60.23 -22.98 63.68 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.155 0.982 . . . . 0.0 113.247 177.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.87 -1.46 49.36 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.296 1.438 . . . . 0.0 113.846 178.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.9 t -61.0 141.97 56.95 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 122.289 1.042 . . . . 0.0 110.62 178.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.8 mm-40 -78.62 -10.54 59.78 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.721 1.208 . . . . 0.0 113.115 -176.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 64.6 t -90.65 114.85 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 124.874 1.27 . . . . 0.0 107.582 174.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.32 -37.0 66.84 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -64.93 -41.63 95.38 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.445 1.098 . . . . 0.0 112.204 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.5 t -67.04 -56.38 10.31 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.594 1.558 . . . . 0.0 109.994 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.57 -26.94 62.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.28 1.032 . . . . 0.0 113.255 178.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 70.8 m -82.33 -47.27 12.55 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.049 0.94 . . . . 0.0 112.124 175.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 60.2 m -62.17 -34.8 77.11 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 121.56 -0.713 . . . . 0.0 111.873 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -59.07 -31.53 68.97 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.338 1.055 . . . . 0.0 112.503 176.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -67.71 -34.14 76.29 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.873 0.869 . . . . 0.0 111.299 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.4 mt -72.23 -46.04 59.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 124.343 1.057 . . . . 0.0 110.035 177.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 19.2 mm -62.57 -39.69 85.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.142 0.977 . . . . 0.0 111.301 176.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 16.5 t -60.39 -26.16 66.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.085 0.954 . . . . 0.0 112.712 177.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.6 t60 -61.54 -57.28 12.73 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.092 0.86 . . . . 0.0 111.159 177.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 59.5 m95 -62.45 -22.56 66.31 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 178.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -79.66 -29.92 41.03 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.509 1.123 . . . . 0.0 112.614 178.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -99.96 -36.32 9.42 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 179.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.4 t -74.04 139.33 44.64 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.354 1.461 . . . . 0.0 111.289 -178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 74.2 p -130.12 -2.84 4.52 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 -177.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -96.09 141.51 29.38 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.227 1.411 . . . . 0.0 112.647 -177.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -74.34 -34.4 63.41 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 121.728 -0.607 . . . . 0.0 111.819 176.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 36.7 t0 -90.89 79.34 5.93 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.718 1.607 . . . . 0.0 111.038 178.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.4 t -135.13 137.43 26.85 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 127.106 2.162 . . . . 0.0 109.124 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -56.72 -26.54 66.27 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.858 2.372 . . . . 0.0 114.604 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.8 t -92.24 -51.65 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-N 119.783 1.174 . . . . 0.0 111.604 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 6.1 m -69.63 -39.72 76.97 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 -174.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 1.6 tt -56.24 -55.91 37.0 Favored Pre-proline 0 CA--C 1.546 0.823 0 CA-C-O 117.578 -1.201 . . . . 0.0 112.903 -177.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.18 -32.49 94.56 Favored 'Trans proline' 0 C--N 1.354 0.848 0 CA-C-N 121.845 1.695 . . . . 0.0 113.169 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 98.4 mt -69.31 -46.19 67.72 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.001 0.819 . . . . 0.0 111.47 177.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 48.7 mttm -62.63 -41.89 99.28 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.026 0.93 . . . . 0.0 110.472 176.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.0 t30 -63.71 -39.19 93.7 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.274 1.429 . . . . 0.0 112.252 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -77.3 -21.33 53.66 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.325 1.05 . . . . 0.0 113.662 178.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 33.5 p -68.7 146.41 52.99 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -175.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -137.47 12.48 2.99 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 126.026 1.73 . . . . 0.0 113.065 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 57.2 tptt -71.49 -24.72 62.03 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.05 1.74 . . . . 0.0 113.635 -177.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 13.4 mmt85 . . . . . 0 N--CA 1.478 0.955 0 C-N-CA 125.688 1.595 . . . . 0.0 111.309 177.05 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.423 0 N-CA-C 114.132 0.413 . . . . 0.0 114.132 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.2 t -153.01 152.49 31.45 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.337 1.455 . . . . 0.0 111.243 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 22.0 p-80 -58.5 -19.72 39.64 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.282 1.033 . . . . 0.0 113.074 175.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 13.4 tpt -76.67 -18.93 58.27 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.274 1.43 . . . . 0.0 112.89 177.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -124.56 -22.75 4.55 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -74.16 144.27 81.57 Favored Pre-proline 0 CA--C 1.549 0.93 0 O-C-N 121.076 -1.015 . . . . 0.0 112.501 179.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -76.71 -15.44 17.08 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.684 2.923 . . . . 0.0 114.644 -178.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -78.21 92.48 4.47 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.284 1.033 . . . . 0.0 111.56 -178.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 15.0 t -153.04 152.3 31.2 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.825 1.65 . . . . 0.0 111.251 179.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 14.9 t70 -151.29 142.18 15.11 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 125.477 1.511 . . . . 0.0 110.883 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -55.89 -22.81 39.49 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.358 2.705 . . . . 0.0 116.752 -178.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 48.2 m -83.04 0.63 43.98 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -179.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 10.8 p -136.69 155.73 34.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 125.297 1.439 . . . . 0.0 111.48 179.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -134.82 150.28 72.93 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 124.707 1.203 . . . . 0.0 112.533 179.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -59.36 -43.03 43.59 Favored 'Trans proline' 0 CA--C 1.547 1.143 0 C-N-CA 123.472 2.781 . . . . 0.0 117.991 -178.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -79.51 152.17 22.98 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 122.297 1.998 . . . . 0.0 113.734 -177.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 6.9 tt -65.39 143.82 57.48 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.474 1.11 . . . . 0.0 110.944 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 40.9 t -118.58 160.61 21.48 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.314 1.845 . . . . 0.0 109.434 175.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -62.82 -24.67 67.87 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.875 -1.141 . . . . 0.0 111.011 174.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -79.33 -16.84 55.68 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.454 1.102 . . . . 0.0 113.058 176.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 58.2 m -59.23 -60.08 4.44 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 119.368 0.986 . . . . 0.0 110.876 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -60.17 -25.76 65.79 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 175.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 45.3 m -75.05 -31.89 61.4 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.378 -0.826 . . . . 0.0 112.642 177.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -90.06 -25.45 20.78 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.62 1.168 . . . . 0.0 112.902 175.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.9 tt -45.51 -60.01 2.41 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 127.451 2.3 . . . . 0.0 113.87 -178.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.2 p-90 -70.08 -8.36 48.76 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -173.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 10.2 ptmm? -112.15 -56.0 2.45 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 4.2 mp -120.12 16.88 12.44 Favored 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 117.055 2.243 . . . . 0.0 117.055 -176.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.4 137.22 50.8 Favored Pre-proline 0 N--CA 1.48 1.044 0 O-C-N 120.473 -1.392 . . . . 0.0 113.802 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -80.14 162.59 23.01 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 124.104 3.203 . . . . 0.0 113.717 -179.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -67.93 -11.14 58.16 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.007 1.323 . . . . 0.0 113.538 177.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.68 1.95 40.01 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 126.117 1.767 . . . . 0.0 113.683 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -68.81 145.11 54.03 Favored 'General case' 0 CA--C 1.551 0.992 0 O-C-N 120.573 -1.33 . . . . 0.0 112.861 -178.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 34.5 m -127.01 9.3 3.55 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 -177.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.19 -4.75 46.29 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.844 1.258 . . . . 0.0 113.399 -178.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 6.0 m -52.77 113.77 4.94 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 126.598 1.959 . . . . 0.0 114.618 -176.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -75.02 135.4 18.98 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.483 2.122 . . . . 0.0 109.515 176.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 85.5 mt -73.56 135.98 78.16 Favored Pre-proline 0 CA--C 1.545 0.757 0 CA-C-O 118.415 -0.802 . . . . 0.0 112.469 -177.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -54.44 -30.81 65.71 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.666 2.91 . . . . 0.0 114.639 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 46.9 p -69.73 -15.77 63.21 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.178 1.391 . . . . 0.0 113.932 177.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -127.52 15.1 7.1 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.677 1.991 . . . . 0.0 112.096 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.54 159.44 33.92 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -176.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.75 16.8 5.31 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 128.26 2.624 . . . . 0.0 114.119 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -66.92 -14.63 63.0 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.949 1.3 . . . . 0.0 114.482 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 37.2 t70 -69.58 -16.13 63.35 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 121.217 -0.927 . . . . 0.0 112.097 175.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 28.3 tp -110.88 16.16 21.43 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 127.569 2.348 . . . . 0.0 111.881 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.4 tpt -62.75 145.52 54.64 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -175.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.89 149.29 47.71 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 128.251 2.621 . . . . 0.0 109.682 177.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 24.2 m -71.51 134.41 84.4 Favored Pre-proline 0 N--CA 1.474 0.737 0 CA-C-O 118.327 -0.844 . . . . 0.0 110.966 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -55.39 -28.8 65.19 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.002 2.468 . . . . 0.0 116.085 -176.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -70.72 -15.25 62.68 Favored 'General case' 0 CA--C 1.55 0.954 0 O-C-N 120.912 -1.118 . . . . 0.0 113.196 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.1 t70 -89.76 -9.83 47.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.243 1.817 . . . . 0.0 113.13 178.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 72.7 mt -52.56 -34.35 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 125.045 1.338 . . . . 0.0 111.33 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -67.44 -9.73 44.64 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.562 1.145 . . . . 0.0 113.697 177.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -75.65 -20.2 58.64 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 120.928 -1.108 . . . . 0.0 111.109 175.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -86.19 -49.98 7.32 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.022 0.828 . . . . 0.0 109.876 178.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -115.4 109.92 18.58 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.556 1.942 . . . . 0.0 106.782 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 1.6 m -123.56 138.17 54.61 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -173.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -72.96 171.36 12.95 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.979 1.312 . . . . 0.0 112.286 176.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 11.1 t70 -60.18 122.91 70.1 Favored Pre-proline 0 CA--C 1.555 1.173 0 O-C-N 121.292 -0.88 . . . . 0.0 111.538 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -82.47 -3.58 11.42 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 123.938 3.092 . . . . 0.0 115.333 -176.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 92.78 -148.65 19.16 Favored Glycine 0 CA--C 1.543 1.826 0 C-N-CA 124.703 1.144 . . . . 0.0 112.85 -177.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -60.2 -21.95 68.35 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 124.485 3.456 . . . . 0.0 116.302 -177.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 24.7 t70 -140.05 137.46 34.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.035 1.334 . . . . 0.0 112.169 -177.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 170.68 55.21 0.04 OUTLIER Glycine 0 CA--C 1.534 1.239 0 C-N-CA 124.316 0.96 . . . . 0.0 112.921 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 20.0 m -67.56 -7.08 23.25 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.664 1.727 . . . . 0.0 115.664 -176.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 59.8 m -50.95 -31.97 19.44 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.026 1.73 . . . . 0.0 113.95 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -55.97 -31.8 63.32 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.825 0.85 . . . . 0.0 113.187 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 26.4 t30 -70.73 -26.23 63.29 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 121.26 -0.9 . . . . 0.0 112.406 177.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -86.44 -37.52 8.83 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 124.906 1.241 . . . . 0.0 112.807 176.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 71.5 p -78.13 -32.25 50.31 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.084 0.954 . . . . 0.0 112.814 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -93.67 76.14 4.33 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.032 1.333 . . . . 0.0 109.587 175.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 43.4 p -64.86 -16.38 63.1 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 125.848 1.659 . . . . 0.0 114.766 -177.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -177.33 -71.04 0.06 OUTLIER Glycine 0 CA--C 1.533 1.203 0 C-N-CA 127.611 2.529 . . . . 0.0 108.217 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -70.59 170.45 17.54 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.383 2.722 . . . . 0.0 110.528 172.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 9.5 m -56.32 -31.96 64.19 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.458 1.103 . . . . 0.0 112.714 179.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -144.67 129.9 18.67 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.139 1.776 . . . . 0.0 109.711 175.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 15.8 t70 -61.12 146.31 88.36 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 125.104 1.362 . . . . 0.0 112.147 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -51.69 -34.27 52.91 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.009 2.473 . . . . 0.0 114.715 178.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -66.61 -22.22 66.12 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.579 1.152 . . . . 0.0 112.494 177.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -89.73 -42.35 11.37 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.59 1.556 . . . . 0.0 110.215 174.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 77.9 mtm-85 -60.68 -39.27 87.82 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.868 0.867 . . . . 0.0 112.619 179.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -63.58 -27.87 69.54 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 86.3 mt -70.26 -37.71 74.96 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.176 0.59 . . . . 0.0 110.593 175.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.5 mt -62.1 -51.81 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 175.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -54.57 -54.01 46.98 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.966 0.906 . . . . 0.0 111.016 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -36.17 83.12 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.164 0.893 . . . . 0.0 113.352 -178.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -71.74 -44.15 64.59 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.888 0.767 . . . . 0.0 110.96 179.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 12.3 tp -63.76 -38.35 90.79 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.569 0.747 . . . . 0.0 110.784 177.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 87.8 t -61.87 -32.27 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 CA-C-N 119.735 1.152 . . . . 0.0 110.619 174.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 15.6 tp -69.53 -34.98 75.02 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 120.762 -1.211 . . . . 0.0 111.608 174.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.4 mp -59.14 -26.14 64.48 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 120.11 1.323 . . . . 0.0 110.271 174.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 4.0 mt -77.5 -53.25 7.84 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.289 -0.882 . . . . 0.0 109.933 176.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.6 t60 -54.93 -52.93 61.42 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.13 0.572 . . . . 0.0 110.226 177.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -58.19 -22.78 53.04 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.79 1.236 . . . . 0.0 113.968 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -90.07 -29.42 18.37 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.157 -0.964 . . . . 0.0 113.417 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 31.9 mttp -86.07 -34.67 20.62 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.682 1.193 . . . . 0.0 112.623 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 20.2 t -63.92 -44.83 91.72 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.277 1.831 . . . . 0.0 110.946 177.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -60.88 -33.47 73.14 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 120.797 -1.19 . . . . 0.0 111.819 174.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -69.26 -34.76 75.27 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.184 0.993 . . . . 0.0 111.067 174.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.53 -37.37 80.97 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.879 1.271 . . . . 0.0 110.871 174.433 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -75.49 -44.87 41.7 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 122.992 0.517 . . . . 0.0 110.506 175.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -55.68 -36.86 67.58 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.826 1.25 . . . . 0.0 112.417 178.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -70.54 -10.01 58.16 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.016 1.326 . . . . 0.0 114.352 178.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -119.02 -48.98 2.43 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.358 1.463 . . . . 0.0 112.94 -179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 74.44 0.91 59.57 Favored Glycine 0 CA--C 1.541 1.694 0 N-CA-C 117.192 1.637 . . . . 0.0 117.192 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -122.08 -29.65 4.19 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 119.89 1.845 . . . . 0.0 114.617 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 33.4 m -78.17 160.68 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.642 1.177 . . . . 0.0 113.984 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -76.6 165.24 25.05 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.147 1.379 . . . . 0.0 111.705 177.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -75.96 177.53 6.96 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.047 0.939 . . . . 0.0 113.415 179.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 3.5 t -59.66 146.8 39.82 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.431 1.892 . . . . 0.0 113.785 -179.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 50.3 m -80.87 -11.46 59.58 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.732 1.213 . . . . 0.0 113.278 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 58.8 tp -83.6 115.18 58.22 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 125.932 1.693 . . . . 0.0 110.512 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -58.12 -35.47 98.71 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.533 2.155 . . . . 0.0 113.828 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 7.6 m170 -65.48 -37.46 86.91 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.589 0.755 . . . . 0.0 112.533 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 33.6 t -62.44 -49.07 76.91 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.024 1.329 . . . . 0.0 109.716 177.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -55.41 -36.99 67.06 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.933 1.293 . . . . 0.0 111.813 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.6 m -70.67 -56.52 6.26 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.887 0.875 . . . . 0.0 111.772 176.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 14.6 mmt -65.07 -32.71 74.56 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -65.51 -32.21 73.69 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 120.753 1.615 . . . . 0.0 112.303 178.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -72.47 -38.55 68.18 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.534 0.734 . . . . 0.0 110.449 174.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 77.0 t -62.22 -47.24 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.277 0.631 . . . . 0.0 110.327 175.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.57 -45.11 95.15 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.878 0.871 . . . . 0.0 111.708 178.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -67.83 -21.22 65.21 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.2 t60 -83.86 -49.39 9.07 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 118.803 0.729 . . . . 0.0 109.339 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.0 ttp -57.55 -27.92 63.07 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.189 1.796 . . . . 0.0 113.778 -177.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 17.2 p -70.75 -30.35 66.83 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 119.507 1.049 . . . . 0.0 112.244 174.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 84.1 t60 -92.39 -27.08 17.73 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.831 1.652 . . . . 0.0 112.835 178.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 14.2 t -63.13 153.02 35.63 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.853 1.661 . . . . 0.0 112.776 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -133.15 -7.24 3.02 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.555 1.542 . . . . 0.0 114.23 -179.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -90.55 -22.85 21.09 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.385 0.993 . . . . 0.0 113.012 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.3 -116.61 5.91 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.448 1.023 . . . . 0.0 112.354 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 58.1 tptt -56.4 -24.3 43.91 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.774 1.23 . . . . 0.0 113.211 176.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.48 -1.86 57.41 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.576 1.151 . . . . 0.0 114.043 178.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 20.0 t -62.66 141.88 58.33 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.112 0.958 . . . . 0.0 110.586 178.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.7 mm-40 -78.09 -9.4 59.13 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.592 1.157 . . . . 0.0 113.163 -176.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 99.3 t -91.87 114.56 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 173.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.85 -42.99 72.68 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -64.42 -37.88 89.09 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.866 0.866 . . . . 0.0 112.945 -178.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 29.7 t -65.86 -59.59 3.71 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.508 1.523 . . . . 0.0 110.378 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.13 -30.86 64.77 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.874 0.87 . . . . 0.0 112.58 178.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.3 m -75.52 -50.63 15.08 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.757 0.823 . . . . 0.0 112.486 176.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 63.6 m -60.04 -36.39 77.18 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.663 -0.648 . . . . 0.0 111.801 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 48.2 tpt85 -59.81 -29.54 68.31 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.849 0.86 . . . . 0.0 113.047 177.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -70.29 -30.06 66.97 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.72 0.808 . . . . 0.0 111.245 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 6.6 mt -73.45 -44.63 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.168 0.987 . . . . 0.0 109.221 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 24.0 mm -58.71 -39.18 75.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 123.86 0.864 . . . . 0.0 109.887 174.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 4.1 t -60.72 -28.56 68.76 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.037 0.935 . . . . 0.0 113.054 176.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.1 t60 -61.76 -55.25 32.15 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.404 1.002 . . . . 0.0 110.44 177.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 44.2 m95 -61.69 -30.65 70.88 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 178.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -70.29 -27.95 64.81 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.703 0.801 . . . . 0.0 112.703 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -100.05 -38.98 8.34 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 179.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.8 t -75.62 137.66 40.9 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.796 1.638 . . . . 0.0 112.862 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 68.2 p -129.97 4.11 4.89 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.692 1.597 . . . . 0.0 114.045 -178.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 69.8 mtm180 -82.1 158.5 23.69 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.126 1.37 . . . . 0.0 113.551 -178.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 23.9 t60 -95.88 -40.22 9.42 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.34 1.056 . . . . 0.0 109.84 170.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.6 t0 -92.79 69.99 4.73 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.7 1.6 . . . . 0.0 111.655 178.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 52.7 t -123.27 133.65 24.67 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 126.653 1.981 . . . . 0.0 108.412 177.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -59.01 -25.61 78.44 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.709 2.273 . . . . 0.0 114.425 -176.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 6.3 t -92.13 -50.29 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 119.519 1.054 . . . . 0.0 111.649 176.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.4 m -68.86 -41.32 78.58 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -175.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.9 tt -50.75 -57.18 14.31 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.472 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -61.3 -31.77 89.42 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.021 1.814 . . . . 0.0 113.591 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 89.7 mt -70.87 -46.44 62.63 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.76 0.824 . . . . 0.0 111.676 178.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -62.26 -36.74 82.97 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.155 0.982 . . . . 0.0 110.397 176.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 13.9 t30 -69.92 -38.32 76.19 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.29 1.436 . . . . 0.0 112.448 175.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -77.29 -25.65 51.57 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.777 1.028 . . . . 0.0 113.777 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 32.1 t -63.37 150.75 42.71 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.352 1.061 . . . . 0.0 113.302 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -91.68 -5.96 52.88 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.341 1.457 . . . . 0.0 113.246 178.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -80.91 85.13 6.26 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.056 1.343 . . . . 0.0 111.139 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 25.4 mmt85 . . . . . 0 N--CA 1.479 1.015 0 C-N-CA 126.297 1.839 . . . . 0.0 112.33 -178.613 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.436 0 CA-C-O 121.38 0.433 . . . . 0.0 113.786 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.9 p -65.08 139.53 58.73 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.902 1.281 . . . . 0.0 113.976 -177.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -84.26 162.32 20.17 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.422 1.489 . . . . 0.0 111.606 -179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 62.7 ttp -80.97 90.4 5.95 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.972 0.909 . . . . 0.0 111.643 -179.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.18 -15.08 36.96 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -135.31 142.35 41.21 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 125.059 1.344 . . . . 0.0 111.885 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -82.5 -7.99 11.59 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 123.846 3.031 . . . . 0.0 114.086 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -72.48 142.99 48.57 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.639 1.175 . . . . 0.0 113.266 -177.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 66.1 m -142.21 149.62 39.9 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.176 1.79 . . . . 0.0 111.133 178.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 14.4 t70 -100.91 127.25 32.66 Favored Pre-proline 0 CA--C 1.553 1.079 0 C-N-CA 124.432 1.093 . . . . 0.0 111.066 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -79.84 -13.31 13.08 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.525 2.817 . . . . 0.0 115.032 -177.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 19.9 m -90.12 6.89 40.59 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.425 1.49 . . . . 0.0 114.727 -177.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 8.1 p -137.53 146.13 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.869 1.268 . . . . 0.0 112.004 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -146.01 81.81 9.57 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 125.483 1.513 . . . . 0.0 110.668 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -102.1 83.88 0.03 OUTLIER 'Trans proline' 0 CA--C 1.555 1.526 0 C-N-CA 125.301 4.0 . . . . 0.0 114.092 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -75.93 162.74 34.34 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.192 2.595 . . . . 0.0 111.893 177.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 38.5 tp -79.57 144.26 34.04 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.834 0.854 . . . . 0.0 111.49 176.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 40.3 t -129.06 155.02 46.08 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.429 1.492 . . . . 0.0 110.872 177.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -58.77 -27.87 65.39 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.913 0.885 . . . . 0.0 111.097 174.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -83.07 -14.69 53.27 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 124.651 1.18 . . . . 0.0 113.71 178.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 61.4 m -58.68 -59.36 5.53 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.468 1.031 . . . . 0.0 111.433 -179.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -60.03 -21.94 62.0 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.504 0.928 . . . . 0.0 113.504 178.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 21.3 t -79.0 -33.65 44.77 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.32 1.048 . . . . 0.0 112.646 178.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 36.4 t70 -89.77 -26.5 20.57 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.838 0.855 . . . . 0.0 112.104 175.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.7 tt -45.82 -60.06 2.45 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 127.176 2.191 . . . . 0.0 113.367 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.2 p-90 -68.91 -8.96 49.07 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -172.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -111.89 -58.51 2.12 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 -178.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 58.0 mt -120.05 16.29 12.46 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -171.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.6 tt -54.76 136.49 64.56 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 124.915 1.286 . . . . 0.0 113.046 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -78.19 151.69 26.91 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 124.216 3.278 . . . . 0.0 114.297 -177.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -60.57 -16.02 33.62 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.38 1.472 . . . . 0.0 114.959 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 64.2 t30 -81.44 -1.29 45.21 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.848 1.259 . . . . 0.0 113.805 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -65.71 143.87 57.26 Favored 'General case' 0 CA--C 1.549 0.941 0 O-C-N 120.85 -1.156 . . . . 0.0 112.665 -179.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 7.6 p -134.57 21.07 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 125.087 1.355 . . . . 0.0 113.388 -178.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 7.8 tt -79.6 -12.81 59.82 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 120.633 -1.292 . . . . 0.0 113.791 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 6.0 t -62.4 126.06 87.2 Favored Pre-proline 0 N--CA 1.473 0.688 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -175.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.29 131.77 18.3 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 122.537 2.158 . . . . 0.0 109.962 175.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 81.0 mt -76.8 156.24 82.73 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 123.983 0.913 . . . . 0.0 111.654 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -52.25 -34.27 58.79 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.542 2.828 . . . . 0.0 114.961 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 18.3 m -70.13 -10.92 60.33 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.892 1.277 . . . . 0.0 114.276 178.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -131.71 16.95 4.78 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 127.139 2.175 . . . . 0.0 112.25 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -80.3 163.28 24.06 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.19 1.396 . . . . 0.0 114.229 -178.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -107.83 23.28 14.71 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.222 2.609 . . . . 0.0 113.605 -178.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -66.4 -14.55 62.3 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.04 1.336 . . . . 0.0 113.987 -178.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -64.11 -17.57 63.57 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 120.857 -1.152 . . . . 0.0 113.322 176.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 83.8 mt -108.2 13.46 25.79 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 126.976 2.11 . . . . 0.0 113.537 178.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.24 151.61 46.64 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -175.154 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 95.9 mt -125.19 170.28 11.4 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.778 2.831 . . . . 0.0 113.504 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.7 m -90.8 150.43 42.14 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 169.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -53.72 -25.1 32.75 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.069 2.512 . . . . 0.0 115.651 -178.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.8 t70 -69.87 -24.08 63.37 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.891 0.876 . . . . 0.0 112.889 178.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -76.17 -18.04 59.28 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.86 0.864 . . . . 0.0 112.361 178.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 93.3 mt -59.5 -34.02 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.59 0.756 . . . . 0.0 109.322 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -71.18 -9.87 58.8 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -84.15 -29.77 26.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.93 0.892 . . . . 0.0 111.521 176.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -96.58 -28.4 14.38 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 176.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -124.3 109.85 13.87 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 170.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 1.4 t -125.07 159.4 31.47 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 -177.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -97.83 177.11 5.56 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.151 1.78 . . . . 0.0 112.483 178.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 12.5 t70 -63.54 128.19 92.32 Favored Pre-proline 0 CA--C 1.555 1.169 0 O-C-N 120.973 -1.079 . . . . 0.0 110.786 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -78.38 -9.11 16.29 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.75 2.966 . . . . 0.0 115.029 -175.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 97.59 -155.68 20.55 Favored Glycine 0 CA--C 1.543 1.799 0 C-N-CA 125.418 1.485 . . . . 0.0 112.947 -177.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -62.31 -16.61 52.38 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 124.449 3.433 . . . . 0.0 115.704 -178.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 24.5 t0 -140.09 161.41 37.69 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.506 1.922 . . . . 0.0 111.218 -178.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 88.55 17.44 56.9 Favored Glycine 0 CA--C 1.536 1.377 0 N-CA-C 115.202 0.841 . . . . 0.0 115.202 179.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 53.3 p -72.99 -0.73 14.6 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.566 1.546 . . . . 0.0 114.8 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 79.7 m -75.8 58.63 1.14 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.818 2.047 . . . . 0.0 111.227 177.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -53.83 -36.24 62.31 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 -175.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -63.98 -19.54 65.23 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 119.53 1.059 . . . . 0.0 113.248 177.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -80.55 -10.0 85.77 Favored Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.82 1.2 . . . . 0.0 113.962 175.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 11.7 t -126.07 -23.57 3.89 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.443 1.497 . . . . 0.0 113.571 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -126.56 130.42 50.51 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.595 1.958 . . . . 0.0 112.567 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 1.7 m -76.26 -16.71 59.75 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.565 1.146 . . . . 0.0 112.588 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 94.0 109.61 2.1 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 126.357 1.932 . . . . 0.0 111.216 -178.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -63.44 -22.4 71.31 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 122.86 2.373 . . . . 0.0 114.134 -177.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 11.2 t -85.07 -18.09 35.4 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 121.218 -0.926 . . . . 0.0 112.529 176.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -100.67 -29.49 12.27 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.332 1.453 . . . . 0.0 114.074 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 12.8 t70 -104.83 110.78 64.91 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 125.309 1.444 . . . . 0.0 111.78 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -60.3 -33.95 94.07 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 123.424 2.75 . . . . 0.0 114.989 -178.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -73.36 -31.13 63.77 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 121.233 -0.917 . . . . 0.0 112.735 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 80.6 tttt -64.94 -30.92 71.94 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.499 0.72 . . . . 0.0 111.581 177.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 70.2 mtp180 -62.38 -41.49 98.68 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.779 0.832 . . . . 0.0 111.122 174.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -59.59 -33.04 70.96 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.065 0.946 . . . . 0.0 112.103 179.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 83.6 mt -65.67 -40.56 92.52 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.963 0.801 . . . . 0.0 112.018 178.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.1 mt -68.35 -51.19 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-N 118.342 0.519 . . . . 0.0 109.677 176.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -55.13 -54.41 43.58 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.576 1.15 . . . . 0.0 110.889 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -34.99 79.49 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.148 -0.97 . . . . 0.0 113.168 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -68.67 -48.99 62.54 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.092 0.86 . . . . 0.0 109.655 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 16.8 tp -59.82 -43.93 94.28 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.425 0.69 . . . . 0.0 111.413 177.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 61.0 t -61.43 -24.98 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 O-C-N 120.64 -1.288 . . . . 0.0 111.331 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 3.7 tp -79.81 -26.09 40.64 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.289 1.404 . . . . 0.0 112.408 172.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.5 mp -60.84 -45.27 95.15 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 120.596 1.544 . . . . 0.0 107.367 170.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.2 mp -61.41 -50.59 72.22 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.307 1.043 . . . . 0.0 111.102 175.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 31.0 t60 -55.61 -57.3 12.54 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.424 1.011 . . . . 0.0 110.285 177.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.59 -30.93 63.76 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.549 1.14 . . . . 0.0 114.032 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 43.1 t60 -75.48 -38.63 59.44 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.522 -0.736 . . . . 0.0 112.04 176.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 42.7 mttm -79.81 -33.62 40.26 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.521 1.128 . . . . 0.0 111.853 -179.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 13.6 t -63.26 -44.77 94.21 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 127.406 2.283 . . . . 0.0 111.677 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -64.74 -38.18 90.12 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 120.726 -1.234 . . . . 0.0 111.727 174.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -65.15 -41.48 94.7 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.671 1.189 . . . . 0.0 111.047 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -40.49 71.31 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.935 1.694 . . . . 0.0 111.678 176.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -76.3 -47.15 24.66 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.123 0.569 . . . . 0.0 111.801 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -59.12 -28.01 66.14 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.746 0.819 . . . . 0.0 112.922 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -66.39 -13.34 60.53 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.183 1.393 . . . . 0.0 114.657 177.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -137.92 -44.69 0.52 Allowed 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.109 1.151 . . . . 0.0 114.109 -177.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 84.44 -15.06 42.7 Favored Glycine 0 CA--C 1.54 1.654 0 C-N-CA 125.665 1.603 . . . . 0.0 116.351 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -114.13 -11.94 12.61 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 119.559 1.68 . . . . 0.0 114.107 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 30.7 m -68.56 156.65 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.315 1.046 . . . . 0.0 112.51 178.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.48 150.22 46.39 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.437 0.695 . . . . 0.0 112.252 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -97.43 169.06 10.0 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.106 1.362 . . . . 0.0 113.696 -179.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -72.21 161.08 31.36 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.658 1.583 . . . . 0.0 113.214 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 50.1 m -115.0 -3.63 12.62 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.343 1.457 . . . . 0.0 114.458 -179.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 36.7 mt -80.62 131.64 60.48 Favored Pre-proline 0 CA--C 1.545 0.779 0 CA-C-N 119.065 0.848 . . . . 0.0 112.988 -179.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.22 -33.06 19.49 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 122.763 2.309 . . . . 0.0 111.289 176.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 35.3 m80 -70.98 -32.32 69.13 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.493 1.117 . . . . 0.0 112.065 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 53.2 t -68.17 -51.03 50.35 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.813 1.245 . . . . 0.0 108.858 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 43.2 ttp-105 -54.42 -39.65 67.53 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.11 1.364 . . . . 0.0 111.283 173.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.2 m -65.43 -56.57 11.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.523 1.129 . . . . 0.0 111.394 176.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 19.9 mmt -66.45 -34.54 78.17 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -177.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -65.44 -32.25 73.77 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 120.88 1.673 . . . . 0.0 112.286 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -70.62 -39.71 73.56 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.034 0.534 . . . . 0.0 110.491 174.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 71.5 t -63.77 -46.9 93.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.261 0.625 . . . . 0.0 111.025 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.5 -43.38 93.37 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.647 0.779 . . . . 0.0 111.259 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -68.32 -18.09 64.42 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 176.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 66.6 t60 -88.03 -49.82 6.8 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.535 0.734 . . . . 0.0 109.432 173.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 27.2 ttp -57.15 -27.86 62.25 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.151 1.781 . . . . 0.0 113.616 -178.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 11.4 p -69.37 -26.52 64.7 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 121.114 -0.991 . . . . 0.0 112.641 175.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 68.8 m80 -104.32 -18.65 14.36 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.111 1.765 . . . . 0.0 113.947 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.0 t -62.84 150.77 40.84 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.282 1.433 . . . . 0.0 112.517 -179.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -121.52 -14.79 8.16 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.846 1.658 . . . . 0.0 113.743 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -97.29 -29.33 13.61 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.339 1.056 . . . . 0.0 112.598 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.92 -110.24 1.22 Allowed Glycine 0 CA--C 1.535 1.308 0 C-N-CA 124.484 1.04 . . . . 0.0 113.41 177.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -60.76 -20.27 60.98 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.095 -1.238 . . . . 0.0 113.3 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.49 -0.49 43.28 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.858 1.663 . . . . 0.0 113.588 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.7 t -63.7 142.46 58.39 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 122.106 0.955 . . . . 0.0 110.284 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -81.87 -3.2 53.52 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 86.2 t -89.75 115.81 30.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 173.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.42 -37.29 67.46 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -71.11 -27.36 63.53 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.125 0.97 . . . . 0.0 113.231 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 43.0 t -78.18 -56.86 4.13 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.6 1.56 . . . . 0.0 110.044 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.52 -27.69 66.41 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 179.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 16.2 p -77.18 -50.37 13.1 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.394 -0.816 . . . . 0.0 111.587 175.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 57.9 m -61.65 -36.37 80.59 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.524 -0.735 . . . . 0.0 112.55 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -61.1 -31.72 71.4 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 121.664 -0.647 . . . . 0.0 112.655 177.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -66.22 -29.94 70.29 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.018 0.826 . . . . 0.0 111.465 175.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.8 mt -76.29 -46.85 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 124.455 1.102 . . . . 0.0 109.807 176.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 33.3 mm -58.48 -36.91 61.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.157 0.983 . . . . 0.0 110.522 175.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 68.9 m -63.95 -21.38 66.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.358 1.063 . . . . 0.0 113.395 177.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.9 t60 -66.15 -57.45 7.62 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.88 1.218 . . . . 0.0 110.843 178.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 43.9 m95 -61.67 -21.25 64.27 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 177.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 92.8 mttt -79.38 -28.38 41.9 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.5 1.12 . . . . 0.0 112.713 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -100.13 -42.89 6.52 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.883 1.273 . . . . 0.0 113.697 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 12.7 t -81.39 133.2 35.38 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.463 1.905 . . . . 0.0 111.652 -178.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.9 p -130.04 -5.18 4.46 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -179.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 74.7 mtp85 -67.15 156.14 36.97 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.1 1.76 . . . . 0.0 114.18 -178.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -85.19 -34.05 22.15 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.846 0.858 . . . . 0.0 111.394 173.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 18.4 t0 -104.45 86.36 2.5 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.727 2.011 . . . . 0.0 111.278 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.0 t -136.5 137.0 22.89 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 126.572 1.949 . . . . 0.0 109.604 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -56.21 -29.11 74.33 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.386 2.724 . . . . 0.0 114.632 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 20.1 t -92.24 -54.86 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 CA-C-N 119.276 0.944 . . . . 0.0 111.934 175.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 9.7 m -66.39 -37.64 85.71 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -173.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.29 -57.98 17.48 Favored Pre-proline 0 CA--C 1.548 0.901 0 CA-C-N 120.046 1.294 . . . . 0.0 112.743 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.0 -29.03 87.18 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 121.806 1.671 . . . . 0.0 113.497 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 92.0 mt -70.44 -44.04 68.65 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.555 1.07 . . . . 0.0 111.482 177.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -62.32 -36.51 82.39 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 118.38 0.536 . . . . 0.0 110.766 175.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.0 t30 -69.21 -36.18 76.99 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 124.706 1.202 . . . . 0.0 112.349 176.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -79.07 -25.57 43.09 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.071 1.349 . . . . 0.0 114.203 178.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 45.9 t -57.53 144.07 38.4 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 125.44 1.496 . . . . 0.0 114.383 -177.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 37.3 t70 -82.48 -4.4 57.42 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.183 1.393 . . . . 0.0 112.388 176.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -80.22 47.46 0.91 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 126.353 1.861 . . . . 0.0 110.218 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 20.7 ptt-85 . . . . . 0 N--CA 1.476 0.875 0 C-N-CA 128.384 2.674 . . . . 0.0 113.226 -175.037 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.476 0 CA-C-O 121.309 0.394 . . . . 0.0 113.946 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.7 t -80.61 147.32 30.77 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.094 0.957 . . . . 0.0 112.165 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -139.16 150.45 45.63 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.795 1.638 . . . . 0.0 111.61 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 65.8 mtt -73.76 -25.39 60.14 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.76 0.824 . . . . 0.0 112.683 178.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -147.68 141.13 25.36 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.961 1.704 . . . . 0.0 110.081 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -154.64 -51.22 0.02 OUTLIER Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.046 1.338 . . . . 0.0 113.524 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -74.41 -29.24 9.53 Favored 'Trans proline' 0 C--N 1.356 0.93 0 CA-C-N 122.128 1.796 . . . . 0.0 115.222 -178.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -85.89 -14.22 45.51 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 -176.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 71.1 p -81.01 -11.05 59.62 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 7.3 t0 -77.57 119.83 78.99 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 125.235 1.414 . . . . 0.0 110.759 176.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.18 -25.03 58.17 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.517 2.145 . . . . 0.0 113.422 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 24.5 m -76.51 -0.72 24.1 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 2.2 p -76.0 -16.77 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 124.012 0.925 . . . . 0.0 113.454 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -70.15 118.04 59.99 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 124.565 1.146 . . . . 0.0 112.816 -178.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -62.72 -38.8 47.13 Favored 'Trans proline' 0 CA--C 1.551 1.334 0 C-N-CA 123.475 2.783 . . . . 0.0 118.853 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -76.03 170.71 19.53 Favored 'Trans proline' 0 C--N 1.356 0.947 0 C-N-CA 122.83 2.353 . . . . 0.0 115.206 -174.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 41.7 tp -68.92 143.4 54.47 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.015 1.326 . . . . 0.0 111.409 177.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 69.5 m -122.64 158.01 30.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.071 1.348 . . . . 0.0 111.899 178.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -56.88 -36.1 69.72 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.934 0.894 . . . . 0.0 112.177 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -70.13 -19.24 63.24 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.328 1.051 . . . . 0.0 113.731 178.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 22.8 m -65.81 -59.98 3.33 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.554 1.07 . . . . 0.0 111.031 -179.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.24 -30.66 69.56 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.754 0.706 . . . . 0.0 112.299 175.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 43.6 m -71.4 -31.37 67.19 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 31.7 t70 -90.11 -28.06 19.22 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.983 1.313 . . . . 0.0 113.391 176.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.5 tt -42.99 -59.99 1.8 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 127.335 2.254 . . . . 0.0 113.347 -177.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.3 p-90 -69.22 -9.43 52.99 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 -174.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -111.98 -59.88 1.93 Allowed 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -178.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 45.8 mt -120.25 20.25 12.02 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -171.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.7 tt -52.0 138.09 35.58 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 125.764 1.626 . . . . 0.0 114.425 -177.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -72.75 168.27 24.97 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 124.749 3.633 . . . . 0.0 115.023 -176.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 22.1 mp0 -61.44 -18.22 57.9 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.983 1.713 . . . . 0.0 115.093 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 50.0 t30 -138.07 129.56 27.87 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.711 1.204 . . . . 0.0 111.442 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -157.9 149.63 21.77 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.953 1.701 . . . . 0.0 110.264 177.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 46.8 t -98.17 -12.17 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 124.892 1.277 . . . . 0.0 114.168 -176.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.98 35.35 0.13 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 125.804 1.641 . . . . 0.0 114.037 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 50.6 m -97.95 107.5 40.93 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 125.471 1.509 . . . . 0.0 113.013 -176.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -74.77 121.97 7.01 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 122.711 2.274 . . . . 0.0 109.726 177.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 83.6 mt -83.24 147.2 52.92 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.022 0.929 . . . . 0.0 113.363 -176.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -52.54 -35.37 66.52 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 124.08 3.187 . . . . 0.0 115.253 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 42.5 m -65.88 -15.4 62.9 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -131.22 20.35 4.85 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.112 1.765 . . . . 0.0 111.699 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.67 155.19 40.25 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.968 1.47 . . . . 0.0 114.968 -176.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.43 15.14 12.84 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 128.588 2.755 . . . . 0.0 113.775 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 35.2 t70 -66.92 -13.79 62.13 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.106 1.362 . . . . 0.0 113.649 -179.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.4 t70 -65.21 -17.48 64.52 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 120.759 -1.213 . . . . 0.0 112.218 174.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 25.3 tp -116.03 19.82 14.79 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 127.392 2.277 . . . . 0.0 111.558 178.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.9 tpt -65.1 141.72 58.62 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 -175.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.5 tt -125.05 148.52 48.47 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.438 2.295 . . . . 0.0 111.75 -176.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 43.3 t -72.63 138.88 80.45 Favored Pre-proline 0 N--CA 1.474 0.755 0 C-N-CA 124.101 0.961 . . . . 0.0 111.383 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -57.15 -26.5 69.69 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 122.659 2.239 . . . . 0.0 114.71 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.6 t70 -69.3 -21.35 63.87 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 121.452 -0.78 . . . . 0.0 112.658 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 19.1 t70 -89.97 -9.89 47.07 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.809 1.644 . . . . 0.0 113.699 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 63.0 mt -51.63 -38.42 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 125.031 1.332 . . . . 0.0 111.244 177.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -67.16 -9.74 43.08 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.233 1.413 . . . . 0.0 113.611 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -78.32 -29.63 47.78 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.032 -1.042 . . . . 0.0 111.661 175.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.2 p-90 -96.25 -42.65 8.07 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 118.247 -0.882 . . . . 0.0 112.186 176.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -95.72 109.68 21.93 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 104.921 -2.251 . . . . 0.0 104.921 169.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.81 144.11 33.82 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -170.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -119.97 -179.9 4.06 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.157 2.183 . . . . 0.0 110.013 176.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -63.03 139.83 97.57 Favored Pre-proline 0 CA--C 1.553 1.088 0 O-C-N 120.804 -1.185 . . . . 0.0 112.233 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.32 -8.28 19.57 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.12 3.213 . . . . 0.0 114.932 -177.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 68.23 -173.14 32.88 Favored Glycine 0 CA--C 1.542 1.747 0 C-N-CA 124.529 1.062 . . . . 0.0 114.486 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.31 -20.65 20.91 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.509 2.806 . . . . 0.0 113.673 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -84.34 -28.35 27.11 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.138 0.975 . . . . 0.0 113.453 -179.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 69.8 9.21 62.12 Favored Glycine 0 CA--C 1.539 1.531 0 C-N-CA 124.447 1.022 . . . . 0.0 115.54 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 19.1 m -54.69 -32.77 59.94 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.21 1.404 . . . . 0.0 114.619 -176.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 74.0 m -58.93 -29.89 67.45 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.491 1.116 . . . . 0.0 113.689 -179.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -61.59 -23.08 65.77 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.33 0.968 . . . . 0.0 113.491 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -79.27 -32.16 43.61 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.54 -0.725 . . . . 0.0 111.237 175.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -82.31 -40.48 10.08 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.078 1.323 . . . . 0.0 114.043 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 46.5 p -64.52 -20.9 66.49 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 118.623 1.211 . . . . 0.0 113.527 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -74.0 -21.32 60.03 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.981 0.912 . . . . 0.0 112.695 176.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 73.2 m -84.02 122.11 28.32 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.669 1.187 . . . . 0.0 109.94 178.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 69.26 78.09 0.37 Allowed Glycine 0 CA--C 1.539 1.532 0 C-N-CA 124.319 0.962 . . . . 0.0 112.486 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -58.36 156.72 29.35 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.676 2.917 . . . . 0.0 113.782 -179.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 25.2 p -59.26 -18.61 38.79 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 179.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -84.13 -9.46 58.57 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.688 1.195 . . . . 0.0 113.42 176.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 14.0 t70 -80.79 133.65 54.89 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.267 1.027 . . . . 0.0 111.913 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -57.58 -39.22 90.05 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.815 2.343 . . . . 0.0 114.577 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -63.52 -36.55 84.15 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.058 -1.026 . . . . 0.0 112.034 -179.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 48.5 tptt -60.73 -25.87 66.77 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.6 1.16 . . . . 0.0 112.35 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.96 -41.29 11.83 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.666 1.587 . . . . 0.0 110.668 175.006 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.6 mtpt -59.4 -34.16 72.11 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.243 1.017 . . . . 0.0 112.257 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 54.7 mt -62.46 -37.82 87.41 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.332 0.969 . . . . 0.0 111.932 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.9 mt -67.82 -51.82 46.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.709 0.804 . . . . 0.0 109.552 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -54.75 -55.07 33.86 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.656 1.182 . . . . 0.0 111.032 178.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -34.84 78.85 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -177.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -69.35 -45.41 69.46 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.074 0.852 . . . . 0.0 110.518 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 7.2 tp -62.71 -39.36 93.81 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.365 0.666 . . . . 0.0 111.146 178.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 71.7 t -60.51 -31.99 50.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 119.656 1.116 . . . . 0.0 110.987 175.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 7.9 tp -72.62 -28.55 62.82 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 120.714 -1.241 . . . . 0.0 112.299 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.35 -28.54 70.07 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 120.403 1.456 . . . . 0.0 110.178 174.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 1.9 mt -74.15 -51.34 15.87 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.96 0.904 . . . . 0.0 108.772 175.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 20.4 t60 -55.3 -54.77 39.41 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.512 0.725 . . . . 0.0 111.167 177.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.43 -23.16 36.63 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -178.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -90.06 -38.02 13.87 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.274 -0.891 . . . . 0.0 112.318 174.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 52.1 mttm -78.34 -25.04 46.28 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.607 1.563 . . . . 0.0 113.467 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 50.8 t -77.9 -53.48 7.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.418 2.287 . . . . 0.0 111.9 178.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -54.01 -32.59 54.69 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 121.185 -0.947 . . . . 0.0 112.518 177.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -62.63 -33.48 75.1 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.649 1.979 . . . . 0.0 112.602 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.16 -37.88 84.51 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.285 0.948 . . . . 0.0 111.475 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -71.98 -46.88 55.7 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.32 1.048 . . . . 0.0 110.15 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -62.29 -41.4 98.47 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.406 1.082 . . . . 0.0 113.513 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -75.39 -31.78 60.57 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -179.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -87.25 -43.35 12.26 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.948 0.899 . . . . 0.0 113.267 -179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 79.6 -6.67 57.4 Favored Glycine 0 CA--C 1.54 1.638 0 N-CA-C 116.74 1.456 . . . . 0.0 116.74 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -120.12 -43.3 2.54 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.954 1.877 . . . . 0.0 113.338 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 17.3 m -78.08 147.65 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 118.94 0.791 . . . . 0.0 111.692 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -93.55 155.36 17.36 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.715 1.206 . . . . 0.0 112.768 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -82.02 -177.22 6.52 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.053 1.341 . . . . 0.0 112.01 176.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 6.2 m -52.1 146.01 9.53 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 116.164 1.913 . . . . 0.0 116.164 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 65.0 p -93.65 -6.11 47.11 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.345 1.858 . . . . 0.0 111.18 170.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 3.7 tt -61.3 119.08 42.94 Favored Pre-proline 0 CA--C 1.554 1.119 0 C-N-CA 128.284 2.634 . . . . 0.0 108.472 178.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -60.93 -41.12 47.26 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.973 2.449 . . . . 0.0 114.487 -173.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 70.5 m80 -69.12 -29.46 67.53 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.46 -0.775 . . . . 0.0 113.058 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 51.2 t -69.44 -52.61 25.18 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.023 1.329 . . . . 0.0 108.518 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -54.78 -34.81 63.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.378 1.471 . . . . 0.0 111.602 174.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 21.4 m -71.08 -59.02 3.01 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.779 1.231 . . . . 0.0 111.591 176.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.0 mmt -62.97 -33.68 75.9 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -64.99 -32.64 74.46 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 120.81 1.641 . . . . 0.0 112.482 177.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -72.79 -38.15 67.35 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.233 0.613 . . . . 0.0 110.452 174.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 96.0 t -63.47 -46.87 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.491 0.587 . . . . 0.0 110.456 176.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -46.47 85.93 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.04 0.836 . . . . 0.0 111.136 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -66.36 -19.52 65.83 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 177.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 65.3 t60 -86.61 -49.38 7.57 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.089 0.858 . . . . 0.0 109.49 173.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 34.9 ttp -57.01 -28.99 62.97 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.445 1.898 . . . . 0.0 113.59 -177.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 16.3 p -70.29 -27.93 64.79 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.954 0.902 . . . . 0.0 112.738 175.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 73.1 m80 -101.62 -18.24 15.98 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.762 1.625 . . . . 0.0 113.906 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 16.8 t -61.5 155.24 22.48 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.183 1.393 . . . . 0.0 112.562 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -126.7 -12.23 6.04 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.782 1.633 . . . . 0.0 113.702 -178.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -96.52 -27.67 14.75 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.351 1.06 . . . . 0.0 112.051 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.23 -114.41 4.19 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.777 1.18 . . . . 0.0 113.406 177.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -62.13 -16.38 52.2 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 121.325 -1.103 . . . . 0.0 113.444 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.24 -0.51 43.93 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.342 1.457 . . . . 0.0 113.382 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.6 t -60.32 142.61 54.51 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 122.403 1.097 . . . . 0.0 110.634 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.0 mm-40 -77.86 -9.44 59.06 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.696 1.198 . . . . 0.0 113.015 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 99.8 t -88.58 115.22 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.6 -41.76 66.97 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -65.76 -41.49 92.03 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.505 0.722 . . . . 0.0 112.884 -179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 41.1 t -61.35 -56.4 20.82 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.718 1.207 . . . . 0.0 110.665 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.42 -30.97 69.96 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.293 0.637 . . . . 0.0 112.632 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 74.7 m -71.64 -51.05 25.15 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.981 0.912 . . . . 0.0 111.161 176.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 33.6 m -58.38 -36.61 73.77 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.952 0.901 . . . . 0.0 112.146 176.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.24 -30.46 71.12 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 118.092 -0.956 . . . . 0.0 113.179 175.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -69.11 -27.46 65.6 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.664 1.12 . . . . 0.0 110.828 176.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.3 mm -74.29 -48.41 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.772 0.829 . . . . 0.0 109.58 175.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 20.2 mm -59.14 -40.56 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.403 1.081 . . . . 0.0 110.714 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 49.9 m -62.14 -22.25 65.71 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.961 0.904 . . . . 0.0 113.068 177.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.3 t60 -66.52 -56.95 8.47 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.514 1.052 . . . . 0.0 109.966 176.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 42.9 m95 -61.47 -32.66 72.67 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.273 0.942 . . . . 0.0 112.966 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -65.45 -28.55 69.31 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.352 -0.843 . . . . 0.0 112.948 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -100.02 -50.02 4.13 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.776 1.23 . . . . 0.0 114.271 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 11.1 t -79.87 132.21 36.04 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.629 1.972 . . . . 0.0 112.525 -176.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 4.4 t -130.14 -2.36 4.54 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.2 1.4 . . . . 0.0 113.872 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 83.5 mtt-85 -69.51 145.74 52.43 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.94 1.296 . . . . 0.0 113.478 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 85.0 t60 -79.79 -34.72 39.41 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 169.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -86.5 69.95 10.42 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.764 1.625 . . . . 0.0 112.14 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.7 t -136.28 133.06 19.24 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 126.055 1.742 . . . . 0.0 109.743 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -58.83 -25.07 75.05 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 122.86 2.373 . . . . 0.0 114.149 -178.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 17.6 t -92.17 -51.66 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 119.28 0.945 . . . . 0.0 111.961 176.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.4 m -71.28 -35.66 71.42 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -174.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.37 -56.56 25.21 Favored Pre-proline 0 N--CA 1.474 0.749 0 CA-C-N 119.773 1.169 . . . . 0.0 113.204 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -60.52 -33.49 93.74 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.032 1.821 . . . . 0.0 113.089 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 94.9 mt -68.4 -45.56 72.34 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.973 0.806 . . . . 0.0 111.565 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 55.4 mttm -61.94 -45.01 95.57 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.911 0.884 . . . . 0.0 109.834 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 19.2 t30 -61.38 -40.9 96.04 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.938 1.295 . . . . 0.0 112.411 176.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -76.43 -19.36 58.16 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.468 1.107 . . . . 0.0 113.935 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 25.1 p -67.42 152.64 45.33 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -177.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -69.11 -27.14 65.32 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.178 0.991 . . . . 0.0 113.615 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -89.06 -18.77 26.62 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.543 1.137 . . . . 0.0 113.058 178.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 . . . . . 0 N--CA 1.476 0.873 0 C-N-CA 125.865 1.666 . . . . 0.0 110.44 179.497 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.494 0 N-CA-C 114.74 0.656 . . . . 0.0 114.74 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.9 p -74.89 -19.0 60.33 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.247 1.419 . . . . 0.0 113.925 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -138.15 159.11 42.88 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.836 2.055 . . . . 0.0 110.888 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 45.3 ttp -80.08 59.02 3.14 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.651 1.18 . . . . 0.0 111.457 178.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -91.46 -3.82 56.22 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.592 1.557 . . . . 0.0 114.071 -178.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -72.82 148.28 89.52 Favored Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 124.927 1.291 . . . . 0.0 112.65 178.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -69.21 150.13 71.18 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 123.172 2.581 . . . . 0.0 112.704 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -132.28 18.97 4.42 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.226 1.411 . . . . 0.0 113.728 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 41.3 p -78.44 -19.6 52.83 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.053 1.341 . . . . 0.0 114.317 -179.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 14.4 t70 -75.2 132.17 76.98 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 124.282 1.033 . . . . 0.0 110.936 178.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.73 -12.4 34.48 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 123.422 2.748 . . . . 0.0 115.376 -177.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 1.6 t -106.47 8.43 31.47 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.895 1.678 . . . . 0.0 113.531 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 6.4 p -67.01 141.12 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 O-C-N 120.754 -1.217 . . . . 0.0 112.405 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -153.44 148.37 19.76 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 124.672 1.189 . . . . 0.0 111.816 177.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -60.07 -44.31 30.38 Favored 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 123.054 2.502 . . . . 0.0 117.26 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -86.24 -179.9 3.34 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 123.503 2.802 . . . . 0.0 113.875 -176.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 7.4 tt -97.18 137.1 36.73 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.765 1.626 . . . . 0.0 110.52 176.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 51.1 m -82.64 141.66 32.33 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.399 1.08 . . . . 0.0 111.683 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 21.0 mm100 -56.13 -33.09 64.83 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -178.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -69.25 -18.12 63.84 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 178.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 87.1 m -61.17 -60.07 4.33 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.284 0.947 . . . . 0.0 110.698 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -60.21 -31.85 70.55 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 49.9 m -68.45 -34.52 76.11 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.76 0.709 . . . . 0.0 112.804 178.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.1 t70 -90.3 -24.32 20.92 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 174.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.6 tt -46.09 -60.08 2.49 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.233 1.813 . . . . 0.0 113.588 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 51.0 p-90 -65.11 -10.24 29.08 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -173.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 58.4 pttt -111.97 -53.46 2.7 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 6.2 mp -120.16 20.03 12.11 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 116.774 2.138 . . . . 0.0 116.774 -175.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.81 140.1 29.91 Favored Pre-proline 0 N--CA 1.483 1.217 0 O-C-N 120.223 -1.548 . . . . 0.0 114.885 -178.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -79.5 159.79 25.55 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 124.04 3.16 . . . . 0.0 113.541 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 12.7 mp0 -66.84 -25.59 66.5 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.899 1.28 . . . . 0.0 112.802 177.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 49.5 t30 -82.16 75.21 9.09 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.252 1.421 . . . . 0.0 112.154 -179.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 8.2 p30 -147.89 153.93 39.74 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.835 1.254 . . . . 0.0 111.645 177.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 34.2 m -136.18 18.98 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 C-N-CA 125.264 1.425 . . . . 0.0 113.733 -178.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 40.2 tp -82.0 -10.3 59.29 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -175.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 2.8 p -63.74 119.47 54.68 Favored Pre-proline 0 CA--C 1.547 0.844 0 O-C-N 120.671 -1.268 . . . . 0.0 113.372 -179.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -76.29 146.75 28.52 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.014 2.476 . . . . 0.0 111.03 177.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 10.3 mp -69.62 138.41 88.46 Favored Pre-proline 0 CA--C 1.547 0.832 0 CA-C-O 118.102 -0.951 . . . . 0.0 110.238 178.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -53.5 -29.95 51.79 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.235 2.623 . . . . 0.0 115.127 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 54.3 p -80.77 -12.31 59.47 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.636 1.575 . . . . 0.0 114.199 177.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -119.0 -16.83 9.15 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.054 1.741 . . . . 0.0 113.59 -178.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -64.08 157.88 24.2 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.614 1.566 . . . . 0.0 114.206 -177.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -73.28 23.99 0.07 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 128.415 2.686 . . . . 0.0 114.668 178.606 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 31.0 t70 -68.86 -20.36 64.27 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.816 1.246 . . . . 0.0 113.873 -178.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -63.96 -16.34 61.32 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 121.057 -1.027 . . . . 0.0 113.278 178.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 27.4 tp -110.16 7.87 23.53 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 126.853 2.061 . . . . 0.0 111.968 178.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 10.8 tpt -70.95 147.87 48.27 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 14.5 mt -118.81 160.9 21.06 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.852 1.661 . . . . 0.0 113.144 -178.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 43.3 t -71.71 145.0 89.13 Favored Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 169.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -58.19 -14.76 20.65 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 123.095 2.53 . . . . 0.0 116.357 -175.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -72.93 -22.99 60.64 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.32 -0.862 . . . . 0.0 112.886 177.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 14.9 t70 -84.8 -10.08 57.55 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.406 1.082 . . . . 0.0 113.006 178.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 91.7 mt -56.59 -34.94 43.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.569 1.148 . . . . 0.0 110.584 176.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -73.45 -9.89 59.16 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.819 1.248 . . . . 0.0 113.641 178.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -84.33 -24.61 29.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.067 0.947 . . . . 0.0 112.773 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -72.29 -48.71 40.3 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.476 1.034 . . . . 0.0 111.756 -179.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -87.14 109.96 19.8 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 176.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 1.5 m -54.25 134.1 44.77 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 -172.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -105.65 173.71 6.19 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.424 1.889 . . . . 0.0 112.428 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 13.1 t70 -64.93 131.98 95.35 Favored Pre-proline 0 CA--C 1.556 1.181 0 O-C-N 121.122 -0.986 . . . . 0.0 111.743 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -75.25 -11.7 21.04 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 123.725 2.95 . . . . 0.0 115.467 -177.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 69.68 -168.44 46.43 Favored Glycine 0 CA--C 1.543 1.807 0 C-N-CA 124.291 0.948 . . . . 0.0 113.643 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -73.73 -19.17 21.49 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.541 2.827 . . . . 0.0 113.708 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 19.4 t70 -87.77 -56.54 3.3 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.773 1.229 . . . . 0.0 112.829 -179.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 62.67 9.31 25.29 Favored Glycine 0 CA--C 1.533 1.216 0 N-CA-C 118.14 2.016 . . . . 0.0 118.14 177.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 70.8 m -70.45 117.51 12.08 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 120.4 2.1 . . . . 0.0 108.277 175.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 20.9 p -77.97 165.4 24.11 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.571 1.549 . . . . 0.0 113.997 -176.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -133.42 169.85 16.34 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.088 1.355 . . . . 0.0 114.061 -173.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 66.4 m-20 -63.97 144.03 57.4 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 121.486 -0.759 . . . . 0.0 109.333 174.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . 93.38 -12.31 69.92 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.556 1.074 . . . . 0.0 113.051 -175.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 11.1 t -130.08 -46.98 1.12 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.389 1.476 . . . . 0.0 110.867 174.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -74.17 -38.35 63.71 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.939 0.896 . . . . 0.0 111.886 175.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 41.4 p -85.16 -10.26 56.91 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.53 1.532 . . . . 0.0 113.465 179.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -154.54 81.21 0.18 Allowed Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.295 1.426 . . . . 0.0 112.302 179.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -63.04 171.68 5.88 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.152 3.234 . . . . 0.0 113.37 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 35.4 p -55.61 -23.46 27.65 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -86.13 -5.72 59.15 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.968 1.307 . . . . 0.0 113.707 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 16.2 t70 -74.1 138.6 75.74 Favored Pre-proline 0 CA--C 1.549 0.915 0 O-C-N 120.736 -1.227 . . . . 0.0 111.575 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.58 -41.16 80.58 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.802 2.335 . . . . 0.0 114.04 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -67.91 -41.91 81.93 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 121.231 -0.918 . . . . 0.0 111.883 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 20.7 tptm -58.68 -35.05 71.98 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.873 0.869 . . . . 0.0 111.501 177.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 78.4 mtm180 -76.76 -43.96 34.92 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.088 1.355 . . . . 0.0 111.311 175.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -56.72 -35.22 68.3 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.252 1.021 . . . . 0.0 112.111 175.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 57.3 mt -59.63 -37.94 80.01 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.202 0.91 . . . . 0.0 112.016 177.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -67.1 -54.59 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 118.703 0.683 . . . . 0.0 109.245 175.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -52.71 -51.75 59.1 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.462 1.105 . . . . 0.0 112.011 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -35.17 78.63 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.338 -0.851 . . . . 0.0 113.178 -179.087 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -71.41 -42.54 68.17 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.569 1.077 . . . . 0.0 109.693 178.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.5 tt -61.81 -44.44 96.86 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.706 1.602 . . . . 0.0 110.723 178.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 89.1 t -61.81 -26.64 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 O-C-N 120.589 -1.32 . . . . 0.0 110.904 174.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.78 -27.53 58.04 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 120.465 -1.397 . . . . 0.0 111.939 173.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.7 mp -61.14 -41.17 96.24 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.478 1.49 . . . . 0.0 107.878 169.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.84 -48.72 73.31 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.503 -0.76 . . . . 0.0 111.074 176.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 15.3 t60 -55.13 -52.47 63.18 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.033 0.833 . . . . 0.0 109.743 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -60.08 -24.34 64.52 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -178.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -88.26 -29.03 20.72 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.16 0.891 . . . . 0.0 112.467 175.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 59.7 mttm -85.37 -39.56 17.47 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.52 1.528 . . . . 0.0 113.084 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.8 t -60.62 -44.6 96.16 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.362 1.865 . . . . 0.0 110.755 176.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -65.45 -38.85 91.04 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 121.415 -0.803 . . . . 0.0 112.069 174.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -69.18 -35.97 76.84 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.665 1.186 . . . . 0.0 111.84 -179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -56.52 -42.42 78.38 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.147 1.779 . . . . 0.0 111.704 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -74.65 -38.85 62.37 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.002 0.521 . . . . 0.0 111.352 177.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -64.79 -36.32 83.94 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.472 -0.768 . . . . 0.0 111.864 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -81.18 -25.61 36.65 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.493 1.517 . . . . 0.0 113.782 179.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -140.02 109.48 6.23 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.565 1.146 . . . . 0.0 112.544 -177.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . -69.8 -10.92 65.27 Favored Glycine 0 CA--C 1.539 1.576 0 N-CA-C 115.518 0.967 . . . . 0.0 115.518 178.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -82.81 -8.11 59.61 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 119.086 1.443 . . . . 0.0 113.286 179.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 35.8 m -131.46 163.16 37.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 125.934 1.694 . . . . 0.0 112.042 179.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 50.4 ptt85 -124.94 161.9 25.62 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 125.306 1.442 . . . . 0.0 113.208 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -68.16 157.73 34.73 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.04 0.936 . . . . 0.0 109.812 173.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 1.9 p -74.54 175.16 8.06 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -177.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 72.1 p -105.35 9.35 33.82 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.277 1.831 . . . . 0.0 114.394 -178.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 14.7 tp -66.76 130.54 94.01 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 124.557 1.143 . . . . 0.0 111.261 -179.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -64.79 -37.59 34.66 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.769 2.313 . . . . 0.0 113.549 -177.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 44.8 m80 -71.26 -32.89 69.26 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.463 -0.773 . . . . 0.0 112.286 177.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.0 t -65.12 -51.16 62.93 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.847 0.748 . . . . 0.0 109.174 174.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -53.6 -34.3 57.93 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.064 1.346 . . . . 0.0 111.972 174.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 52.7 m -73.6 -61.06 1.97 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.162 0.985 . . . . 0.0 111.679 176.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 21.9 mmm -64.28 -30.21 71.27 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 -175.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -65.31 -34.34 78.1 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 120.727 1.603 . . . . 0.0 112.084 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -70.8 -37.27 73.26 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.41 0.684 . . . . 0.0 110.353 175.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 90.3 t -64.6 -48.63 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.578 0.751 . . . . 0.0 110.379 176.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.13 -43.57 91.99 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.976 0.911 . . . . 0.0 111.703 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -68.66 -17.13 64.03 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 177.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 72.0 t60 -90.13 -50.84 5.77 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.727 1.211 . . . . 0.0 109.997 174.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 38.7 ttp -57.31 -26.46 60.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.581 1.953 . . . . 0.0 113.513 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 2.8 p -60.31 -35.45 75.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.803 1.241 . . . . 0.0 112.886 176.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -111.94 -10.2 13.98 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.86 1.264 . . . . 0.0 114.322 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 43.4 t -63.55 129.85 41.91 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.105 0.866 . . . . 0.0 111.434 178.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -101.05 -16.12 17.21 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.103 1.361 . . . . 0.0 114.072 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.31 -31.13 20.36 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.024 0.829 . . . . 0.0 111.758 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.36 -110.77 1.48 Allowed Glycine 0 CA--C 1.532 1.114 0 C-N-CA 124.494 1.045 . . . . 0.0 112.94 178.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.53 -20.39 60.13 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 121.384 -1.068 . . . . 0.0 113.187 177.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -96.54 -2.36 45.21 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.621 1.568 . . . . 0.0 113.567 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.7 t -62.5 142.38 57.96 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.145 0.974 . . . . 0.0 110.011 177.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -81.62 -5.28 57.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.254 1.022 . . . . 0.0 113.565 -176.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.0 t -89.22 115.44 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.91 -43.56 73.37 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -62.63 -38.19 89.27 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.509 0.724 . . . . 0.0 112.872 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.6 t -67.13 -57.74 6.21 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.488 1.515 . . . . 0.0 110.165 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -55.21 -36.39 65.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.033 0.933 . . . . 0.0 112.439 178.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 13.1 m -69.95 -51.56 31.7 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 124.045 0.938 . . . . 0.0 112.394 175.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 70.2 m -61.09 -37.35 82.43 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.19 -0.944 . . . . 0.0 112.066 -179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.41 -33.78 68.23 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.141 0.976 . . . . 0.0 112.165 176.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -67.46 -31.02 70.89 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.934 0.893 . . . . 0.0 112.057 177.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.5 mt -77.46 -45.33 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-N 118.514 0.597 . . . . 0.0 110.01 176.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 28.5 mm -58.37 -38.58 70.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.832 0.853 . . . . 0.0 110.011 176.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 67.9 m -62.23 -24.98 67.56 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.17 0.988 . . . . 0.0 113.222 176.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.1 t60 -64.81 -55.88 16.91 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.836 1.198 . . . . 0.0 109.526 176.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 48.4 m95 -59.27 -33.48 71.1 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 178.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -68.41 -30.14 68.99 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 177.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -100.09 -34.86 9.89 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.5 t -75.86 131.58 39.79 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.41 1.484 . . . . 0.0 112.95 -175.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 67.7 p -130.07 0.6 4.72 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 126.022 1.729 . . . . 0.0 113.421 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 47.6 ttt85 -74.73 135.67 41.79 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.79 1.636 . . . . 0.0 111.22 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 43.2 p-80 -75.33 -36.6 61.01 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 121.897 -0.502 . . . . 0.0 112.166 178.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -101.74 69.98 1.23 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.546 1.538 . . . . 0.0 112.462 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 44.7 t -114.62 132.79 22.71 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 126.546 1.938 . . . . 0.0 108.427 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -59.12 -26.17 80.69 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.899 2.4 . . . . 0.0 115.03 -176.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 41.8 t -92.22 -49.59 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-N 119.232 0.923 . . . . 0.0 111.601 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 13.0 m -68.88 -43.99 74.16 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.297 1.221 . . . . 0.0 114.297 -176.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.1 tt -53.21 -56.57 22.77 Favored Pre-proline 0 CA--C 1.548 0.877 0 CA-C-O 117.891 -1.052 . . . . 0.0 113.105 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -60.95 -32.68 92.72 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 121.873 1.716 . . . . 0.0 113.188 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 92.6 mt -70.16 -44.06 69.57 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.215 0.916 . . . . 0.0 111.637 177.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -60.44 -37.71 81.81 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.496 1.119 . . . . 0.0 110.731 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 17.3 t30 -73.43 -41.32 63.41 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.653 1.581 . . . . 0.0 113.087 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -79.33 -31.12 43.04 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -177.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 40.2 t -66.66 143.58 56.89 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -177.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -87.26 -11.42 49.7 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.386 1.074 . . . . 0.0 112.173 175.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -85.57 36.99 0.67 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 126.076 1.75 . . . . 0.0 112.542 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 33.8 ptt-85 . . . . . 0 N--CA 1.475 0.821 0 C-N-CA 127.099 2.16 . . . . 0.0 114.256 -178.108 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.415 0 N-CA-C 114.816 0.686 . . . . 0.0 114.816 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.5 m -69.24 -15.8 63.45 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.272 1.429 . . . . 0.0 114.368 -179.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -145.52 150.29 36.17 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.281 1.832 . . . . 0.0 111.065 179.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 26.3 mmt -129.09 145.52 51.26 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.661 1.584 . . . . 0.0 111.197 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.73 -28.96 62.96 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.958 0.903 . . . . 0.0 113.183 -179.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -136.66 154.23 76.42 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 125.502 1.521 . . . . 0.0 111.831 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -60.56 152.29 69.43 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 123.531 2.82 . . . . 0.0 113.971 179.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -72.03 -28.5 63.4 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.964 0.905 . . . . 0.0 112.556 178.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 79.0 p -150.02 164.71 34.79 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.144 1.778 . . . . 0.0 111.731 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 21.6 t70 -139.74 123.0 10.51 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 124.851 1.261 . . . . 0.0 111.483 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -81.22 -26.07 3.6 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.04 2.493 . . . . 0.0 113.696 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 16.2 m -59.7 -19.74 51.76 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.963 1.705 . . . . 0.0 115.461 -176.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 9.8 p -72.62 -20.83 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.049 0.939 . . . . 0.0 112.544 177.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -91.28 133.02 32.34 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 124.59 1.156 . . . . 0.0 111.788 179.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -56.31 -47.89 22.03 Favored 'Trans proline' 0 CA--C 1.553 1.44 0 C-N-CA 122.954 2.436 . . . . 0.0 115.608 178.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -79.29 165.56 23.35 Favored 'Trans proline' 0 C--N 1.356 0.946 0 C-N-CA 122.859 2.373 . . . . 0.0 112.453 178.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 72.6 mt -63.19 139.56 58.78 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 121.652 -0.655 . . . . 0.0 111.325 175.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 56.2 p -68.04 -24.82 65.13 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 169.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 13.4 mp0 -81.1 -2.11 46.97 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 128.973 2.909 . . . . 0.0 114.081 175.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.21 -11.34 49.25 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 122.042 2.201 . . . . 0.0 111.338 174.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 9.6 t -48.06 -29.08 3.23 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.195 2.198 . . . . 0.0 111.388 170.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -50.73 -31.95 18.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.089 1.356 . . . . 0.0 112.998 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 26.9 m -72.58 -30.84 64.74 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.932 0.893 . . . . 0.0 113.153 178.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 30.8 t70 -90.28 -30.15 17.69 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.53 1.532 . . . . 0.0 113.277 174.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 1.8 tt -45.68 -60.03 2.43 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 128.276 2.63 . . . . 0.0 112.969 -175.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.4 p-90 -63.33 -13.85 43.4 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -174.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -112.07 -52.33 2.79 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 117.557 2.428 . . . . 0.0 117.557 -177.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 69.8 mt -120.03 20.46 12.11 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 116.319 1.97 . . . . 0.0 116.319 -169.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 12.9 tp -51.8 135.69 36.23 Favored Pre-proline 0 CA--C 1.549 0.931 0 N-CA-C 115.911 1.819 . . . . 0.0 115.911 -172.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -77.33 162.53 30.95 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 123.321 2.68 . . . . 0.0 110.515 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -77.89 -15.9 58.66 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 120.813 -1.18 . . . . 0.0 113.556 179.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 48.4 t30 -92.85 87.61 5.89 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.958 1.303 . . . . 0.0 111.581 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -151.4 151.24 31.43 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.193 1.397 . . . . 0.0 111.075 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 29.1 m -127.02 13.53 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -178.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 26.9 tp -75.69 -10.6 59.57 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.905 -1.122 . . . . 0.0 113.512 178.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 5.5 m -52.15 114.55 5.57 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 125.941 1.696 . . . . 0.0 113.358 -178.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.04 132.29 21.0 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 122.255 1.97 . . . . 0.0 110.243 178.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 21.3 tp -74.1 130.62 82.4 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 124.274 1.029 . . . . 0.0 111.154 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -51.71 -32.05 43.8 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 123.818 3.012 . . . . 0.0 116.295 -177.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 73.5 p -72.57 -14.3 61.59 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 178.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -128.78 13.9 6.39 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.345 1.858 . . . . 0.0 112.344 179.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -73.16 161.72 30.25 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.064 1.345 . . . . 0.0 114.221 -177.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.58 17.81 3.09 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.673 2.389 . . . . 0.0 113.59 178.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -66.79 -14.12 62.27 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.404 1.482 . . . . 0.0 114.752 -177.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 37.3 t70 -68.42 -16.16 63.81 Favored 'General case' 0 CA--C 1.55 0.954 0 O-C-N 121.127 -0.983 . . . . 0.0 112.447 176.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 21.7 tp -117.81 20.4 13.39 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 127.344 2.258 . . . . 0.0 111.641 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.8 tpt -70.25 143.97 51.97 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 116.369 1.988 . . . . 0.0 116.369 -174.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 71.2 mt -125.02 153.15 43.27 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 127.015 2.126 . . . . 0.0 113.63 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 37.0 p -81.61 161.91 59.91 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 123.454 0.702 . . . . 0.0 110.075 171.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -59.67 -21.35 62.5 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.468 2.112 . . . . 0.0 114.869 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -76.66 -22.04 54.58 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.727 0.811 . . . . 0.0 113.099 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -80.18 -19.4 47.19 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.751 0.82 . . . . 0.0 112.664 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 64.7 mt -55.03 -38.07 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.869 1.668 . . . . 0.0 111.57 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.82 -9.87 48.11 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -82.88 -26.75 31.26 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.943 0.897 . . . . 0.0 112.36 177.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.273 4.2 p-90 -102.8 -25.45 13.51 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.413 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -120.5 109.62 15.51 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 103.709 -2.7 . . . . 0.0 103.709 169.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 4.2 m -125.19 146.31 49.57 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.645 0.778 . . . . 0.0 112.872 -171.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -75.07 162.19 28.76 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.231 1.012 . . . . 0.0 111.939 177.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 11.9 t70 -64.73 125.7 89.39 Favored Pre-proline 0 CA--C 1.555 1.141 0 O-C-N 121.264 -0.897 . . . . 0.0 111.657 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -83.24 0.27 9.61 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 124.104 3.202 . . . . 0.0 115.332 -176.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 89.81 174.08 45.52 Favored Glycine 0 CA--C 1.541 1.675 0 C-N-CA 125.603 1.573 . . . . 0.0 113.474 -177.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -64.77 -23.06 63.22 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 123.773 2.982 . . . . 0.0 114.278 -178.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -91.17 -4.9 55.69 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.689 1.196 . . . . 0.0 113.138 177.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -84.11 92.59 1.71 Allowed Glycine 0 C--N 1.34 0.756 0 C-N-CA 124.939 1.257 . . . . 0.0 114.029 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 69.4 m -68.73 123.78 21.86 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 173.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 27.6 p -91.91 160.19 15.4 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.65 1.18 . . . . 0.0 113.479 -176.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -138.59 167.04 22.8 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.975 1.71 . . . . 0.0 111.325 -176.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 55.3 t30 -56.36 -30.82 63.15 Favored 'General case' 0 CA--C 1.551 0.986 0 O-C-N 121.001 -1.062 . . . . 0.0 112.468 177.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -81.77 -8.53 86.68 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.88 1.228 . . . . 0.0 115.488 177.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 78.5 p -124.99 -25.86 3.8 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 119.747 1.773 . . . . 0.0 114.757 -178.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -74.25 141.42 45.36 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.616 1.166 . . . . 0.0 111.538 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 72.5 p -100.2 -28.03 13.21 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -177.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -87.19 -71.98 1.29 Allowed Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.489 1.519 . . . . 0.0 113.515 -179.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -76.24 24.69 0.44 Allowed 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 124.936 3.757 . . . . 0.0 114.405 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 2.7 m -58.93 117.06 4.22 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.379 1.472 . . . . 0.0 111.33 -179.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -93.45 -21.34 19.55 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.71 1.204 . . . . 0.0 112.225 178.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 14.7 t70 -69.87 122.28 85.47 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 124.697 1.199 . . . . 0.0 111.351 178.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -75.05 -29.98 7.58 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.737 2.291 . . . . 0.0 113.728 -178.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -60.27 -40.89 91.98 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.229 -0.919 . . . . 0.0 111.779 179.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -56.46 -34.0 66.44 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 119.839 1.199 . . . . 0.0 112.43 177.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -76.28 -43.27 42.44 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.794 0.838 . . . . 0.0 111.285 175.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -61.86 -36.07 80.15 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.898 0.879 . . . . 0.0 111.892 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 64.3 mt -68.87 -38.45 79.73 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.659 1.184 . . . . 0.0 111.259 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 48.4 mt -61.76 -50.65 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 118.858 0.754 . . . . 0.0 109.257 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -56.01 -54.73 41.37 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.593 0.757 . . . . 0.0 111.039 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -35.21 80.3 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -177.06 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -68.36 -47.66 66.83 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.259 0.936 . . . . 0.0 109.892 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 10.7 tp -60.37 -39.29 86.7 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.479 0.711 . . . . 0.0 111.296 177.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 90.5 t -62.21 -31.12 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.791 1.178 . . . . 0.0 110.966 175.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.6 tp -73.61 -29.53 62.43 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.658 -1.276 . . . . 0.0 111.984 174.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.71 -29.8 69.57 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 120.219 1.372 . . . . 0.0 109.901 173.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.5 mt -74.19 -51.88 14.16 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.696 0.798 . . . . 0.0 109.302 175.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 24.4 t60 -55.07 -52.99 61.48 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.38 0.672 . . . . 0.0 111.597 178.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -59.12 -23.24 61.96 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -178.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -90.1 -32.88 16.49 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.171 0.896 . . . . 0.0 112.088 173.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 49.5 mttm -74.85 -38.24 62.04 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.842 1.257 . . . . 0.0 112.198 177.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 26.0 t -61.12 -50.0 74.98 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.22 2.208 . . . . 0.0 110.951 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -62.5 -37.34 85.64 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 121.33 -0.856 . . . . 0.0 112.216 175.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -65.23 -43.75 90.42 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.227 1.011 . . . . 0.0 111.229 175.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -59.72 -42.91 94.18 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.773 1.629 . . . . 0.0 111.308 177.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -65.17 -46.46 80.75 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 122.736 0.415 . . . . 0.0 110.877 177.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -63.79 -37.01 85.76 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.031 0.932 . . . . 0.0 112.735 178.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -66.3 -37.61 85.82 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.438 1.095 . . . . 0.0 113.401 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -89.61 -45.57 9.27 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.168 0.987 . . . . 0.0 113.079 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 76.53 -10.69 16.19 Favored Glycine 0 CA--C 1.541 1.691 0 N-CA-C 117.169 1.628 . . . . 0.0 117.169 178.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -108.79 -36.2 6.2 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.982 1.891 . . . . 0.0 113.205 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 34.0 m -74.76 163.66 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.478 1.111 . . . . 0.0 112.296 177.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -112.41 143.85 42.85 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.285 1.434 . . . . 0.0 111.097 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -73.09 174.92 7.24 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.024 1.33 . . . . 0.0 113.32 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 23.8 m -51.24 148.6 4.55 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.119 2.168 . . . . 0.0 116.463 -178.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 64.6 p -92.26 -5.4 52.46 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.245 1.818 . . . . 0.0 111.815 172.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 8.0 mt -58.53 120.99 49.64 Favored Pre-proline 0 CA--C 1.543 0.71 0 C-N-CA 126.056 1.742 . . . . 0.0 111.082 178.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 44.4 Cg_exo -57.74 -38.46 92.95 Favored 'Trans proline' 0 CA--C 1.536 0.58 0 C-N-CA 122.805 2.337 . . . . 0.0 112.002 177.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 59.5 m80 -73.05 -33.56 65.76 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.584 1.154 . . . . 0.0 113.623 179.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 45.3 t -67.4 -50.81 57.98 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.41 1.084 . . . . 0.0 108.389 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -55.82 -37.53 68.8 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.418 1.487 . . . . 0.0 111.433 173.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.3 m -67.96 -60.08 2.78 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.289 1.035 . . . . 0.0 111.241 176.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.8 mmt -62.17 -35.13 77.87 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -64.7 -32.52 74.23 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 120.922 1.692 . . . . 0.0 112.567 177.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.5 m-80 -72.87 -38.62 66.94 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.173 0.589 . . . . 0.0 110.592 174.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 58.1 t -63.76 -47.17 92.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-N 118.597 0.635 . . . . 0.0 110.558 176.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -44.94 86.22 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.54 0.736 . . . . 0.0 110.864 178.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -66.77 -17.66 64.98 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 176.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.7 t60 -90.04 -49.08 6.79 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.021 0.928 . . . . 0.0 109.951 173.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.1 ttp -56.47 -28.45 59.74 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.579 1.951 . . . . 0.0 113.258 -178.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 14.7 p -67.91 -29.4 68.47 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.383 1.073 . . . . 0.0 112.814 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -97.85 -28.9 13.64 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.645 1.578 . . . . 0.0 112.532 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.6 t -63.77 133.71 53.98 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.94 1.296 . . . . 0.0 112.966 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -109.25 -11.94 14.83 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.42 1.488 . . . . 0.0 113.833 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.53 -29.95 20.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.883 0.873 . . . . 0.0 111.409 178.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.41 -112.78 2.88 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.507 1.051 . . . . 0.0 112.963 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 59.5 tttm -60.86 -20.48 61.93 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.44 -1.035 . . . . 0.0 112.855 177.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -93.28 -2.64 54.79 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.955 1.302 . . . . 0.0 113.47 176.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 22.7 t -59.87 142.91 52.67 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 122.384 1.088 . . . . 0.0 110.277 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -78.81 -5.74 54.17 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.463 1.105 . . . . 0.0 113.488 -176.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 6.7 t -96.98 123.55 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.821 1.248 . . . . 0.0 108.715 175.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.28 -45.12 72.42 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -176.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -30.6 71.06 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 -178.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 54.0 t -72.27 -56.37 5.63 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.164 0.986 . . . . 0.0 109.738 178.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.73 -26.44 63.95 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 177.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 46.1 m -80.56 -45.31 17.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.819 0.847 . . . . 0.0 111.586 176.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 63.7 m -64.99 -34.55 78.71 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.316 1.046 . . . . 0.0 112.741 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.55 -30.86 70.92 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.332 -0.855 . . . . 0.0 111.879 176.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -68.41 -31.18 70.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.565 0.746 . . . . 0.0 111.764 177.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.3 mm -70.39 -45.6 74.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 30.1 mm -62.49 -39.35 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 124.887 1.275 . . . . 0.0 110.429 177.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 16.5 t -59.66 -29.95 68.41 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.413 1.085 . . . . 0.0 112.717 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.5 t60 -60.06 -51.76 68.24 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.146 0.884 . . . . 0.0 110.486 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 24.8 m95 -64.74 -24.52 67.59 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 14.2 mptt -75.91 -30.4 58.76 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.586 0.754 . . . . 0.0 112.509 176.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -100.04 -34.75 9.95 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -178.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.1 t -79.27 131.29 36.11 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.992 1.317 . . . . 0.0 112.924 -176.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.0 p -130.05 -3.88 4.51 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.815 1.646 . . . . 0.0 114.209 -178.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -82.44 141.76 32.47 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.551 1.54 . . . . 0.0 111.842 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 47.7 p-80 -77.45 -40.56 42.82 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.88 -0.513 . . . . 0.0 111.993 177.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.2 t70 -87.0 69.98 10.27 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.045 1.738 . . . . 0.0 111.518 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 41.9 t -121.34 133.55 24.24 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.305 1.842 . . . . 0.0 109.347 178.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -59.66 -24.0 73.71 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.608 2.205 . . . . 0.0 113.572 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 15.8 t -92.12 -54.97 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 119.268 0.94 . . . . 0.0 111.637 176.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 17.0 m -69.22 -35.29 76.03 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -174.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -57.08 -56.89 28.78 Favored Pre-proline 0 CA--C 1.548 0.889 0 CA-C-N 120.01 1.277 . . . . 0.0 112.629 -178.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -60.21 -32.8 94.89 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 121.84 1.693 . . . . 0.0 113.161 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.2 mt -68.7 -47.85 65.38 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 118.798 0.727 . . . . 0.0 111.929 178.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -59.65 -37.1 77.79 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.034 0.533 . . . . 0.0 111.772 176.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 14.0 t30 -70.46 -40.75 73.5 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.611 1.564 . . . . 0.0 112.33 177.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -79.97 -25.98 40.16 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 45.4 t -49.5 142.02 8.49 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.273 1.429 . . . . 0.0 113.969 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -74.73 -6.41 48.66 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.492 -0.755 . . . . 0.0 112.714 176.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -96.34 -2.25 46.14 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.61 1.564 . . . . 0.0 113.049 176.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 12.1 ptp180 . . . . . 0 N--CA 1.48 1.06 0 C-N-CA 127.184 2.194 . . . . 0.0 113.714 -178.998 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.51 0 N-CA-C 114.728 0.651 . . . . 0.0 114.728 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.0 m -73.87 -11.55 60.4 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.178 1.391 . . . . 0.0 114.202 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 28.7 p80 -144.64 169.2 18.44 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.458 1.903 . . . . 0.0 111.751 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 28.6 ptm -64.73 159.09 23.01 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.7 1.2 . . . . 0.0 113.771 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -138.23 156.97 47.18 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.839 1.656 . . . . 0.0 111.313 178.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -137.83 155.53 74.81 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 125.263 1.425 . . . . 0.0 111.799 179.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -58.72 150.04 73.16 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.537 2.824 . . . . 0.0 114.355 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -90.2 -3.97 57.52 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.62 1.168 . . . . 0.0 113.494 178.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 36.4 p -75.97 163.0 27.61 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.751 1.62 . . . . 0.0 112.811 178.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 12.1 t70 -126.74 124.83 24.23 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.922 1.289 . . . . 0.0 110.933 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -82.38 -14.12 9.51 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.971 3.114 . . . . 0.0 115.191 -177.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 18.9 m -79.52 -0.6 34.01 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.861 1.264 . . . . 0.0 113.818 -179.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 14.8 p -143.18 153.49 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 126.986 2.114 . . . . 0.0 109.661 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -128.8 87.32 55.06 Favored Pre-proline 0 N--CA 1.47 0.562 0 C-N-CA 123.845 0.858 . . . . 0.0 111.827 177.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -106.85 63.89 0.02 OUTLIER 'Trans proline' 0 CA--C 1.557 1.644 1 C-N-CA 126.068 4.512 . . . . 0.0 110.229 176.302 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -67.24 163.18 35.35 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.082 2.521 . . . . 0.0 114.723 -175.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.48 145.87 46.82 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.926 1.69 . . . . 0.0 111.515 175.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 52.6 m -66.61 125.69 26.58 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.037 0.935 . . . . 0.0 109.824 176.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -51.01 -33.25 24.19 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.617 1.71 . . . . 0.0 115.617 -173.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -74.1 -9.67 58.85 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 28.9 m -62.4 -57.35 11.59 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.161 -0.962 . . . . 0.0 111.132 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -60.13 -24.92 65.07 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.786 0.835 . . . . 0.0 112.737 176.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 11.2 m -70.19 -35.99 74.33 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.119 0.872 . . . . 0.0 113.104 179.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.8 t70 -90.18 -27.91 19.24 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.69 0.796 . . . . 0.0 112.818 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.8 tt -43.09 -58.4 2.47 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 126.919 2.088 . . . . 0.0 113.685 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 52.9 p-90 -70.18 -10.42 58.79 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -173.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 9.3 ptmm? -112.19 -59.91 1.93 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.251 1.945 . . . . 0.0 116.251 -175.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 59.1 mt -119.45 17.31 12.96 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 116.165 1.913 . . . . 0.0 116.165 -171.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.1 tt -54.82 138.36 63.39 Favored Pre-proline 0 CA--C 1.554 1.113 0 C-N-CA 126.154 1.781 . . . . 0.0 113.536 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.94 166.26 28.38 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 124.501 3.467 . . . . 0.0 114.186 -178.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.68 -27.13 25.98 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.598 2.073 . . . . 0.0 116.598 -177.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -116.58 137.38 52.22 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.78 1.232 . . . . 0.0 111.626 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -150.43 166.09 31.17 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.321 1.048 . . . . 0.0 112.502 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 27.4 m -116.65 -10.53 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 125.894 1.678 . . . . 0.0 114.919 -178.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 44.7 tp -87.32 -5.57 58.85 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.354 1.462 . . . . 0.0 113.236 -179.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 14.3 m -50.41 108.2 0.97 Allowed Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 127.482 2.313 . . . . 0.0 114.606 -177.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -64.4 119.73 6.84 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.4 2.733 . . . . 0.0 111.409 178.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 26.6 tp -74.48 127.58 87.25 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 124.745 1.218 . . . . 0.0 111.772 -178.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -52.1 -36.0 64.2 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 123.632 2.888 . . . . 0.0 114.641 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 12.9 m -65.63 -14.8 61.93 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.958 1.303 . . . . 0.0 114.149 178.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -129.47 13.7 6.02 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.58 1.952 . . . . 0.0 112.181 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -73.66 159.42 33.06 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 -175.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.45 9.54 20.5 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 128.533 2.733 . . . . 0.0 113.852 179.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -57.75 -15.37 7.82 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 -176.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -63.63 -20.79 65.97 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.234 1.014 . . . . 0.0 112.496 174.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 22.7 tp -113.81 19.15 16.89 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 127.631 2.373 . . . . 0.0 111.701 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 7.8 tpt -64.35 146.22 54.78 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 18.2 tp -125.02 151.5 45.5 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.032 2.133 . . . . 0.0 113.047 -174.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 62.0 m -82.87 145.18 49.42 Favored Pre-proline 0 N--CA 1.476 0.84 0 C-N-CA 123.501 0.72 . . . . 0.0 110.493 174.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.47 -30.58 74.39 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.839 2.359 . . . . 0.0 115.734 -177.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.47 -22.31 66.14 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 178.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -87.98 -10.06 51.58 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.568 1.147 . . . . 0.0 113.673 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 96.6 mt -58.43 -34.49 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 CA-C-N 119.29 0.95 . . . . 0.0 109.776 175.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -66.85 -9.9 42.5 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.432 1.893 . . . . 0.0 114.058 177.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -87.51 -26.84 22.98 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.821 0.848 . . . . 0.0 112.361 178.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -98.31 -33.91 10.89 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.787 0.835 . . . . 0.0 112.336 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -109.85 109.82 20.59 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 169.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 1.7 m -125.05 145.17 50.04 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 -169.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -115.23 161.52 18.34 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.686 1.994 . . . . 0.0 111.2 175.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 26.5 t0 -64.87 118.22 46.56 Favored Pre-proline 0 CA--C 1.552 1.028 0 O-C-N 121.478 -0.764 . . . . 0.0 111.58 -179.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -81.05 -17.33 9.42 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 123.17 2.58 . . . . 0.0 114.352 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 127.06 -152.15 18.55 Favored Glycine 0 CA--C 1.543 1.806 0 C-N-CA 125.748 1.642 . . . . 0.0 112.696 -177.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -59.65 -24.92 77.3 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 123.947 3.098 . . . . 0.0 114.054 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -82.94 9.8 9.26 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 127.213 2.205 . . . . 0.0 114.297 -179.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -72.02 50.47 1.23 Allowed Glycine 0 CA--C 1.535 1.299 0 C-N-CA 126.41 1.957 . . . . 0.0 116.212 -178.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 22.6 p -65.6 -50.63 64.36 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.66 1.23 . . . . 0.0 111.272 177.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 99.2 m -68.57 -30.22 68.94 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.96 0.904 . . . . 0.0 111.543 175.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 54.7 t80 -58.11 -26.83 63.11 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -178.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -64.14 -53.64 46.38 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.334 -0.854 . . . . 0.0 110.092 174.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -62.47 -39.59 98.01 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 123.933 0.778 . . . . 0.0 113.501 178.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 48.1 p -74.78 -0.71 19.18 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -113.71 -37.44 4.56 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.481 1.512 . . . . 0.0 112.386 175.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 68.7 p -79.58 -26.8 41.21 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -165.05 52.64 0.28 Allowed Glycine 0 CA--C 1.536 1.39 0 N-CA-C 116.793 1.477 . . . . 0.0 116.793 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.23 -27.15 48.74 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.954 2.436 . . . . 0.0 112.919 177.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 6.6 t -72.55 -10.5 59.86 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.061 1.345 . . . . 0.0 114.176 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -73.43 -16.29 61.32 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 12.2 t70 -93.49 118.45 67.56 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 124.383 1.073 . . . . 0.0 111.547 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -73.08 -31.94 9.13 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.833 2.355 . . . . 0.0 113.506 -178.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -64.86 -40.08 94.57 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.269 -0.894 . . . . 0.0 110.979 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 92.8 mttt -58.21 -46.97 84.89 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 118.582 0.628 . . . . 0.0 110.54 174.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -57.96 -46.63 84.83 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.68 0.792 . . . . 0.0 111.534 176.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -60.47 -40.13 90.11 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.548 0.739 . . . . 0.0 111.393 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 71.6 mt -66.15 -40.61 90.69 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 117.916 -1.04 . . . . 0.0 111.961 177.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -62.45 -52.93 53.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 CA-C-N 120.038 1.29 . . . . 0.0 109.267 175.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -54.02 -54.01 45.03 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.014 0.925 . . . . 0.0 111.148 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -65.06 -36.17 83.48 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.379 -0.826 . . . . 0.0 112.58 -179.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -68.04 -45.45 73.9 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.039 0.836 . . . . 0.0 110.599 177.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.6 tt -62.6 -41.29 98.88 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.185 0.994 . . . . 0.0 110.516 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 99.5 t -60.17 -32.16 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 CA-C-N 119.269 0.94 . . . . 0.0 111.031 174.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.8 tp -69.98 -31.21 68.79 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.812 -1.18 . . . . 0.0 112.313 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.41 -28.36 69.2 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 120.325 1.42 . . . . 0.0 110.062 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 5.2 mt -72.89 -50.45 23.69 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.365 1.066 . . . . 0.0 109.579 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.0 t60 -57.25 -55.95 28.07 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 122.768 0.427 . . . . 0.0 110.313 176.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.01 -25.24 43.57 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.879 1.272 . . . . 0.0 114.429 -178.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -90.11 -31.35 17.15 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 175.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 41.6 mttm -83.91 -36.16 23.54 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.598 1.159 . . . . 0.0 112.122 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.3 t -61.27 -53.75 52.79 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.092 2.157 . . . . 0.0 110.948 177.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -55.75 -29.92 60.38 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.042 -1.036 . . . . 0.0 113.121 176.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 8.2 mpt_? -80.47 -24.68 39.32 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.748 1.619 . . . . 0.0 113.216 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -30.0 71.16 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 119.839 1.199 . . . . 0.0 112.9 179.092 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -73.25 -23.96 60.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.368 0.667 . . . . 0.0 111.873 175.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -77.31 -35.07 55.24 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.053 -1.029 . . . . 0.0 109.912 174.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -75.12 -33.8 61.61 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.205 1.002 . . . . 0.0 112.625 176.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -135.82 111.79 9.55 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.518 1.527 . . . . 0.0 111.656 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . -76.03 -6.24 82.15 Favored Glycine 0 CA--C 1.539 1.532 0 N-CA-C 115.591 0.997 . . . . 0.0 115.591 179.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -85.89 -9.73 56.47 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.207 1.503 . . . . 0.0 114.216 -178.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 33.4 m -106.31 162.89 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 124.92 1.288 . . . . 0.0 113.062 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -110.13 171.36 7.5 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.185 1.794 . . . . 0.0 111.424 178.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -69.71 162.57 27.48 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.565 1.146 . . . . 0.0 113.414 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.66 147.7 50.9 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.93 1.692 . . . . 0.0 113.932 -178.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 50.4 m -94.49 -7.47 41.2 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.1 1.36 . . . . 0.0 113.382 178.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 49.8 tp -78.24 114.23 40.65 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 126.378 1.871 . . . . 0.0 110.619 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -56.69 -35.83 97.85 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.962 2.441 . . . . 0.0 114.344 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 57.8 m80 -69.55 -34.21 73.86 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 178.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 33.2 t -66.92 -50.17 63.25 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.313 1.045 . . . . 0.0 108.748 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -54.69 -34.39 62.24 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.341 1.456 . . . . 0.0 111.91 174.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 26.2 m -72.82 -58.44 3.34 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.672 1.189 . . . . 0.0 111.607 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -37.58 82.46 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.549 -0.719 . . . . 0.0 112.603 -178.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -62.7 -34.44 77.14 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.424 1.466 . . . . 0.0 113.071 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -71.04 -39.69 72.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.061 0.544 . . . . 0.0 110.421 175.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 94.5 t -64.38 -46.57 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.361 0.664 . . . . 0.0 110.831 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.92 -42.29 93.62 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.124 0.969 . . . . 0.0 111.84 178.568 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -66.59 -30.64 70.98 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 55.8 t60 -77.78 -48.67 16.02 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.988 0.813 . . . . 0.0 110.213 175.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 35.7 ttp -56.42 -31.86 64.32 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.303 1.841 . . . . 0.0 114.199 -177.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.7 t -77.48 -10.13 59.3 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 119.805 1.184 . . . . 0.0 112.999 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 50.8 m80 -114.28 -18.99 11.46 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.797 1.639 . . . . 0.0 113.175 177.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 34.8 t -57.57 145.62 33.04 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.493 1.517 . . . . 0.0 112.879 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -109.41 -14.86 14.35 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.821 1.648 . . . . 0.0 113.648 -179.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -104.55 -30.16 10.19 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.465 1.106 . . . . 0.0 112.666 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.99 -110.66 1.59 Allowed Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.61 1.1 . . . . 0.0 113.822 177.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.32 -15.77 60.92 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 120.93 -1.335 . . . . 0.0 113.372 177.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -99.52 -0.21 41.07 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.937 1.695 . . . . 0.0 113.011 174.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 15.4 t -63.71 142.03 58.55 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.326 1.05 . . . . 0.0 110.033 178.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -81.58 -5.25 57.84 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.287 1.035 . . . . 0.0 113.489 -176.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.8 t -87.22 114.49 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 172.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.78 -39.41 65.4 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -176.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -67.78 -41.05 83.83 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.344 0.658 . . . . 0.0 112.585 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.9 t -62.12 -54.82 35.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.981 1.312 . . . . 0.0 110.198 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.6 -22.96 64.31 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.044 0.938 . . . . 0.0 113.078 177.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.4 m -82.01 -52.06 7.42 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.051 0.941 . . . . 0.0 111.939 176.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 41.7 m -61.05 -34.18 74.47 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 119.17 0.895 . . . . 0.0 112.056 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -60.04 -31.31 69.85 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.285 -0.885 . . . . 0.0 112.759 175.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -69.11 -30.7 69.04 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.707 1.14 . . . . 0.0 111.229 176.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 15.0 mt -74.27 -48.42 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.502 1.121 . . . . 0.0 109.929 176.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 25.8 mm -61.86 -37.47 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.939 0.895 . . . . 0.0 111.046 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 73.1 m -61.74 -24.83 67.06 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.395 -0.815 . . . . 0.0 112.869 176.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 10.0 t60 -64.91 -54.85 24.21 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.411 1.005 . . . . 0.0 109.963 176.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 46.3 m95 -62.05 -28.83 69.87 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 177.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -71.03 -29.93 65.99 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.784 0.834 . . . . 0.0 112.709 177.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -100.19 -40.85 7.36 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.2 t -77.76 135.45 38.0 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.472 1.509 . . . . 0.0 112.381 -177.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 3.8 t -130.11 2.76 4.77 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.542 1.537 . . . . 0.0 114.008 -179.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -78.25 153.49 31.82 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.207 1.403 . . . . 0.0 114.207 -177.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 80.6 t60 -86.89 -39.26 15.97 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.086 0.955 . . . . 0.0 109.859 170.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.7 t70 -93.71 78.59 4.25 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.654 1.582 . . . . 0.0 111.682 178.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.2 t -137.79 135.06 18.52 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 126.882 2.073 . . . . 0.0 108.887 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -58.56 -26.95 80.85 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 122.809 2.339 . . . . 0.0 114.799 -177.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 4.9 t -92.11 -50.68 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 119.653 1.115 . . . . 0.0 111.869 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.7 m -69.92 -39.21 76.29 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -175.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.5 tt -53.34 -57.7 15.73 Favored Pre-proline 0 N--CA 1.474 0.746 0 CA-C-O 117.588 -1.196 . . . . 0.0 112.781 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.62 -32.7 93.64 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-N 121.569 1.596 . . . . 0.0 113.424 -179.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.27 -46.8 63.62 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.636 1.107 . . . . 0.0 112.011 178.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -64.49 -30.52 71.55 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.346 1.059 . . . . 0.0 111.416 177.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 37.8 t30 -78.07 -41.58 34.97 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.797 1.639 . . . . 0.0 112.39 176.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -72.8 -29.55 63.35 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.761 1.224 . . . . 0.0 114.192 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 46.7 t -62.75 140.07 58.72 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 35.6 t70 -65.93 -16.63 64.04 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.688 1.195 . . . . 0.0 112.218 176.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -78.56 -6.07 54.51 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.314 1.446 . . . . 0.0 113.469 177.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 73.7 ttt-85 . . . . . 0 N--CA 1.479 0.994 0 C-N-CA 125.239 1.415 . . . . 0.0 111.758 179.711 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.438 0 N-CA-C 114.024 0.37 . . . . 0.0 114.024 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 p -73.69 -24.68 59.98 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.612 1.165 . . . . 0.0 114.049 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -148.58 149.33 31.37 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.152 1.781 . . . . 0.0 111.212 178.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 64.1 mtt -140.59 147.29 39.18 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.726 1.61 . . . . 0.0 110.573 178.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -148.07 147.04 29.12 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.962 1.305 . . . . 0.0 111.226 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -143.54 135.27 12.93 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.203 1.401 . . . . 0.0 110.585 179.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -74.37 6.41 3.13 Favored 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 124.159 3.239 . . . . 0.0 115.367 -178.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 35.5 tp60 -70.89 -22.89 62.22 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.789 1.236 . . . . 0.0 113.611 -179.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 78.5 p -75.82 159.72 30.71 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.527 1.131 . . . . 0.0 113.269 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 16.1 t70 -141.28 129.15 12.08 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 124.926 1.29 . . . . 0.0 111.373 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -85.17 -17.38 4.62 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.529 2.82 . . . . 0.0 114.903 -178.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 26.1 m -81.59 -27.47 34.25 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -176.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 12.2 p -73.42 139.41 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.956 0.902 . . . . 0.0 111.816 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -133.89 86.49 37.97 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.936 1.295 . . . . 0.0 111.098 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -57.57 -42.54 59.69 Favored 'Trans proline' 0 CA--C 1.55 1.294 0 C-N-CA 123.716 2.944 . . . . 0.0 117.267 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -75.46 166.96 27.61 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 122.653 2.235 . . . . 0.0 114.163 -177.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 15.7 tp -70.09 143.66 52.35 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.476 1.11 . . . . 0.0 111.55 177.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 54.7 m -69.15 127.98 35.01 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 174.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -58.5 -24.76 61.28 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -175.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -75.44 -10.87 59.83 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 177.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 76.8 m -58.77 -60.04 4.46 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.931 0.892 . . . . 0.0 111.848 -177.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -60.21 -24.82 65.12 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 9.1 t -75.63 -31.05 59.7 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.897 0.879 . . . . 0.0 112.359 178.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.9 t70 -90.02 -28.07 19.32 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.001 0.92 . . . . 0.0 112.319 175.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.9 tt -46.49 -59.02 3.24 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 126.993 2.117 . . . . 0.0 112.847 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.6 p-90 -69.69 -9.24 53.6 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.021 1.489 . . . . 0.0 115.021 -173.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -112.0 -56.25 2.41 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -177.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 50.1 mt -120.14 15.86 12.36 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -172.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.2 tt -52.84 137.4 45.03 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 126.07 1.748 . . . . 0.0 114.891 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -71.15 171.99 14.86 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 124.487 3.458 . . . . 0.0 113.344 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -65.68 -4.22 5.98 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 116.693 2.109 . . . . 0.0 116.693 -177.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 53.5 t30 -141.64 146.75 36.54 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.68 1.192 . . . . 0.0 111.616 178.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -150.29 154.68 38.29 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.768 1.227 . . . . 0.0 111.792 177.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 18.1 t -90.27 -26.44 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 124.383 1.073 . . . . 0.0 112.664 -179.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 61.2 tp -89.24 0.82 56.47 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.272 1.429 . . . . 0.0 114.325 -177.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 49.7 m -48.69 109.29 1.14 Allowed Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 125.461 1.505 . . . . 0.0 113.474 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -63.0 123.07 11.59 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 123.48 2.787 . . . . 0.0 112.185 -178.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 87.4 mt -81.57 128.92 67.81 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 124.379 1.072 . . . . 0.0 112.184 -177.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -53.14 -32.75 60.96 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.844 3.029 . . . . 0.0 115.113 179.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 8.2 t -69.24 -18.37 63.87 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.59 1.156 . . . . 0.0 113.56 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -131.37 26.79 4.79 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.14 1.776 . . . . 0.0 111.681 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -77.42 160.64 28.58 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 -176.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.89 18.69 8.63 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 128.287 2.635 . . . . 0.0 113.225 179.034 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -66.87 -16.37 64.26 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.234 1.414 . . . . 0.0 114.712 -177.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.3 -16.14 64.1 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 121.161 -0.962 . . . . 0.0 112.626 177.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 23.9 tp -116.75 19.23 14.59 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 127.145 2.178 . . . . 0.0 111.756 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 8.0 tpt -71.73 151.77 43.32 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 115.923 1.823 . . . . 0.0 115.923 -175.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 91.3 mt -125.03 162.98 23.36 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.061 2.144 . . . . 0.0 113.709 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 31.2 t -83.67 144.83 46.21 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 169.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -56.86 -20.32 35.49 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.248 1.965 . . . . 0.0 114.718 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -69.04 -25.08 64.3 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.863 0.865 . . . . 0.0 112.76 177.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.3 t70 -83.76 -12.76 55.3 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 80.3 mt -56.18 -36.39 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 124.571 1.148 . . . . 0.0 110.465 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -66.01 -10.0 35.68 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.014 1.326 . . . . 0.0 113.863 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 20.8 tp60 -84.64 -29.6 25.59 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.104 -0.998 . . . . 0.0 112.596 177.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 3.2 p-90 -96.17 -35.06 11.44 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.735 0.814 . . . . 0.0 111.907 176.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 13.9 m-30 -110.78 109.57 19.85 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 104.749 -2.315 . . . . 0.0 104.749 169.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 3.7 m -125.06 140.82 52.56 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -172.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -103.67 163.17 12.49 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.687 1.595 . . . . 0.0 111.638 176.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 22.8 t0 -61.16 114.99 12.17 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.074 0.95 . . . . 0.0 112.553 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -87.41 -2.54 7.69 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.775 2.983 . . . . 0.0 113.85 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 79.82 -176.29 54.73 Favored Glycine 0 CA--C 1.544 1.866 0 C-N-CA 124.619 1.104 . . . . 0.0 113.183 -176.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.85 -21.45 57.66 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.535 2.823 . . . . 0.0 114.131 -178.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 36.0 t70 -78.0 -19.55 54.24 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.259 1.024 . . . . 0.0 113.149 178.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -80.77 68.09 3.45 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 125.08 1.324 . . . . 0.0 113.161 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 78.9 p -63.69 -1.02 1.14 Allowed 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 116.466 2.025 . . . . 0.0 116.466 -178.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 60.8 m -67.92 13.81 0.07 Allowed 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 127.584 2.354 . . . . 0.0 115.053 178.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -49.57 -32.98 13.79 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.161 1.785 . . . . 0.0 114.907 -177.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 25.7 m120 -61.48 -25.95 67.58 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.201 -0.937 . . . . 0.0 112.934 178.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -97.01 -23.94 13.98 Favored Glycine 0 CA--C 1.538 1.481 0 C-N-CA 124.967 1.27 . . . . 0.0 114.315 177.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 69.3 p -96.43 -19.94 18.8 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -178.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -66.9 159.44 28.34 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.467 1.107 . . . . 0.0 113.572 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 14.5 t -65.58 146.43 54.84 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.02 0.928 . . . . 0.0 112.268 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 139.79 -79.33 0.29 Allowed Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.214 1.387 . . . . 0.0 110.679 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -62.87 -23.06 74.26 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 123.0 2.467 . . . . 0.0 111.753 176.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 28.4 p -60.32 -21.55 62.15 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.466 1.907 . . . . 0.0 113.679 176.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -87.55 -4.69 58.97 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.974 1.31 . . . . 0.0 113.618 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 12.4 t70 -70.13 138.42 87.18 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 124.177 0.991 . . . . 0.0 111.49 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -57.89 -31.02 91.52 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.653 2.235 . . . . 0.0 113.661 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -64.33 -37.19 86.63 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.459 1.027 . . . . 0.0 111.468 176.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -65.36 -41.45 93.84 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.431 -0.793 . . . . 0.0 110.945 175.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -63.3 -42.35 99.04 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.652 0.66 . . . . 0.0 110.474 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -62.07 -33.4 74.33 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.213 1.005 . . . . 0.0 112.497 176.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 71.5 mt -64.27 -41.31 96.99 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 120.1 1.318 . . . . 0.0 111.451 175.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.8 mt -64.7 -51.47 66.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.054 0.541 . . . . 0.0 109.736 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -55.35 -55.16 34.69 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.396 1.078 . . . . 0.0 111.299 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -34.42 77.79 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -177.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -68.91 -44.84 72.34 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.103 0.865 . . . . 0.0 110.52 176.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 7.6 tp -62.65 -39.69 94.69 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.609 0.641 . . . . 0.0 110.896 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 58.0 t -60.29 -32.21 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 CA-C-N 119.449 1.022 . . . . 0.0 110.95 175.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 9.3 tp -71.37 -31.71 67.64 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 120.793 -1.192 . . . . 0.0 112.138 175.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.61 -28.91 69.7 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 120.211 1.369 . . . . 0.0 109.938 174.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.9 mt -72.55 -52.9 13.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.707 0.803 . . . . 0.0 109.584 175.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.0 t60 -55.02 -54.39 43.67 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 122.902 0.481 . . . . 0.0 110.531 177.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -57.22 -25.3 58.86 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -178.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -90.01 -31.42 17.21 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.467 1.031 . . . . 0.0 113.323 175.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 76.9 mttt -80.54 -39.59 27.5 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.4 1.48 . . . . 0.0 112.231 179.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 51.9 t -62.76 -51.25 67.86 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 127.635 2.374 . . . . 0.0 112.048 178.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -55.32 -27.7 48.75 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -80.39 -15.85 55.85 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.36 -37.01 80.05 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 119.978 1.263 . . . . 0.0 112.516 179.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -64.13 -40.88 97.11 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.945 0.898 . . . . 0.0 110.388 177.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -70.12 -39.39 75.49 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.054 0.942 . . . . 0.0 111.865 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -68.07 -41.2 82.29 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.027 0.931 . . . . 0.0 112.963 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -83.55 -42.22 17.05 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.216 1.006 . . . . 0.0 112.985 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 77.07 1.87 75.71 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 116.694 1.438 . . . . 0.0 116.694 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -128.71 -45.11 1.32 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.803 1.801 . . . . 0.0 113.809 -178.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 17.7 m -78.15 148.77 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 CA-C-N 119.12 0.873 . . . . 0.0 113.124 -179.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -76.1 164.77 25.79 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.542 1.137 . . . . 0.0 113.51 178.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -79.76 175.6 10.48 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 124.833 1.253 . . . . 0.0 111.601 174.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -51.3 149.53 3.97 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.967 1.707 . . . . 0.0 115.481 -178.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 76.4 p -100.01 -8.27 24.07 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.251 1.821 . . . . 0.0 112.526 175.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 36.1 tp -69.58 115.41 32.63 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 127.086 2.154 . . . . 0.0 109.578 178.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -59.47 -34.28 97.17 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.737 2.291 . . . . 0.0 114.039 -176.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 45.0 m80 -68.78 -37.06 79.04 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 121.395 -0.816 . . . . 0.0 112.392 177.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 36.0 t -66.09 -50.15 65.07 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.74 1.216 . . . . 0.0 108.948 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -54.99 -34.66 63.6 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.264 1.426 . . . . 0.0 111.824 174.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.8 m -71.83 -59.56 2.69 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.526 1.13 . . . . 0.0 111.446 176.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.46 -37.79 79.1 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.771 -0.633 . . . . 0.0 112.522 -178.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -63.83 -34.34 77.71 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 120.505 1.502 . . . . 0.0 113.1 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -71.17 -37.66 72.19 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.011 0.524 . . . . 0.0 110.519 175.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 91.6 t -65.67 -47.04 87.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 122.934 0.493 . . . . 0.0 110.623 176.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.78 -43.38 85.51 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.784 0.833 . . . . 0.0 111.156 178.12 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 33.7 m-80 -68.22 -17.64 64.36 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 176.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 62.7 t60 -90.11 -47.81 7.58 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.815 0.846 . . . . 0.0 109.497 173.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -57.28 -28.44 63.01 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.339 1.856 . . . . 0.0 113.293 -178.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 7.5 p -66.88 -27.05 67.2 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.488 1.115 . . . . 0.0 112.542 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 68.8 m80 -102.51 -22.2 14.07 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.059 1.744 . . . . 0.0 113.443 178.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 19.4 t -64.18 142.86 58.26 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.442 1.497 . . . . 0.0 112.692 -179.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -117.72 -12.77 10.22 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.651 1.58 . . . . 0.0 113.814 -179.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -91.44 -27.59 18.2 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.976 0.91 . . . . 0.0 112.058 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 55.69 -114.16 4.58 Favored Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.219 0.914 . . . . 0.0 112.605 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 82.2 tttt -62.18 -20.49 64.2 Favored 'General case' 0 N--CA 1.479 0.994 0 O-C-N 121.316 -1.109 . . . . 0.0 112.803 177.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.5 -1.96 57.36 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.917 1.287 . . . . 0.0 113.466 176.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 17.5 t -63.64 141.96 58.57 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 122.058 0.932 . . . . 0.0 109.599 177.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -80.54 -3.9 51.91 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -175.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 96.5 t -91.67 115.01 29.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 172.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.89 -39.51 68.81 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -176.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -65.84 -38.89 90.09 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.675 0.79 . . . . 0.0 112.517 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 40.7 t -66.69 -55.06 16.88 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.382 1.473 . . . . 0.0 110.163 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.72 -26.12 63.61 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.005 0.922 . . . . 0.0 113.393 177.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.4 m -81.93 -46.49 13.97 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 124.214 1.006 . . . . 0.0 111.535 175.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 66.8 m -61.98 -36.05 80.31 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.375 1.07 . . . . 0.0 112.284 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -61.16 -31.98 71.71 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.747 0.819 . . . . 0.0 112.16 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -68.91 -29.68 68.0 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.4 0.68 . . . . 0.0 111.714 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.1 mm -71.17 -46.74 64.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 18.9 mm -60.99 -38.45 79.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 124.96 1.304 . . . . 0.0 110.974 177.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 70.5 m -62.15 -21.91 65.44 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.283 1.033 . . . . 0.0 113.271 177.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.2 t60 -65.28 -60.21 3.23 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.474 1.034 . . . . 0.0 110.683 178.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 52.6 m95 -60.15 -24.13 64.46 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 177.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 61.8 mtpt -74.53 -35.95 63.15 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.95 0.9 . . . . 0.0 112.748 178.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.03 -32.72 10.81 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 8.9 t -82.29 132.92 35.22 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.522 1.529 . . . . 0.0 110.979 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.2 p -129.98 0.47 4.76 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.352 1.461 . . . . 0.0 114.427 -177.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -80.09 151.95 29.58 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.831 1.252 . . . . 0.0 113.093 -178.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 40.6 p-80 -86.41 -29.22 23.04 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.694 0.798 . . . . 0.0 111.444 173.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.8 t0 -100.27 70.05 1.5 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.46 1.904 . . . . 0.0 111.511 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 41.7 t -127.88 135.18 27.1 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 126.615 1.966 . . . . 0.0 109.22 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -58.56 -25.08 72.98 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 122.814 2.343 . . . . 0.0 114.204 -178.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.2 t -92.19 -52.49 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 119.682 1.128 . . . . 0.0 111.732 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 10.4 m -68.76 -40.25 79.85 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -175.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -53.42 -57.95 14.83 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-O 117.414 -1.279 . . . . 0.0 112.866 -178.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -59.93 -34.11 95.4 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 121.918 1.745 . . . . 0.0 113.565 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.5 mt -70.24 -47.13 62.74 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.977 0.808 . . . . 0.0 111.924 178.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -64.6 -34.75 79.0 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.982 0.913 . . . . 0.0 110.886 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.8 t30 -70.12 -43.15 71.6 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.254 1.421 . . . . 0.0 111.77 176.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -69.29 -32.27 71.31 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.939 0.896 . . . . 0.0 112.46 178.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 23.2 t -67.76 112.35 4.79 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.439 1.096 . . . . 0.0 112.458 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 36.1 t70 -73.58 -8.29 55.36 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.83 0.852 . . . . 0.0 112.4 177.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -77.72 -7.17 56.14 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 126.674 1.99 . . . . 0.0 112.889 179.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 9.7 ptm85 . . . . . 0 N--CA 1.477 0.884 0 C-N-CA 126.582 1.953 . . . . 0.0 114.021 -179.923 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.37 0 N-CA-C 114.622 0.609 . . . . 0.0 114.622 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.0 p -57.06 -28.92 63.0 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.486 1.514 . . . . 0.0 114.03 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 29.9 p80 -97.69 2.33 49.58 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.405 1.882 . . . . 0.0 113.687 177.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 89.3 mtp -114.99 -34.72 4.98 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.684 1.594 . . . . 0.0 112.769 -178.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -72.35 143.88 48.47 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.565 1.146 . . . . 0.0 111.963 179.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -143.81 135.7 13.03 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 124.915 1.286 . . . . 0.0 111.067 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -71.32 164.19 36.56 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.401 2.734 . . . . 0.0 113.146 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -125.01 153.43 42.83 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.335 1.454 . . . . 0.0 112.074 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 34.0 m -71.18 159.51 34.52 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.104 1.361 . . . . 0.0 113.317 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 15.6 t70 -132.71 129.54 21.32 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.468 1.507 . . . . 0.0 111.279 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -84.51 -14.19 6.84 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.599 2.866 . . . . 0.0 115.324 -177.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 11.7 t -78.5 -38.38 40.91 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.113 0.965 . . . . 0.0 113.072 -178.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 7.6 p -75.93 146.49 9.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 124.33 1.052 . . . . 0.0 111.734 178.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -134.28 147.09 62.25 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.061 1.344 . . . . 0.0 110.887 179.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -55.42 -48.5 20.22 Favored 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 123.121 2.547 . . . . 0.0 116.478 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -72.88 150.91 50.19 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.263 1.975 . . . . 0.0 112.608 -179.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 4.9 tt -64.19 139.83 58.81 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.78 1.232 . . . . 0.0 111.796 177.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 47.1 t -77.28 148.57 35.66 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.229 1.012 . . . . 0.0 112.042 178.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -59.24 -26.92 65.31 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.47 0.708 . . . . 0.0 112.477 177.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -88.4 -7.99 55.73 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 90.5 m -62.27 -54.52 39.46 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.569 1.077 . . . . 0.0 110.832 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -60.08 -27.49 67.04 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.619 0.767 . . . . 0.0 112.967 176.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 24.2 m -68.01 -34.72 77.05 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.611 0.764 . . . . 0.0 112.663 178.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.31 -28.73 18.56 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 174.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 2.6 tt -43.24 -60.06 1.83 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.4 1.88 . . . . 0.0 113.318 -177.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 50.1 p-90 -63.0 -12.49 26.25 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -173.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 16.1 pttp -111.94 -50.25 2.93 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -177.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 66.2 mt -120.08 20.44 12.09 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 117.203 2.297 . . . . 0.0 117.203 -169.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 12.4 tp -51.74 138.96 31.61 Favored Pre-proline 0 CA--C 1.551 1.019 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -173.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -76.57 155.06 35.66 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.394 2.729 . . . . 0.0 111.468 176.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -68.42 -14.99 63.39 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.691 1.737 . . . . 0.0 115.691 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 1.1 t30 -81.13 66.85 6.83 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.83 1.252 . . . . 0.0 110.856 178.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -131.83 132.95 44.15 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.061 1.344 . . . . 0.0 112.883 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 35.7 m -138.81 9.76 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 125.895 1.678 . . . . 0.0 114.042 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 7.9 tt -77.42 -11.02 59.8 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -177.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 1.8 p -54.84 124.92 53.51 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 124.459 1.103 . . . . 0.0 112.366 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -67.28 146.81 76.88 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.987 2.458 . . . . 0.0 111.748 179.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 30.2 tp -66.32 127.25 93.17 Favored Pre-proline 0 CA--C 1.546 0.823 0 CA-C-O 117.923 -1.037 . . . . 0.0 110.714 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -51.62 -35.05 55.48 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.603 2.868 . . . . 0.0 114.784 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 15.0 m -65.23 -16.2 63.28 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.846 1.258 . . . . 0.0 113.959 178.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -129.58 14.7 5.99 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.645 1.978 . . . . 0.0 112.375 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.03 162.35 29.58 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 122.666 1.222 . . . . 0.0 113.9 -178.052 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.84 17.05 1.61 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.324 2.249 . . . . 0.0 113.721 178.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -64.24 -11.15 28.6 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.504 1.522 . . . . 0.0 114.836 -178.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.2 t70 -65.0 -19.2 65.88 Favored 'General case' 0 CA--C 1.548 0.896 0 O-C-N 121.075 -1.015 . . . . 0.0 112.081 174.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 93.0 mt -108.64 13.47 25.16 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.716 2.006 . . . . 0.0 112.904 178.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.39 149.51 44.25 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.844 -1.16 . . . . 0.0 113.356 -177.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.14 179.66 4.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.31 1.844 . . . . 0.0 114.242 -175.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 6.1 p -79.92 160.13 69.55 Favored Pre-proline 0 CA--C 1.545 0.769 0 O-C-N 121.464 -0.773 . . . . 0.0 109.452 169.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.37 -15.16 47.1 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 121.725 1.617 . . . . 0.0 113.009 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -85.61 -28.86 24.53 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.346 1.058 . . . . 0.0 111.452 176.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -67.71 -21.0 65.33 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.674 0.79 . . . . 0.0 112.243 177.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 97.2 mt -57.43 -35.84 50.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.993 0.917 . . . . 0.0 109.678 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -72.86 -10.0 59.31 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 179.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -78.24 -30.46 48.73 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.052 -1.03 . . . . 0.0 111.336 175.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 7.4 p-90 -99.54 -20.06 16.58 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 177.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -129.69 109.82 11.29 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 169.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 6.0 t -125.21 175.47 7.39 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.407 1.083 . . . . 0.0 113.62 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -116.44 -179.95 3.82 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.993 2.517 . . . . 0.0 109.969 176.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 9.8 t70 -59.22 120.93 52.01 Favored Pre-proline 0 CA--C 1.556 1.201 0 O-C-N 120.601 -1.312 . . . . 0.0 110.536 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -81.2 -13.4 11.25 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.448 2.765 . . . . 0.0 115.709 -175.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 62.51 -162.24 29.66 Favored Glycine 0 CA--C 1.544 1.895 0 CA-C-N 118.983 0.811 . . . . 0.0 113.14 -176.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -76.05 -19.44 15.72 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 123.337 2.691 . . . . 0.0 113.836 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -88.68 -33.75 17.45 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 -177.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -85.75 27.91 5.16 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 124.968 1.271 . . . . 0.0 114.916 -179.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 65.1 p -50.28 -29.82 10.51 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 -176.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 76.6 m -54.9 -26.06 33.32 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.14 1.376 . . . . 0.0 113.711 177.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -60.62 -25.99 66.68 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.357 -0.84 . . . . 0.0 113.13 178.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 26.3 p30 -66.02 -15.57 63.15 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 119.507 1.049 . . . . 0.0 113.448 177.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -94.45 0.68 65.92 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.873 1.702 . . . . 0.0 114.438 177.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 6.2 t -139.78 -37.92 0.48 Allowed 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 118.855 1.328 . . . . 0.0 114.091 -178.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -79.85 34.33 0.28 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.146 1.378 . . . . 0.0 114.134 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 5.9 m -62.1 -34.08 75.65 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.573 1.549 . . . . 0.0 112.829 -178.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 170.17 74.9 0.04 OUTLIER Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.745 1.164 . . . . 0.0 112.644 178.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -54.13 -27.74 47.85 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.16 3.24 . . . . 0.0 116.476 -177.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 21.9 p -86.88 -32.0 20.46 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.44 1.096 . . . . 0.0 112.652 178.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -80.58 -30.66 36.94 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.346 1.458 . . . . 0.0 112.581 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 16.8 t70 -76.34 121.28 84.62 Favored Pre-proline 0 CA--C 1.549 0.904 0 C-N-CA 124.963 1.305 . . . . 0.0 109.884 176.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -59.1 -40.97 65.3 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.395 2.063 . . . . 0.0 114.852 -176.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -66.69 -46.32 76.01 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 121.361 -0.837 . . . . 0.0 111.517 -179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 81.0 mttt -63.77 -39.85 95.26 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 117.792 -1.099 . . . . 0.0 112.021 177.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 10.5 ptt-85 -64.52 -35.97 82.69 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.641 1.564 . . . . 0.0 111.655 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -63.07 -38.39 91.01 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.171 0.896 . . . . 0.0 111.267 173.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 97.6 mt -63.69 -38.88 92.79 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.714 0.688 . . . . 0.0 111.198 176.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -68.05 -51.96 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 118.928 0.785 . . . . 0.0 109.851 175.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -52.89 -53.64 46.19 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.226 1.01 . . . . 0.0 111.373 179.108 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -38.06 88.14 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 119.282 0.946 . . . . 0.0 112.503 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -70.13 -45.91 65.85 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.681 0.673 . . . . 0.0 111.119 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.0 tt -63.05 -43.05 99.71 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.587 0.755 . . . . 0.0 109.948 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 61.9 t -63.94 -24.34 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 120.737 -1.227 . . . . 0.0 111.131 174.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.44 -31.25 57.74 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.292 -1.505 . . . . 0.0 111.612 173.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.7 mp -59.86 -41.65 91.93 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 169.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.3 mp -67.26 -47.46 70.65 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 117.704 -1.141 . . . . 0.0 111.997 176.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 30.2 t60 -55.06 -55.01 35.84 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.746 1.157 . . . . 0.0 108.719 176.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.38 -45.92 66.0 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.147 0.979 . . . . 0.0 113.27 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -69.43 -39.26 77.94 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.513 -0.742 . . . . 0.0 112.817 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 49.1 mttp -74.9 -32.8 61.92 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.007 -1.058 . . . . 0.0 111.736 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 8.3 t -68.52 -42.14 78.93 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.253 1.821 . . . . 0.0 109.424 173.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -58.39 -43.89 88.7 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.232 1.413 . . . . 0.0 110.056 172.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 3.4 mmp_? -66.89 -36.05 81.41 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.312 -0.868 . . . . 0.0 112.549 175.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -35.6 72.81 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.706 1.203 . . . . 0.0 110.861 174.094 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -75.83 -44.31 41.66 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.111 0.564 . . . . 0.0 110.865 176.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -58.28 -34.13 70.19 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.659 0.784 . . . . 0.0 112.356 177.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -69.71 -10.02 56.68 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.664 1.186 . . . . 0.0 114.109 177.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -120.15 -47.25 2.38 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.517 1.527 . . . . 0.0 113.148 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 76.78 3.88 80.69 Favored Glycine 0 CA--C 1.539 1.537 0 N-CA-C 117.369 1.708 . . . . 0.0 117.369 177.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -127.27 -37.67 2.02 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 119.843 1.821 . . . . 0.0 114.038 -178.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 27.2 m -65.52 154.46 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 113.531 0.938 . . . . 0.0 113.531 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 79.0 mmt-85 -82.57 163.55 21.41 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.075 1.35 . . . . 0.0 111.018 176.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -74.16 173.14 10.53 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -178.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 1.9 t -54.3 150.98 7.93 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 127.807 2.443 . . . . 0.0 115.042 -177.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 50.1 m -81.03 -14.2 58.1 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.955 1.302 . . . . 0.0 112.856 177.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 67.0 tp -82.95 114.5 52.98 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.809 1.644 . . . . 0.0 110.354 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -57.99 -35.77 98.53 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.556 2.171 . . . . 0.0 113.735 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 19.7 m170 -63.81 -38.18 90.14 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 5.1 t -64.94 -51.84 59.6 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.091 1.357 . . . . 0.0 109.228 175.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -52.02 -41.87 62.58 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.179 1.792 . . . . 0.0 111.774 175.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 5.1 m -66.99 -58.63 4.58 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.934 1.294 . . . . 0.0 111.252 176.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.2 mmt -62.67 -33.1 74.38 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -177.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -67.09 -30.39 70.4 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 121.138 1.79 . . . . 0.0 112.51 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -72.07 -36.81 69.65 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 122.875 0.47 . . . . 0.0 110.264 172.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 71.2 t -62.61 -46.94 95.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 123.076 0.55 . . . . 0.0 110.13 175.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.23 -41.29 92.8 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.253 1.021 . . . . 0.0 112.002 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -63.6 -39.55 94.66 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.013 0.525 . . . . 0.0 111.762 175.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.8 -50.75 27.03 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.268 0.627 . . . . 0.0 111.15 176.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 30.1 ttp -57.54 -34.9 69.64 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.318 1.847 . . . . 0.0 114.378 -175.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 13.0 t -74.35 -16.1 60.92 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 120.06 1.3 . . . . 0.0 112.544 175.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -98.84 -30.64 12.29 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.53 1.532 . . . . 0.0 112.039 176.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 36.4 t -61.95 145.15 53.79 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.418 1.887 . . . . 0.0 112.279 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -121.33 -5.39 9.37 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.406 1.482 . . . . 0.0 114.718 -177.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -88.95 -15.5 34.12 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.486 1.039 . . . . 0.0 113.211 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 58.69 -126.9 43.9 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 121.38 -0.825 . . . . 0.0 112.007 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -66.48 -10.06 40.64 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -94.26 0.35 55.59 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.573 1.149 . . . . 0.0 113.445 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.1 t -59.17 140.77 55.57 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.331 1.062 . . . . 0.0 110.383 177.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 55.1 mm-40 -77.94 -9.0 58.87 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.853 1.261 . . . . 0.0 113.319 -176.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 10.9 t -93.94 124.13 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.491 1.116 . . . . 0.0 108.652 175.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.63 -50.36 65.88 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -176.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -62.4 -32.85 73.73 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -178.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 49.7 t -68.61 -59.37 3.17 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.937 0.789 . . . . 0.0 109.992 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.73 68.67 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.647 0.779 . . . . 0.0 112.419 178.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 19.8 m -69.32 -51.9 32.57 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.314 -0.866 . . . . 0.0 112.08 176.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 36.7 m -62.9 -33.64 75.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.853 1.206 . . . . 0.0 112.066 178.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -59.65 -34.15 72.45 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.474 -0.766 . . . . 0.0 111.872 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -65.93 -27.83 68.47 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 118.924 0.784 . . . . 0.0 111.697 175.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 11.6 mt -76.73 -48.02 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.171 0.989 . . . . 0.0 109.886 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 20.4 mm -59.25 -38.02 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 124.191 0.996 . . . . 0.0 110.741 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 22.3 t -58.46 -29.34 66.1 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.799 1.239 . . . . 0.0 112.8 176.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 10.8 t60 -61.53 -55.89 26.07 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.295 -0.878 . . . . 0.0 110.453 176.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 51.7 m95 -61.3 -31.96 71.8 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 178.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -67.23 -34.76 78.15 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 118.606 -0.711 . . . . 0.0 112.824 178.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.6 p30 -100.1 -30.76 11.77 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 11.1 t -78.58 125.7 29.73 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.775 1.23 . . . . 0.0 112.095 -178.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 54.4 p -111.32 1.66 17.23 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.858 1.663 . . . . 0.0 113.941 -178.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 64.7 mtm180 -85.35 162.07 19.22 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.346 1.458 . . . . 0.0 114.084 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 15.3 t-160 -106.67 -37.96 6.27 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.656 1.582 . . . . 0.0 108.425 170.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -85.75 69.88 10.64 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.094 1.758 . . . . 0.0 111.097 175.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 44.3 t -131.62 136.79 29.07 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 126.898 2.079 . . . . 0.0 109.224 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -55.29 -28.38 62.15 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.903 2.402 . . . . 0.0 114.566 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.9 t -92.14 -52.14 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 119.461 1.028 . . . . 0.0 111.941 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 4.9 m -68.39 -34.89 76.83 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 115.203 1.556 . . . . 0.0 115.203 -174.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -54.8 -58.9 12.22 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-O 117.678 -1.153 . . . . 0.0 113.083 -178.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.23 -31.83 93.56 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.983 1.789 . . . . 0.0 113.402 179.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.72 -48.09 60.78 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.706 0.802 . . . . 0.0 111.988 178.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -67.22 -25.19 65.99 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.115 0.966 . . . . 0.0 111.993 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 18.9 t30 -77.46 -40.37 43.43 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.112 1.365 . . . . 0.0 111.699 175.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -79.74 -41.86 25.77 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -179.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 73.8 m -97.79 128.31 44.35 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.71 1.204 . . . . 0.0 112.007 -179.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -131.74 43.1 3.09 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.918 1.687 . . . . 0.0 113.091 -177.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -59.32 -19.92 50.35 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -177.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 26.9 ttp180 . . . . . 0 N--CA 1.476 0.873 0 C-N-CA 125.472 1.509 . . . . 0.0 111.365 179.711 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.383 0 CA-C-O 121.324 0.402 . . . . 0.0 113.874 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.2 m -77.37 50.54 0.79 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.823 1.649 . . . . 0.0 113.36 -179.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -72.04 154.21 41.27 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.381 1.472 . . . . 0.0 112.822 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 14.4 tpt -72.41 148.51 45.13 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.159 0.983 . . . . 0.0 111.823 178.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -71.94 -30.51 65.39 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 -177.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -147.36 158.14 44.32 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 125.167 1.387 . . . . 0.0 112.674 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.72 136.45 75.62 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 123.135 2.557 . . . . 0.0 113.449 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -95.1 157.71 15.78 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.792 1.237 . . . . 0.0 111.33 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 20.1 m -74.13 44.52 0.19 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.767 1.627 . . . . 0.0 114.942 -177.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 12.6 t70 -73.69 140.99 78.7 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.127 1.371 . . . . 0.0 110.178 176.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -49.61 -20.56 4.42 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 124.233 3.289 . . . . 0.0 117.92 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 89.0 p -82.78 -7.1 59.68 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 178.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 13.6 p -141.5 158.92 21.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 125.464 1.506 . . . . 0.0 112.569 -177.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -127.1 82.52 67.98 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.0 1.32 . . . . 0.0 110.89 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -57.52 -47.29 22.34 Favored 'Trans proline' 0 CA--C 1.549 1.264 0 C-N-CA 123.089 2.526 . . . . 0.0 115.282 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -80.64 169.2 17.1 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 122.861 2.374 . . . . 0.0 112.032 179.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 7.8 tt -78.5 122.91 26.47 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.364 -0.835 . . . . 0.0 110.437 177.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 19.4 t -90.43 157.26 17.68 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.7 1.2 . . . . 0.0 113.246 -178.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -59.13 -29.5 67.45 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.778 1.231 . . . . 0.0 112.838 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.15 -19.45 61.12 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 179.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 86.2 m -64.96 -60.01 3.53 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.232 0.924 . . . . 0.0 111.069 -178.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -60.29 -27.31 67.19 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.661 -0.649 . . . . 0.0 112.462 174.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 53.7 m -71.54 -31.23 66.8 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.43 0.692 . . . . 0.0 112.802 178.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.1 t70 -90.15 -28.62 18.81 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.438 1.095 . . . . 0.0 112.966 175.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.1 tt -44.39 -60.1 2.1 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.926 2.09 . . . . 0.0 113.314 -178.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.8 p-90 -70.94 -4.81 26.57 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -112.02 -59.97 1.92 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.736 1.754 . . . . 0.0 115.736 -177.419 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 7.0 mp -120.23 14.27 12.12 Favored 'General case' 0 CA--C 1.554 1.135 0 N-CA-C 116.372 1.99 . . . . 0.0 116.372 -174.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 4.4 tt -54.21 134.55 60.14 Favored Pre-proline 0 CA--C 1.552 1.048 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -178.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -84.82 170.11 10.17 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 124.656 3.571 . . . . 0.0 113.548 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.5 -5.72 21.08 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 178.661 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.67 56.75 2.31 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.297 1.439 . . . . 0.0 111.361 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -139.49 139.65 37.03 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.546 1.538 . . . . 0.0 112.299 -178.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 35.8 m -132.23 12.43 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 C-N-CA 125.851 1.66 . . . . 0.0 113.182 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 42.3 tp -69.64 -24.29 63.61 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.601 1.16 . . . . 0.0 113.919 -177.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 29.2 m -53.94 115.46 8.2 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.754 1.622 . . . . 0.0 114.316 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -71.78 153.92 58.97 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 122.687 2.258 . . . . 0.0 111.09 176.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 87.0 mt -74.02 148.26 86.64 Favored Pre-proline 0 CA--C 1.544 0.729 0 CA-C-O 118.44 -0.791 . . . . 0.0 111.208 178.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -53.77 -29.68 53.39 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 123.453 2.768 . . . . 0.0 115.069 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 56.0 p -82.75 -10.82 58.71 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.839 1.656 . . . . 0.0 114.256 177.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -117.6 -21.41 8.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.134 1.774 . . . . 0.0 113.514 -178.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -66.02 158.06 29.3 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.589 1.555 . . . . 0.0 114.403 -177.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.85 21.29 0.16 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 128.215 2.606 . . . . 0.0 114.265 178.024 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.39 -16.8 64.44 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.702 1.201 . . . . 0.0 113.286 -179.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -63.04 -21.07 65.91 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.739 1.216 . . . . 0.0 113.487 176.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 29.5 tp -110.42 9.96 23.36 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 127.001 2.12 . . . . 0.0 112.114 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 13.3 tpt -76.81 150.88 36.1 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -175.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.9 mp -125.04 159.91 30.25 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 125.602 1.561 . . . . 0.0 111.992 177.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.3 m -66.63 152.16 95.5 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 170.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -64.02 -11.49 27.57 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 122.25 1.967 . . . . 0.0 115.788 -174.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -80.08 -18.02 51.1 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.406 -0.809 . . . . 0.0 112.236 177.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -84.85 -9.97 57.61 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.481 1.112 . . . . 0.0 112.232 177.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 95.8 mt -58.55 -35.25 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.658 1.183 . . . . 0.0 109.711 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -65.58 -11.24 42.38 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.077 1.351 . . . . 0.0 113.167 177.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -82.94 -25.37 32.44 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.604 1.162 . . . . 0.0 112.286 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.3 p-90 -109.69 -26.07 10.06 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.517 1.127 . . . . 0.0 113.677 178.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -113.6 109.93 19.41 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 169.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.07 144.54 50.36 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -174.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -91.01 178.22 6.06 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.169 1.387 . . . . 0.0 110.561 172.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -65.79 120.2 66.94 Favored Pre-proline 0 CA--C 1.552 1.023 0 O-C-N 120.668 -1.27 . . . . 0.0 110.618 177.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -82.8 -12.11 9.94 Favored 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 123.211 2.608 . . . . 0.0 114.497 -176.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 96.35 -146.53 18.3 Favored Glycine 0 CA--C 1.543 1.816 0 C-N-CA 125.232 1.396 . . . . 0.0 112.951 -178.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -74.92 -10.26 21.27 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 124.128 3.219 . . . . 0.0 114.672 -177.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -140.0 166.15 25.43 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.459 1.903 . . . . 0.0 110.997 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 80.59 19.05 69.32 Favored Glycine 0 CA--C 1.538 1.501 0 N-CA-C 115.221 0.848 . . . . 0.0 115.221 178.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 18.1 m -76.56 13.55 0.96 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.68 1.592 . . . . 0.0 114.695 -179.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 57.0 m -50.14 -27.98 6.62 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.221 2.209 . . . . 0.0 114.722 -178.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -56.13 -25.45 46.2 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.29 1.436 . . . . 0.0 113.987 179.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 32.1 t30 -78.05 -25.1 47.58 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.714 0.806 . . . . 0.0 111.957 175.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -91.92 -30.27 10.58 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 125.826 1.679 . . . . 0.0 113.707 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 72.2 p -73.01 -25.31 60.92 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 118.62 1.21 . . . . 0.0 112.266 177.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -84.47 142.83 29.79 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.718 1.207 . . . . 0.0 111.275 176.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 63.0 m -123.96 140.69 52.73 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.019 1.327 . . . . 0.0 110.696 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 73.47 -113.94 4.46 Favored Glycine 0 CA--C 1.542 1.736 0 CA-C-O 118.328 -1.262 . . . . 0.0 112.72 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -63.09 171.57 6.09 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 124.287 3.325 . . . . 0.0 114.13 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 7.2 m -48.22 -36.33 13.64 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 126.966 2.106 . . . . 0.0 113.958 -179.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -130.7 128.83 41.66 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.315 1.846 . . . . 0.0 108.005 175.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 13.0 t70 -61.87 137.53 95.34 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 123.32 0.648 . . . . 0.0 112.447 -177.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -53.23 -40.64 76.81 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.022 2.482 . . . . 0.0 114.291 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -69.55 -35.26 75.24 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.34 -0.85 . . . . 0.0 111.59 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -68.04 -38.53 82.61 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 118.601 0.637 . . . . 0.0 110.365 175.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 42.3 mtm105 -63.73 -38.16 90.07 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 118.617 -0.706 . . . . 0.0 111.665 175.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -58.08 -36.72 73.25 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 119.082 0.855 . . . . 0.0 111.492 173.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 55.6 mt -64.17 -45.0 90.34 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.646 0.657 . . . . 0.0 110.937 176.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -58.23 -51.11 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-N 118.142 0.428 . . . . 0.0 110.102 177.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -57.34 -53.08 62.23 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.531 1.133 . . . . 0.0 111.414 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.98 -33.29 75.47 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.458 1.026 . . . . 0.0 112.847 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -67.86 -46.19 72.45 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.315 0.962 . . . . 0.0 109.305 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 12.0 tp -61.78 -39.65 92.41 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.949 1.3 . . . . 0.0 111.861 177.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 96.1 t -60.29 -32.52 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.056 1.298 . . . . 0.0 110.331 174.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.4 tp -73.65 -29.49 62.36 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 120.86 -1.15 . . . . 0.0 112.779 175.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.37 -29.93 69.24 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 120.102 1.319 . . . . 0.0 109.56 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.5 mt -71.67 -53.68 12.8 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.483 -0.761 . . . . 0.0 109.768 175.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 12.4 t60 -54.62 -53.62 52.24 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.381 0.673 . . . . 0.0 110.925 178.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -59.91 -21.94 61.75 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -178.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -87.53 -32.99 19.11 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.119 0.872 . . . . 0.0 111.958 174.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 39.2 mttm -84.16 -41.5 16.97 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.043 1.337 . . . . 0.0 113.346 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 34.5 t -56.73 -45.74 81.76 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.382 1.873 . . . . 0.0 111.212 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -60.41 -38.55 84.41 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 176.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -69.69 -43.94 71.45 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.625 -0.672 . . . . 0.0 110.551 177.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 3.4 tmm_? -56.41 -42.85 78.67 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.757 1.623 . . . . 0.0 111.296 176.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -69.08 -49.26 58.88 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.694 0.798 . . . . 0.0 111.745 178.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -66.64 -38.13 86.26 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -178.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -69.46 -33.76 73.39 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.911 0.885 . . . . 0.0 113.121 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -81.01 -48.85 11.67 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.527 0.731 . . . . 0.0 112.142 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 74.04 -15.16 3.35 Favored Glycine 0 CA--C 1.54 1.632 0 N-CA-C 116.977 1.551 . . . . 0.0 116.977 178.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -97.01 -37.86 10.01 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.923 1.861 . . . . 0.0 111.837 178.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 13.1 m -86.83 165.38 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.762 1.225 . . . . 0.0 110.997 176.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 77.1 mmt-85 -118.98 171.29 8.35 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.2 1.4 . . . . 0.0 111.218 178.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -60.45 160.72 8.39 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.053 0.941 . . . . 0.0 113.278 -178.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 16.8 p -67.77 174.35 3.67 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 126.059 1.744 . . . . 0.0 114.179 -178.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 75.8 p -92.6 3.96 54.54 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.439 1.496 . . . . 0.0 114.668 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 5.1 tt -72.31 125.09 91.53 Favored Pre-proline 0 CA--C 1.554 1.11 0 C-N-CA 124.738 1.215 . . . . 0.0 110.041 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -65.9 -46.72 4.47 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.96 2.44 . . . . 0.0 115.055 -174.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 72.8 m80 -74.73 -13.48 60.61 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.4 t -62.27 -49.15 76.82 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.242 1.017 . . . . 0.0 110.379 178.021 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 31.5 tpt180 -55.21 -37.58 67.32 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.916 1.286 . . . . 0.0 111.96 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 52.0 m -68.84 -55.77 10.1 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.672 0.789 . . . . 0.0 111.389 177.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.9 mmt -64.45 -35.25 80.33 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -64.74 -33.29 75.62 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.711 1.596 . . . . 0.0 112.335 178.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -70.72 -40.89 72.52 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.49 0.716 . . . . 0.0 110.298 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 78.6 t -62.61 -47.54 92.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 123.353 0.661 . . . . 0.0 110.566 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.13 -42.83 95.63 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.182 0.993 . . . . 0.0 112.575 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -65.08 -30.33 71.28 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 177.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 64.8 t60 -78.32 -52.48 8.56 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.577 0.751 . . . . 0.0 110.3 174.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.6 ttp -55.6 -35.84 66.25 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.1 1.76 . . . . 0.0 113.698 -176.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 6.0 t -71.44 -11.46 60.9 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.101 1.319 . . . . 0.0 113.55 178.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -112.9 -22.74 10.48 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.365 1.466 . . . . 0.0 112.791 176.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 39.0 t -56.91 138.19 54.22 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.475 1.51 . . . . 0.0 112.452 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -103.48 -16.55 15.53 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.672 1.589 . . . . 0.0 113.699 -178.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -95.68 -31.18 13.36 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.34 1.056 . . . . 0.0 112.678 -178.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.76 -108.06 0.65 Allowed Glycine 0 CA--C 1.536 1.35 0 C-N-CA 124.561 1.076 . . . . 0.0 112.917 178.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 67.3 mttm -58.37 -25.08 61.62 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 121.446 -1.032 . . . . 0.0 113.13 177.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -96.09 -0.69 49.96 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.335 1.454 . . . . 0.0 114.005 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.2 t -60.07 144.24 50.08 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 122.341 1.067 . . . . 0.0 111.007 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -80.01 -8.77 59.53 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.611 1.165 . . . . 0.0 113.036 -177.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.9 t -89.56 117.41 32.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 173.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.58 -40.73 72.39 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -177.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -64.06 -38.37 90.82 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.664 0.786 . . . . 0.0 112.915 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 51.9 t -68.03 -57.14 6.64 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.458 1.503 . . . . 0.0 110.285 178.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.35 -28.09 62.85 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.296 1.039 . . . . 0.0 113.084 177.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 68.7 m -79.32 -49.77 11.91 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.739 0.816 . . . . 0.0 112.268 176.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.6 m -61.61 -33.98 74.86 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.498 -0.751 . . . . 0.0 111.962 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -58.75 -31.87 68.73 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.014 0.926 . . . . 0.0 112.546 176.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -68.74 -35.3 76.94 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.074 0.852 . . . . 0.0 111.592 176.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 7.9 mt -68.84 -45.23 81.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 123.846 0.858 . . . . 0.0 109.668 176.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 18.1 mm -62.44 -40.75 89.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.151 0.98 . . . . 0.0 110.911 175.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 70.8 m -61.09 -26.66 67.81 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.968 0.907 . . . . 0.0 113.106 178.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.5 t60 -62.14 -56.59 17.26 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.688 1.131 . . . . 0.0 109.889 177.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 41.5 m95 -60.19 -30.63 69.49 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 178.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -72.8 -28.13 62.4 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 178.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -100.14 -34.97 9.82 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.3 t -74.39 134.16 42.44 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.413 1.485 . . . . 0.0 111.225 -178.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 61.6 p -123.22 -9.65 8.11 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -176.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -78.91 159.81 27.56 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 0.0 113.499 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 39.2 p-80 -93.14 -25.22 17.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.695 1.198 . . . . 0.0 111.324 172.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 17.5 t0 -106.84 86.13 2.27 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.615 1.966 . . . . 0.0 110.797 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 50.9 t -138.69 135.87 18.25 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 126.842 2.057 . . . . 0.0 108.7 179.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -58.76 -26.55 80.45 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 123.049 2.5 . . . . 0.0 114.627 -177.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 39.4 t -92.07 -48.97 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.636 1.107 . . . . 0.0 111.643 176.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.5 m -69.96 -43.98 70.43 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -175.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.03 -54.31 48.62 Favored Pre-proline 0 CA--C 1.552 1.021 0 O-C-N 120.904 -1.123 . . . . 0.0 112.845 -178.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -65.8 -4.41 9.88 Favored 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 122.91 2.406 . . . . 0.0 114.996 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.6 mt -100.0 -47.61 4.94 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.91 1.284 . . . . 0.0 109.911 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -58.59 -36.86 74.65 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.204 1.402 . . . . 0.0 111.918 176.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 16.6 p30 -83.93 -10.02 58.27 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 179.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -102.81 -38.96 7.2 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.947 1.299 . . . . 0.0 113.619 -178.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 32.8 t -73.37 142.03 47.02 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 121.684 0.754 . . . . 0.0 112.504 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 38.0 t70 -84.54 -6.05 59.34 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.904 1.282 . . . . 0.0 112.844 178.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -79.11 40.64 0.42 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 126.028 1.731 . . . . 0.0 113.383 -178.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 40.9 ptt180 . . . . . 0 N--CA 1.478 0.951 0 C-N-CA 126.996 2.119 . . . . 0.0 113.973 -178.507 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 34.5 m . . . . . 0 N--CA 1.472 0.652 0 CA-C-O 119.029 -0.51 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -60.02 -27.37 66.84 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 177.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 67.0 m -74.53 -34.49 63.01 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 178.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.7 t70 -90.25 -27.43 19.49 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.426 1.09 . . . . 0.0 113.229 176.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -42.9 -54.38 4.22 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.731 2.412 . . . . 0.0 112.966 -178.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 42.1 p-90 -75.3 -4.84 41.5 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -175.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 87.1 mttt -107.91 -60.32 1.73 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -177.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 26.0 mt -120.14 12.14 11.79 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -169.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.5 tt . . . . . 0 CA--C 1.55 0.976 0 C-N-CA 125.191 1.396 . . . . 0.0 114.028 -176.514 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 86.5 mt . . . . . 0 CA--C 1.551 0.987 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.27 152.75 32.7 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -174.267 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 90.9 mt -125.19 179.96 4.84 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 129.209 3.004 . . . . 0.0 113.557 -177.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 88.0 p -100.11 152.58 37.87 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.85 1.66 . . . . 0.0 106.999 169.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_exo -56.48 -23.78 49.41 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.569 2.179 . . . . 0.0 114.889 -178.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.2 t70 -71.42 -29.15 64.56 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.945 0.898 . . . . 0.0 112.98 178.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 15.5 t70 -76.58 -15.0 59.96 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 93.8 mt -58.13 -35.38 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 O-C-N 121.435 -0.791 . . . . 0.0 109.947 175.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -69.14 -9.85 54.83 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.75 1.22 . . . . 0.0 113.391 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -83.73 -29.06 27.81 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.285 1.034 . . . . 0.0 111.715 177.059 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.3 p-90 . . . . . 0 N--CA 1.471 0.589 0 C-N-CA 123.847 0.859 . . . . 0.0 112.498 176.51 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 30.7 mmtp . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 119.714 -0.184 . . . . 0.0 110.524 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -64.99 -39.5 93.57 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.819 0.848 . . . . 0.0 111.34 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -59.0 -41.0 86.62 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.132 0.878 . . . . 0.0 111.11 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 94.3 mt -64.84 -38.44 90.97 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.683 0.793 . . . . 0.0 111.848 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -65.5 -53.83 35.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 CA-C-N 119.066 0.848 . . . . 0.0 109.454 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -52.29 -52.06 55.05 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.184 0.994 . . . . 0.0 111.563 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -35.53 80.46 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -179.11 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 14.0 tp60 -74.21 -44.05 54.75 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.044 0.838 . . . . 0.0 110.88 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.8 tt -59.63 -46.25 89.56 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.863 1.265 . . . . 0.0 110.435 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 92.4 t -58.24 -32.13 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.008 0.822 . . . . 0.0 111.221 175.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.58 -26.15 61.6 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.827 -1.17 . . . . 0.0 113.854 175.725 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.8 mp -63.6 -32.59 74.11 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 120.104 1.32 . . . . 0.0 108.911 173.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 4.1 mt -69.14 -50.42 48.09 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.708 1.203 . . . . 0.0 109.564 175.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 17.9 t60 -55.79 -53.55 55.28 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 122.603 0.361 . . . . 0.0 110.365 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -58.31 -27.29 63.96 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -86.28 -28.36 23.81 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.996 0.816 . . . . 0.0 112.885 176.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 40.9 mttm -86.06 -36.21 19.81 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.017 1.327 . . . . 0.0 112.223 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 49.5 t -60.85 -48.4 82.0 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 127.067 2.147 . . . . 0.0 111.051 177.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.5 pt20 . . . . . 0 CA--C 1.547 0.85 0 O-C-N 121.322 -0.861 . . . . 0.0 112.335 175.736 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 95.2 m-70 . . . . . 0 N--CA 1.472 0.659 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.7 t -67.61 -50.44 58.16 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.3 1.44 . . . . 0.0 109.258 175.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -55.49 -40.83 72.21 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.123 1.369 . . . . 0.0 111.585 174.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.3 m -64.74 -56.53 13.08 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.526 1.13 . . . . 0.0 111.044 177.092 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.7 mmt -64.25 -36.81 85.31 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.79 -32.08 73.41 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.909 1.686 . . . . 0.0 112.667 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -71.48 -41.4 69.37 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.165 0.586 . . . . 0.0 110.398 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 76.1 t -62.56 -48.06 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.467 0.707 . . . . 0.0 110.839 177.002 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.71 -44.63 90.44 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.918 0.887 . . . . 0.0 111.635 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -67.74 -17.43 64.55 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 177.401 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 58.2 t60 -88.75 -49.75 6.65 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.857 0.863 . . . . 0.0 109.512 173.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.2 ttp -56.77 -28.15 60.76 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.273 1.829 . . . . 0.0 113.591 -177.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.9 p -67.77 -27.7 66.99 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.569 1.148 . . . . 0.0 112.783 175.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -105.26 -17.55 14.42 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.775 1.63 . . . . 0.0 113.853 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 30.4 t -62.1 146.97 48.92 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.24 1.416 . . . . 0.0 112.218 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -116.79 -13.72 10.75 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.53 1.532 . . . . 0.0 113.881 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -94.81 -27.24 15.87 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.096 0.959 . . . . 0.0 112.373 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.34 -112.89 2.58 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.619 1.105 . . . . 0.0 113.007 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -61.78 -18.18 58.9 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 121.392 -1.064 . . . . 0.0 113.309 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.26 -0.25 44.35 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.45 1.5 . . . . 0.0 113.644 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 15.4 t -59.69 144.01 49.15 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 122.473 1.13 . . . . 0.0 110.779 179.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 56.4 mm-40 -78.52 -8.39 58.51 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.5 1.12 . . . . 0.0 113.053 -176.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 90.8 t -91.05 115.04 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 173.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.34 -36.88 66.76 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -177.542 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -67.49 -32.63 73.59 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.374 1.07 . . . . 0.0 112.809 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 47.9 t -74.73 -55.42 5.87 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.357 1.463 . . . . 0.0 109.72 177.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -54.91 -45.81 74.8 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.261 1.025 . . . . 0.0 112.624 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 23.8 p -63.9 -46.33 85.36 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 177.251 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 62.8 m -63.17 -33.22 75.01 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 118.859 0.754 . . . . 0.0 112.039 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -63.7 -30.8 71.86 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 118.168 -0.92 . . . . 0.0 112.674 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -63.98 -37.98 89.4 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.213 1.37 . . . . 0.0 110.692 173.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.9 mt -66.99 -42.49 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.205 1.002 . . . . 0.0 110.365 178.401 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 19.4 mm -66.09 -36.74 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 123.599 0.76 . . . . 0.0 110.911 176.015 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 54.1 m -66.11 -24.08 66.62 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.422 1.089 . . . . 0.0 113.251 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -62.35 -59.03 5.58 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.243 0.928 . . . . 0.0 110.852 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 56.5 m95 -60.61 -26.22 66.84 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 48.1 mttp -72.95 -33.75 66.1 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.869 0.868 . . . . 0.0 113.144 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.7 p30 -100.05 -29.56 12.45 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 6.3 t -79.05 133.92 36.78 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.439 1.096 . . . . 0.0 112.315 -178.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 74.2 p -130.12 2.14 4.74 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.658 1.583 . . . . 0.0 114.311 -178.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -78.31 155.78 29.98 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.203 1.401 . . . . 0.0 113.612 -178.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -88.56 -33.11 17.83 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.875 0.87 . . . . 0.0 110.646 171.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 19.8 t0 -103.03 80.24 1.84 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.851 2.06 . . . . 0.0 111.478 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 42.8 t -132.19 134.97 25.69 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 126.995 2.118 . . . . 0.0 107.958 177.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -59.96 -22.9 70.86 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 122.252 1.968 . . . . 0.0 113.52 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 5.0 t -92.14 -51.49 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 119.409 1.004 . . . . 0.0 111.634 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 19.6 m -65.68 -44.06 87.36 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -177.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.52 -56.4 27.27 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.149 -175.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -63.34 -30.65 73.25 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 121.789 1.675 . . . . 0.0 113.068 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 97.8 mt -69.84 -44.16 70.45 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.47 1.032 . . . . 0.0 111.288 176.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -64.74 -35.06 79.86 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.192 0.997 . . . . 0.0 111.184 175.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 57.4 t30 -68.12 -40.3 82.56 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.458 1.103 . . . . 0.0 111.065 175.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.748 0 C-N-CA 124.378 1.071 . . . . 0.0 112.763 177.619 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 95.9 m . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 119.733 -0.175 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -60.19 -28.48 68.0 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.61 0.764 . . . . 0.0 112.924 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 42.5 m -70.19 -34.2 72.66 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.853 0.861 . . . . 0.0 112.631 178.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -90.1 -26.61 20.14 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.593 1.157 . . . . 0.0 113.365 175.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.2 tt -45.41 -60.04 2.37 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 126.913 2.085 . . . . 0.0 113.498 -176.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 40.0 p-90 -66.72 -10.52 47.71 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -173.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 9.1 ptmm? -112.12 -57.72 2.23 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 47.2 mt -116.05 13.96 15.95 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 -171.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.9 tt . . . . . 0 CA--C 1.551 1.014 0 C-N-CA 125.701 1.6 . . . . 0.0 113.703 179.366 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 24.0 tp . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 62.1 mmm -67.3 159.5 29.11 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.732 1.753 . . . . 0.0 115.732 -177.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 96.3 mt -125.06 170.51 11.1 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 127.666 2.386 . . . . 0.0 112.766 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 30.7 t -86.36 146.65 42.67 Favored Pre-proline 0 CA--C 1.543 0.696 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 169.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.8 Cg_exo -54.14 -21.45 22.14 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.89 2.394 . . . . 0.0 115.087 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 32.7 t70 -73.27 -22.07 60.46 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.342 1.057 . . . . 0.0 113.006 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -78.92 -17.44 55.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.062 0.945 . . . . 0.0 112.994 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.65 -34.26 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 125.134 1.374 . . . . 0.0 110.667 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -68.41 -10.03 52.43 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.702 1.201 . . . . 0.0 113.814 178.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 52.6 tp60 -82.35 -39.11 23.24 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.093 -1.004 . . . . 0.0 111.373 177.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.255 3.9 p-90 . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 179.168 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 56.1 mtpt . . . . . 0 N--CA 1.474 0.75 0 CA-C-O 119.377 -0.344 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 6.9 mmp_? -58.47 -42.98 88.7 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.957 0.903 . . . . 0.0 111.544 176.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -64.43 -28.65 69.82 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 177.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 98.7 mt -69.92 -37.86 76.06 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.534 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -63.13 -52.75 55.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 174.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -52.51 -55.71 20.22 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.949 0.9 . . . . 0.0 111.412 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -34.26 77.41 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -178.388 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -69.47 -44.87 70.29 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.485 1.039 . . . . 0.0 110.365 177.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 5.1 tt -60.07 -43.8 95.21 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.603 1.161 . . . . 0.0 110.017 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 85.4 t -58.94 -31.43 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.1 0.864 . . . . 0.0 111.525 175.539 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 4.4 tp -72.26 -29.61 64.07 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.137 1.335 . . . . 0.0 112.816 175.085 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -60.97 -33.83 73.82 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 120.394 1.452 . . . . 0.0 109.14 174.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 7.0 mt -66.7 -51.84 51.47 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.307 1.043 . . . . 0.0 109.998 175.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 31.4 t60 -57.3 -57.35 13.0 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 119.19 -0.433 . . . . 0.0 110.291 177.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -51.79 -41.21 61.51 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.419 1.088 . . . . 0.0 113.548 -178.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -75.32 -35.99 61.13 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 36.9 mttm -73.31 -46.84 47.2 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.954 0.902 . . . . 0.0 110.844 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 35.3 t -55.79 -45.51 78.19 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 127.123 2.169 . . . . 0.0 111.151 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 7.7 tt0 . . . . . 0 CA--C 1.54 0.569 0 C-N-CA 125.782 1.633 . . . . 0.0 112.659 175.7 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 37.7 m80 . . . . . 0 CA--C 1.539 0.533 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.5 t -66.42 -51.84 52.7 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.806 1.243 . . . . 0.0 109.019 175.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -55.87 -38.86 70.69 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.806 1.242 . . . . 0.0 111.367 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 33.1 m -66.16 -57.14 8.29 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.959 0.904 . . . . 0.0 111.538 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.2 mmt -64.35 -36.33 83.79 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -177.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -64.71 -28.9 69.91 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 120.738 1.608 . . . . 0.0 112.773 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -74.06 -39.74 63.27 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.129 0.572 . . . . 0.0 110.449 173.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 92.8 t -63.01 -44.84 99.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 121.753 -0.592 . . . . 0.0 110.744 176.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.54 -44.8 95.71 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.957 0.903 . . . . 0.0 110.576 177.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -63.52 -31.4 72.55 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.127 0.876 . . . . 0.0 113.202 175.471 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 74.5 t60 -74.73 -50.64 16.74 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.324 -0.86 . . . . 0.0 109.303 175.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.7 ttp -58.65 -30.95 67.71 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.32 1.848 . . . . 0.0 114.127 -177.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 25.0 p -70.22 -27.85 64.81 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 119.958 1.254 . . . . 0.0 112.307 174.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 78.6 t60 -96.83 -24.02 16.1 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.032 1.733 . . . . 0.0 113.556 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 20.0 t -60.06 148.68 34.87 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.373 1.469 . . . . 0.0 113.182 -177.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -113.87 -14.59 12.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.303 1.841 . . . . 0.0 113.503 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -103.9 -31.98 9.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.453 1.101 . . . . 0.0 112.536 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.55 -107.78 0.58 Allowed Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.559 1.076 . . . . 0.0 113.601 177.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 64.6 tttp -59.29 -25.51 64.17 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.034 -1.274 . . . . 0.0 112.48 177.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -94.97 -0.23 54.05 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.453 1.501 . . . . 0.0 113.833 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.1 t -61.71 143.64 55.87 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 122.407 1.099 . . . . 0.0 110.581 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.8 mm-40 -80.15 -6.14 57.24 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.513 1.125 . . . . 0.0 113.373 -176.437 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 16.8 t -92.82 124.53 45.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.748 1.219 . . . . 0.0 108.653 175.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.59 -46.25 70.3 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -176.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.56 -31.88 71.4 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 -178.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 51.2 t -67.65 -57.48 6.32 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.914 0.886 . . . . 0.0 109.859 178.545 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -61.76 -15.53 41.93 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.7 m -89.05 -55.61 3.61 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.341 1.057 . . . . 0.0 112.121 176.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.2 m -61.34 -31.98 71.86 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.478 1.036 . . . . 0.0 111.989 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -61.43 -32.75 72.72 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.548 -0.72 . . . . 0.0 111.987 175.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -66.26 -32.28 73.6 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.503 1.047 . . . . 0.0 111.481 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 12.3 mt -71.18 -46.83 64.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.252 1.021 . . . . 0.0 109.675 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 23.2 mm -60.87 -44.06 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 123.942 0.897 . . . . 0.0 110.687 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 44.9 m -57.56 -22.44 44.69 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 178.065 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.0 t60 -63.31 -53.06 58.71 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.636 1.107 . . . . 0.0 110.277 176.338 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 64.6 m95 -65.05 -27.91 69.12 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -68.72 -33.02 73.22 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.579 0.752 . . . . 0.0 112.31 175.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -100.04 -35.64 9.63 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 -177.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.2 t -80.53 137.18 36.4 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.352 1.461 . . . . 0.0 112.555 -176.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 22.1 m -129.99 -19.77 3.19 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.476 1.511 . . . . 0.0 113.274 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -68.39 140.78 55.84 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.514 1.525 . . . . 0.0 112.048 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -77.81 -38.11 47.16 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.222 0.609 . . . . 0.0 112.387 177.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 24.0 t70 -86.98 69.95 10.28 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.055 1.742 . . . . 0.0 111.745 179.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.8 t -124.17 135.22 26.14 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 126.543 1.937 . . . . 0.0 109.763 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -58.89 -25.47 77.11 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.964 2.443 . . . . 0.0 114.405 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.5 t -92.21 -51.16 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 119.748 1.158 . . . . 0.0 111.726 176.031 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.8 m -69.6 -39.64 77.14 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -175.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.5 tt -56.44 -55.65 40.31 Favored Pre-proline 0 CA--C 1.547 0.852 0 O-C-N 120.893 -1.129 . . . . 0.0 112.76 -178.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -61.44 -28.79 84.24 Favored 'Trans proline' 0 C--N 1.353 0.765 0 CA-C-N 121.609 1.61 . . . . 0.0 113.264 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 91.2 mt -70.15 -45.53 66.59 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.807 1.185 . . . . 0.0 111.401 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -63.84 -33.27 75.32 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.191 0.597 . . . . 0.0 111.229 176.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 59.1 t30 -72.81 -40.63 65.67 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.79 1.236 . . . . 0.0 111.833 176.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.629 0 C-N-CA 125.044 1.338 . . . . 0.0 113.892 179.429 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 20.9 m . . . . . 0 N--CA 1.473 0.675 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -60.26 -31.37 70.15 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.772 0.829 . . . . 0.0 112.738 174.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 54.0 m -69.45 -32.8 71.96 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.1 t70 -90.08 -29.52 18.29 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.74 1.216 . . . . 0.0 113.058 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -45.2 -58.14 3.46 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.843 2.057 . . . . 0.0 113.508 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -69.99 -9.76 56.29 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -112.06 -51.78 2.83 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 116.835 2.161 . . . . 0.0 116.835 -176.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 55.4 mt -117.04 20.19 13.92 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -170.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 7.5 tp . . . . . 0 CA--C 1.55 0.945 0 C-N-CA 125.911 1.685 . . . . 0.0 115.012 -174.409 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 83.7 mt . . . . . 0 CA--C 1.547 0.855 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 5.6 tpt -62.98 135.41 57.28 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -173.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.5 tt -124.99 144.88 50.15 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.391 2.276 . . . . 0.0 111.379 -177.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 52.2 m -73.24 151.53 90.08 Favored Pre-proline 0 N--CA 1.475 0.811 0 C-N-CA 124.946 1.299 . . . . 0.0 113.141 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -60.78 -23.92 77.65 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.574 2.849 . . . . 0.0 115.252 -177.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -78.71 -23.76 45.33 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.47 -0.769 . . . . 0.0 112.315 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -83.48 -9.86 58.71 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.61 1.564 . . . . 0.0 112.526 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 89.2 mt -57.87 -32.16 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 119.131 0.878 . . . . 0.0 109.46 173.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -69.74 -9.92 56.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.372 1.069 . . . . 0.0 113.476 177.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -77.89 -28.78 49.98 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.109 0.964 . . . . 0.0 111.7 177.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.4 p-90 . . . . . 0 N--CA 1.469 0.504 0 C-N-CA 124.068 0.947 . . . . 0.0 112.853 177.612 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 59.0 mtpt . . . . . 0 N--CA 1.472 0.669 0 N-CA-C 110.476 -0.194 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 27.3 ttp-105 -57.04 -51.29 69.84 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.535 1.134 . . . . 0.0 112.509 178.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -67.41 -29.69 69.26 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.112 0.869 . . . . 0.0 112.766 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 60.4 mt -66.37 -42.13 88.46 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.941 0.791 . . . . 0.0 111.192 174.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.4 mt -64.22 -51.23 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.527 1.058 . . . . 0.0 109.569 175.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -53.88 -52.13 61.45 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.533 0.733 . . . . 0.0 111.558 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -37.05 85.68 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.176 0.898 . . . . 0.0 113.099 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 16.1 tp60 -69.82 -44.08 70.69 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.794 0.724 . . . . 0.0 111.045 178.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.0 tt -63.45 -41.91 98.64 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.471 0.709 . . . . 0.0 110.231 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 94.5 t -59.8 -32.21 49.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 119.398 0.999 . . . . 0.0 111.15 174.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 1.6 tp -71.2 -26.31 62.9 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.913 -1.117 . . . . 0.0 112.995 175.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.33 -29.13 70.22 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 120.597 1.544 . . . . 0.0 109.612 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.3 mt -73.37 -53.63 10.28 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.734 1.213 . . . . 0.0 108.906 175.107 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 15.4 t60 -54.98 -56.06 23.95 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 122.887 0.475 . . . . 0.0 110.792 177.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -55.99 -23.49 32.9 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -90.07 -33.6 16.24 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.144 -0.972 . . . . 0.0 113.112 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 42.4 mttm -82.34 -31.13 30.02 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.441 1.497 . . . . 0.0 112.693 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.1 t -68.98 -51.91 34.52 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.227 2.211 . . . . 0.0 111.488 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.4 pt20 . . . . . 0 N--CA 1.476 0.857 0 O-C-N 121.062 -1.024 . . . . 0.0 113.405 178.377 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 75.7 m80 . . . . . 0 N--CA 1.472 0.641 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.9 t -68.03 -50.23 56.65 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 174.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -56.06 -37.2 68.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.577 1.551 . . . . 0.0 111.563 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 24.1 m -68.26 -58.18 4.82 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.511 1.124 . . . . 0.0 111.296 176.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -39.14 91.09 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.564 -0.732 . . . . 0.0 112.729 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -63.27 -33.77 76.22 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.483 1.492 . . . . 0.0 112.956 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -70.83 -41.06 72.01 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.118 0.567 . . . . 0.0 110.582 174.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 70.1 t -63.84 -47.28 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.381 0.672 . . . . 0.0 110.989 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.58 -43.99 89.65 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.998 0.919 . . . . 0.0 111.237 179.034 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -68.39 -17.07 64.14 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 176.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 56.6 t60 -89.99 -48.33 7.28 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.916 0.886 . . . . 0.0 109.963 174.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.7 ttp -56.41 -27.77 57.46 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.377 1.871 . . . . 0.0 113.392 -178.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 12.4 p -69.53 -24.27 63.71 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.976 1.31 . . . . 0.0 113.037 175.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 66.0 m80 -108.96 -17.77 13.84 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.261 1.824 . . . . 0.0 114.093 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.9 t -61.19 149.05 38.74 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.542 1.537 . . . . 0.0 112.72 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -118.38 -15.15 9.72 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.891 1.676 . . . . 0.0 113.747 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -98.8 -28.89 13.28 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.325 1.05 . . . . 0.0 112.802 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.13 -111.24 1.89 Allowed Glycine 0 CA--C 1.536 1.376 0 C-N-CA 124.336 0.969 . . . . 0.0 113.112 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.7 mttt -61.28 -20.82 63.32 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 121.22 -1.164 . . . . 0.0 113.226 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.95 -0.6 50.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.637 1.575 . . . . 0.0 113.537 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.5 t -63.95 141.53 58.73 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.114 0.959 . . . . 0.0 109.935 177.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -80.33 -5.14 55.86 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.208 1.003 . . . . 0.0 113.675 -175.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 84.1 t -89.21 112.98 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 172.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.55 -38.76 64.14 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -69.31 -30.98 69.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.481 1.113 . . . . 0.0 113.423 -178.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 41.5 t -73.1 -54.82 7.54 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.135 1.374 . . . . 0.0 108.997 176.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.83 -25.59 65.11 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 90.1 p -82.24 -48.88 10.73 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.386 0.993 . . . . 0.0 112.151 175.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 69.8 m -61.59 -33.59 74.14 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.372 -0.83 . . . . 0.0 112.259 178.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 43.9 tpt85 -61.63 -29.99 70.41 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.486 -0.759 . . . . 0.0 112.934 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -71.0 -32.61 69.47 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.019 0.927 . . . . 0.0 111.212 176.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 27.9 mt -70.78 -44.76 75.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 124.156 0.982 . . . . 0.0 109.227 176.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 22.7 mm -61.79 -36.71 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.984 0.914 . . . . 0.0 110.947 174.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 61.0 m -63.02 -23.56 67.51 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.676 0.79 . . . . 0.0 113.121 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 6.8 t60 -63.63 -58.35 7.2 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.331 0.969 . . . . 0.0 110.694 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 56.2 m95 -61.69 -23.19 65.94 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 177.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 94.4 mttt -76.49 -35.57 58.31 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.937 0.895 . . . . 0.0 112.768 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -100.03 -30.31 12.04 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 179.014 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.6 t -76.14 136.52 39.81 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.099 1.359 . . . . 0.0 111.469 -179.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.8 p -127.72 -6.98 5.64 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -176.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 -81.76 147.22 29.55 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.353 1.061 . . . . 0.0 113.335 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.7 p-80 -81.67 -27.8 33.86 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.738 0.815 . . . . 0.0 110.534 171.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 16.1 p-10 -98.69 69.93 1.88 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.487 2.315 . . . . 0.0 111.94 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 54.0 t -127.14 134.71 26.43 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 126.533 1.933 . . . . 0.0 109.248 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -57.0 -26.97 71.3 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 123.099 2.533 . . . . 0.0 114.551 -178.02 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 8.1 t -92.14 -52.96 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-N 119.441 1.019 . . . . 0.0 111.59 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.4 m -67.22 -39.11 86.22 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -174.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.1 tt -54.24 -57.79 16.71 Favored Pre-proline 0 CA--C 1.547 0.844 0 CA-C-O 117.804 -1.093 . . . . 0.0 113.209 -177.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.53 -31.25 92.14 Favored 'Trans proline' 0 C--N 1.352 0.736 0 CA-C-N 121.644 1.623 . . . . 0.0 113.041 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.13 -49.87 46.33 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.01 0.924 . . . . 0.0 112.44 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -65.52 -28.92 69.52 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.108 0.867 . . . . 0.0 111.862 176.389 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 9.4 t30 -71.87 -43.1 66.02 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.71 1.204 . . . . 0.0 111.949 175.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.59 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -179.008 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 90.8 m . . . . . 0 N--CA 1.469 0.488 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.19 -30.88 69.64 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 175.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 22.9 t -70.13 -33.65 72.09 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.5 t70 -90.15 -26.13 20.33 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.849 -1.157 . . . . 0.0 113.437 174.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -42.63 -58.02 2.47 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.891 2.076 . . . . 0.0 113.106 -179.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 45.3 p-90 -70.52 -11.91 61.23 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -172.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 50.4 pttt -112.03 -60.27 1.88 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -177.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 58.2 mt -120.21 18.59 12.28 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 116.65 2.092 . . . . 0.0 116.65 -172.304 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 5.4 tt . . . . . 0 CA--C 1.552 1.031 0 C-N-CA 125.266 1.426 . . . . 0.0 113.595 -178.754 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 22.7 tp . . . . . 0 CA--C 1.553 1.083 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 7.7 tpt -71.95 154.65 41.06 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -176.296 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 25.7 mt -124.26 169.81 11.39 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.503 2.321 . . . . 0.0 112.546 -176.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.2 m -76.92 151.44 82.06 Favored Pre-proline 0 CA--C 1.544 0.729 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 169.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -60.07 -14.59 29.13 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 123.086 2.524 . . . . 0.0 115.264 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.0 t70 -78.96 -19.17 52.36 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 120.916 -1.115 . . . . 0.0 112.978 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -81.65 -13.31 58.08 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.356 1.062 . . . . 0.0 113.081 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 91.3 mt -54.84 -36.93 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.471 1.509 . . . . 0.0 111.495 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -76.1 -9.91 59.0 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -84.53 -25.09 29.01 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.138 0.975 . . . . 0.0 113.526 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.678 0 CA-C-N 119.556 1.071 . . . . 0.0 112.301 -178.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 31.0 mmtp . . . . . 0 N--CA 1.474 0.747 0 CA-C-O 119.179 -0.438 . . . . 0.0 110.697 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -42.37 93.79 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.783 0.833 . . . . 0.0 111.136 174.573 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -58.84 -40.36 83.99 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.037 0.835 . . . . 0.0 111.289 174.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.8 -36.68 83.94 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 118.395 -0.812 . . . . 0.0 111.676 177.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -67.36 -55.14 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 119.216 0.916 . . . . 0.0 109.479 174.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -49.68 -52.33 31.85 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.687 1.195 . . . . 0.0 111.51 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 4.0 pp0? -65.22 -36.77 85.18 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 112.924 0.712 . . . . 0.0 112.924 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -69.69 -46.0 67.03 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.061 0.846 . . . . 0.0 110.139 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.11 -41.44 96.7 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.756 1.222 . . . . 0.0 111.156 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 83.8 t -60.15 -32.45 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-N 119.44 1.018 . . . . 0.0 110.937 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.37 -29.14 62.44 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.17 -0.956 . . . . 0.0 113.18 176.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -62.15 -37.45 85.26 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.445 1.02 . . . . 0.0 108.692 171.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.2 mt -65.59 -49.17 69.78 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.659 0.784 . . . . 0.0 110.077 177.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 28.5 t60 -56.58 -54.58 44.25 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 118.702 -0.666 . . . . 0.0 110.228 177.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.36 -46.27 66.09 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 118.603 0.638 . . . . 0.0 112.035 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -64.51 -45.2 88.26 Favored 'General case' 0 C--N 1.345 0.373 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 58.4 mttm -69.4 -25.34 64.09 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.688 1.195 . . . . 0.0 113.054 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.8 t -80.68 -52.26 7.75 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 127.11 2.164 . . . . 0.0 110.654 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.9 pt20 . . . . . 0 N--CA 1.474 0.761 0 O-C-N 120.202 -1.561 . . . . 0.0 112.791 179.416 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 99.2 m-70 . . . . . 0 N--CA 1.472 0.648 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.5 t -68.38 -50.42 53.12 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.906 1.282 . . . . 0.0 109.035 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -55.29 -39.07 69.43 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.028 1.331 . . . . 0.0 111.582 174.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 21.5 m -67.39 -57.43 6.59 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.459 1.104 . . . . 0.0 111.063 176.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.9 mmt -62.03 -37.07 83.54 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -177.283 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -65.23 -37.14 86.34 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.319 1.418 . . . . 0.0 113.053 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -65.14 -39.06 92.48 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 122.653 0.381 . . . . 0.0 110.539 175.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 96.9 t -65.12 -48.08 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 123.058 0.543 . . . . 0.0 110.459 175.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -39.35 92.23 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.161 0.984 . . . . 0.0 112.449 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 43.9 m-20 -61.31 -39.05 89.06 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.461 0.704 . . . . 0.0 111.501 175.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.2 t60 -78.75 -50.08 11.96 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.197 0.999 . . . . 0.0 111.733 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -56.84 -32.88 66.21 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.832 1.653 . . . . 0.0 114.116 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 6.6 t -72.71 -15.07 61.69 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 119.91 1.232 . . . . 0.0 112.818 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 81.7 t60 -105.27 -28.99 10.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.897 1.679 . . . . 0.0 112.639 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 30.4 t -58.5 144.77 41.32 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.105 1.762 . . . . 0.0 112.836 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -117.9 -12.25 10.18 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.602 1.561 . . . . 0.0 113.726 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -91.21 -27.16 18.65 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.209 1.004 . . . . 0.0 112.175 178.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.48 -112.33 2.32 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.764 1.173 . . . . 0.0 112.75 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.3 mttt -61.49 -19.57 62.21 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 121.588 -0.948 . . . . 0.0 113.417 178.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.85 -2.44 47.43 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.179 1.391 . . . . 0.0 113.625 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 18.1 t -59.93 144.46 48.93 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 122.323 1.058 . . . . 0.0 110.737 178.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -79.03 -8.3 58.83 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.463 1.105 . . . . 0.0 113.17 -176.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 97.6 t -89.99 115.01 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 173.273 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.66 -38.84 70.14 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -176.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -67.39 -37.99 83.99 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.796 0.838 . . . . 0.0 112.461 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 43.0 t -66.08 -56.63 10.55 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.687 1.595 . . . . 0.0 109.536 176.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -56.84 -31.44 64.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.389 1.076 . . . . 0.0 112.968 177.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.5 m -77.01 -49.89 14.36 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.027 0.931 . . . . 0.0 112.351 177.016 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 70.8 m -60.08 -36.0 76.42 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 121.529 -0.732 . . . . 0.0 111.6 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -58.87 -33.03 70.01 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.132 0.973 . . . . 0.0 112.782 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -67.09 -32.75 74.12 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 118.876 0.762 . . . . 0.0 111.671 177.222 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 1.7 mt -76.39 -45.42 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 123.289 0.636 . . . . 0.0 109.816 177.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 35.7 mm -60.57 -37.66 75.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.268 1.027 . . . . 0.0 110.735 176.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 22.7 t -58.14 -29.9 65.91 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.328 1.051 . . . . 0.0 112.252 176.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.3 t60 -63.94 -52.84 57.89 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.161 0.891 . . . . 0.0 109.995 176.477 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 39.1 m95 -61.74 -30.28 70.67 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 10.7 mtpm? -70.88 -28.61 64.69 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.458 0.703 . . . . 0.0 112.758 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -100.11 -38.12 8.67 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.951 1.464 . . . . 0.0 114.951 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.6 t -78.23 134.64 37.55 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.474 1.51 . . . . 0.0 112.929 -176.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 79.9 p -130.09 -1.67 4.6 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.646 1.578 . . . . 0.0 114.242 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 22.9 ttt-85 -83.07 145.68 29.13 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.193 1.397 . . . . 0.0 112.683 -177.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 41.9 p-80 -78.06 -30.11 49.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.509 0.724 . . . . 0.0 112.35 176.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 20.7 t0 -103.1 84.16 2.31 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.044 1.738 . . . . 0.0 111.316 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 46.8 t -139.67 135.79 17.06 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 126.85 2.06 . . . . 0.0 108.468 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -57.47 -27.48 76.44 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.17 2.58 . . . . 0.0 115.383 -176.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 16.6 t -92.14 -49.86 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 CA-C-N 119.805 1.184 . . . . 0.0 111.387 176.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 4.1 m -69.54 -39.91 77.17 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -174.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.1 tt -55.09 -57.02 21.88 Favored Pre-proline 0 N--CA 1.475 0.804 0 CA-C-O 117.748 -1.12 . . . . 0.0 112.934 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.54 -31.08 91.94 Favored 'Trans proline' 0 C--N 1.354 0.824 0 CA-C-N 121.682 1.636 . . . . 0.0 113.082 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.8 mt -70.55 -45.13 66.04 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.211 0.914 . . . . 0.0 111.601 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 60.1 mttm -60.99 -37.65 83.25 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.423 1.089 . . . . 0.0 110.898 175.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 20.4 t30 -73.3 -41.56 63.42 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.354 1.461 . . . . 0.0 112.745 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.628 0 C-N-CA 124.05 0.94 . . . . 0.0 113.453 -179.149 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.6 m-85 -60.28 -29.15 68.63 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.408 0.683 . . . . 0.0 112.277 174.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 35.9 m -68.01 -34.62 76.85 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.231 0.923 . . . . 0.0 112.916 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.4 t70 -90.03 -30.29 17.84 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.218 1.007 . . . . 0.0 113.136 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.1 tt -43.4 -58.38 2.6 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.105 2.162 . . . . 0.0 113.168 -178.23 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 44.5 p-90 -71.08 -11.45 60.96 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 -173.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -110.1 -60.08 1.84 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 116.312 1.967 . . . . 0.0 116.312 -175.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 77.9 mt -120.28 16.78 12.3 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 116.665 2.098 . . . . 0.0 116.665 -172.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 6.1 tt . . . . . 0 CA--C 1.554 1.127 0 C-N-CA 125.243 1.417 . . . . 0.0 113.349 -178.35 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 85.8 mt . . . . . 0 CA--C 1.547 0.832 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 68.0 mmm -66.03 148.07 52.37 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -177.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.05 178.18 5.67 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.688 1.995 . . . . 0.0 111.372 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 74.4 m -89.02 152.85 48.82 Favored Pre-proline 0 CA--C 1.546 0.791 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 169.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.74 -18.56 49.14 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 122.546 2.164 . . . . 0.0 115.781 -176.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -76.47 -17.08 59.48 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.04 -1.038 . . . . 0.0 112.596 177.167 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -82.79 -12.44 57.48 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.313 1.045 . . . . 0.0 112.535 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 96.4 mt -59.07 -35.88 59.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.869 1.268 . . . . 0.0 110.753 178.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -73.32 -9.8 59.08 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.811 1.244 . . . . 0.0 113.265 178.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -79.6 -20.72 46.19 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.964 0.906 . . . . 0.0 111.138 175.229 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.8 p-90 . . . . . 0 N--CA 1.468 0.441 0 C-N-CA 124.437 1.095 . . . . 0.0 113.033 177.171 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 39.9 ttmt . . . . . 0 CA--C 1.536 0.429 0 CA-C-O 119.61 -0.233 . . . . 0.0 111.495 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 96.9 mtm-85 -69.12 -33.28 73.22 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.427 -0.796 . . . . 0.0 111.181 174.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -65.36 -33.24 75.5 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 118.826 0.739 . . . . 0.0 111.367 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.44 -36.36 83.49 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 118.872 0.76 . . . . 0.0 111.052 175.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -67.01 -52.96 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 118.551 0.614 . . . . 0.0 109.63 175.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -51.94 -56.07 16.44 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.848 0.859 . . . . 0.0 111.443 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -36.05 83.05 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.26 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.0 tp60 -70.96 -41.76 70.63 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 119.234 0.925 . . . . 0.0 110.393 178.043 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.9 tt -62.18 -40.86 97.47 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.578 0.751 . . . . 0.0 109.919 177.129 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 97.1 t -59.62 -33.37 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.13 0.877 . . . . 0.0 110.942 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.0 tp -73.23 -25.55 60.78 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.875 1.216 . . . . 0.0 113.835 175.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -62.72 -30.19 71.23 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.788 1.176 . . . . 0.0 109.044 172.232 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.3 mt -72.95 -54.38 8.81 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.118 0.967 . . . . 0.0 108.513 174.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 20.4 t60 -49.4 -55.87 11.55 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.678 0.672 . . . . 0.0 111.273 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -57.65 -22.96 48.75 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -90.04 -24.65 21.12 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -88.0 -41.54 13.05 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 119.843 1.201 . . . . 0.0 112.211 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 25.4 t -59.59 -41.61 90.65 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.107 1.363 . . . . 0.0 111.108 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 6.7 pt20 . . . . . 0 CA--C 1.549 0.919 0 O-C-N 120.651 -1.281 . . . . 0.0 113.055 174.492 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 39.0 m80 . . . . . 0 CA--C 1.54 0.595 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 30.8 t -64.16 -50.05 69.71 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.643 1.177 . . . . 0.0 109.752 176.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -53.92 -43.58 69.87 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.222 1.409 . . . . 0.0 111.015 174.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 19.4 m -64.02 -55.34 22.99 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.699 0.8 . . . . 0.0 111.787 176.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.7 mmt -65.0 -34.64 78.92 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -67.37 -34.94 78.33 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 121.142 1.792 . . . . 0.0 112.081 178.021 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -66.19 -37.82 86.54 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.214 0.461 . . . . 0.0 110.46 174.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 78.7 t -64.96 -52.17 57.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 123.49 0.716 . . . . 0.0 110.448 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.11 -44.86 87.91 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.722 1.209 . . . . 0.0 112.666 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 37.7 m-20 -66.41 -20.39 66.05 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.562 0.745 . . . . 0.0 112.653 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 63.7 t60 -90.17 -50.92 5.72 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.362 1.065 . . . . 0.0 109.933 172.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.1 ttp -54.99 -34.53 63.49 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.646 1.978 . . . . 0.0 113.474 -177.155 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 14.8 t -64.12 -27.33 69.01 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 119.276 0.944 . . . . 0.0 112.403 177.125 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 41.6 m80 -98.28 -26.25 14.58 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.362 1.465 . . . . 0.0 113.302 177.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 49.6 t -63.38 132.49 51.63 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.509 1.523 . . . . 0.0 112.889 -178.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -106.67 -14.15 15.1 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.38 1.472 . . . . 0.0 113.717 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -84.31 -32.96 24.04 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.283 0.947 . . . . 0.0 111.216 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.55 -106.55 0.32 Allowed Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.066 1.317 . . . . 0.0 113.188 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.74 -21.56 63.11 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.753 -0.851 . . . . 0.0 113.2 177.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -97.86 -2.66 40.31 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.639 1.576 . . . . 0.0 113.571 177.049 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.8 t -60.13 144.59 49.44 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 122.304 1.049 . . . . 0.0 110.612 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -81.26 -10.06 59.66 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.962 1.305 . . . . 0.0 113.234 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 98.2 t -89.16 115.98 29.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 174.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.32 -41.46 72.44 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -64.08 -42.16 97.05 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.478 0.711 . . . . 0.0 112.389 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.7 t -63.12 -53.37 54.52 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.033 1.333 . . . . 0.0 109.974 176.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -56.06 -38.86 71.21 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.97 0.908 . . . . 0.0 112.375 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 25.5 m -67.06 -53.37 31.68 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.975 0.91 . . . . 0.0 113.135 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.8 m -59.34 -26.95 65.48 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.162 0.892 . . . . 0.0 112.823 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.6 -31.5 71.57 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 118.335 -0.841 . . . . 0.0 112.229 175.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -65.93 -38.67 89.25 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.921 1.237 . . . . 0.0 110.89 174.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 9.4 mt -68.39 -48.15 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.129 0.972 . . . . 0.0 110.323 179.216 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 16.8 mm -62.13 -36.29 73.49 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 123.918 0.887 . . . . 0.0 111.232 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 71.9 m -61.63 -23.71 66.22 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 176.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.7 t60 -64.58 -56.46 13.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.584 1.084 . . . . 0.0 110.268 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 55.5 m95 -61.21 -29.35 69.77 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -70.28 -30.29 67.27 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.939 0.896 . . . . 0.0 112.782 177.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -100.06 -38.91 8.36 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.2 t -80.07 133.4 36.11 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.483 1.513 . . . . 0.0 112.611 -176.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 71.7 p -130.0 1.61 4.78 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.929 1.692 . . . . 0.0 113.893 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -75.91 154.71 35.79 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.273 1.429 . . . . 0.0 113.299 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 18.8 t60 -88.26 -39.2 14.61 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.588 0.755 . . . . 0.0 110.365 172.346 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 20.1 t0 -94.96 80.49 3.66 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.915 1.686 . . . . 0.0 111.374 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.5 t -134.97 135.45 23.11 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.736 2.014 . . . . 0.0 109.123 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -59.05 -25.18 76.87 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.751 2.3 . . . . 0.0 114.153 -178.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.7 t -92.16 -52.97 9.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 119.817 1.189 . . . . 0.0 111.618 176.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 9.0 m -68.61 -37.73 80.02 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.235 1.569 . . . . 0.0 115.235 -174.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -56.27 -57.53 22.17 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-O 117.63 -1.176 . . . . 0.0 112.8 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -61.08 -31.62 90.9 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 121.933 1.755 . . . . 0.0 113.411 179.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 93.3 mt -68.13 -48.49 65.25 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.888 0.767 . . . . 0.0 111.175 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -63.95 -35.79 81.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.753 0.821 . . . . 0.0 111.37 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 49.4 t30 -64.51 -46.72 81.72 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.525 1.13 . . . . 0.0 110.894 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.77 0 C-N-CA 123.901 0.88 . . . . 0.0 112.515 176.97 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 86.6 m . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 119.46 -0.305 . . . . 0.0 111.25 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -60.11 -29.54 68.67 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.403 0.681 . . . . 0.0 112.602 176.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 70.5 m -71.04 -31.09 67.46 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.888 0.875 . . . . 0.0 113.215 178.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.1 t70 -90.05 -31.14 17.29 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.811 1.244 . . . . 0.0 112.826 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.8 tt -42.59 -60.02 1.69 Allowed 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 127.665 2.386 . . . . 0.0 113.489 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.4 p-90 -70.18 -11.36 60.84 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 115.272 1.582 . . . . 0.0 115.272 -174.025 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -111.5 -60.03 1.9 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 116.034 1.864 . . . . 0.0 116.034 -175.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 6.6 mp -120.18 20.21 12.07 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -174.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 3.0 tt . . . . . 0 N--CA 1.476 0.829 0 C-N-CA 124.979 1.311 . . . . 0.0 114.137 -178.938 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 21.3 tp . . . . . 0 CA--C 1.554 1.116 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 76.5 mmm -66.33 155.37 37.48 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 -177.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.07 167.18 15.12 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.071 2.148 . . . . 0.0 114.984 -178.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 88.2 p -91.58 162.26 32.02 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 127.202 2.201 . . . . 0.0 108.749 169.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -62.78 -24.56 74.6 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.023 1.815 . . . . 0.0 113.327 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.0 t70 -63.54 -29.12 70.43 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.756 0.823 . . . . 0.0 112.944 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 11.5 t70 -90.12 -17.58 27.42 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 75.5 mt -59.88 -38.33 75.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 CA-C-N 119.792 1.178 . . . . 0.0 110.942 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . 0.304 0.0 OUTLIER -67.98 -9.82 48.56 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 176.628 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -79.37 -29.84 42.3 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.105 -0.997 . . . . 0.0 111.77 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.27 15.0 p-90 . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 178.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 14.2 mptt . . . . . 0 N--CA 1.47 0.535 0 CA-C-O 118.309 -0.853 . . . . 0.0 110.387 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -55.79 -43.93 77.3 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 119.615 1.098 . . . . 0.0 111.586 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -60.71 -38.56 85.46 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.699 0.8 . . . . 0.0 111.582 176.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 93.2 mt -66.3 -38.79 88.54 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.36 0.664 . . . . 0.0 111.637 177.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -62.29 -54.57 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 119.027 0.83 . . . . 0.0 109.754 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -53.63 -55.57 24.72 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.818 1.247 . . . . 0.0 111.095 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -33.36 75.65 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -69.75 -46.56 65.59 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.809 1.186 . . . . 0.0 109.781 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 5.9 tp -59.22 -41.95 89.84 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.56 0.744 . . . . 0.0 111.195 177.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 63.4 t -59.08 -31.89 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-N 119.996 1.271 . . . . 0.0 111.485 176.171 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 5.8 tp -72.49 -31.42 65.38 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.707 -1.245 . . . . 0.0 112.871 175.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.0 mp -60.48 -31.14 70.18 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 120.249 1.386 . . . . 0.0 109.603 172.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.6 mt -71.1 -51.7 23.6 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.546 0.738 . . . . 0.0 109.975 176.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 21.6 t60 -56.29 -55.8 28.93 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.264 0.625 . . . . 0.0 111.071 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -50.39 -41.74 52.5 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.717 1.207 . . . . 0.0 114.004 -175.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -73.93 -44.44 55.04 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.212 0.915 . . . . 0.0 112.569 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 44.4 mttm -65.73 -43.13 89.96 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.364 1.066 . . . . 0.0 111.229 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 42.2 t -62.21 -47.35 84.83 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.196 1.798 . . . . 0.0 110.388 175.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 14.7 tt0 . . . . . 0 CA--C 1.539 0.548 0 O-C-N 121.302 -0.874 . . . . 0.0 112.881 177.413 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 32.6 m80 . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 43.5 t -67.15 -51.45 53.69 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.292 1.437 . . . . 0.0 109.656 177.469 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -57.11 -34.93 68.85 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.912 1.285 . . . . 0.0 111.6 174.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.5 m -69.21 -60.97 1.99 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.239 1.016 . . . . 0.0 110.908 175.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.1 mmt -59.4 -35.34 73.78 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -177.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -66.56 -34.47 77.98 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 120.659 1.572 . . . . 0.0 112.722 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -69.73 -37.36 76.47 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.914 -0.491 . . . . 0.0 110.311 173.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 59.3 t -64.78 -40.84 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-O 118.966 -0.54 . . . . 0.0 110.264 175.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.94 -43.78 94.78 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.908 1.283 . . . . 0.0 111.014 175.715 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -63.7 -36.6 84.37 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.222 0.609 . . . . 0.0 112.006 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 63.5 t60 -74.72 -52.55 11.27 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.741 0.816 . . . . 0.0 110.687 177.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.3 ttp -58.24 -33.27 69.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.741 1.616 . . . . 0.0 113.668 -176.495 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 3.9 t -75.45 -10.06 59.12 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 119.657 1.117 . . . . 0.0 113.275 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 46.6 m80 -117.37 -16.72 10.24 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.761 1.625 . . . . 0.0 113.717 177.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 38.1 t -57.57 144.72 36.2 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.466 1.506 . . . . 0.0 112.946 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -103.77 -15.12 15.82 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.046 1.738 . . . . 0.0 113.564 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -106.94 -34.0 7.34 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.329 1.052 . . . . 0.0 112.448 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.5 -105.73 0.24 Allowed Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.828 1.204 . . . . 0.0 114.096 177.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -60.09 -21.9 62.07 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 121.133 -1.216 . . . . 0.0 112.828 177.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -100.78 0.2 38.32 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.272 1.829 . . . . 0.0 113.522 176.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 12.5 t -63.67 143.28 57.97 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 122.261 1.029 . . . . 0.0 110.375 178.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -84.6 -6.48 59.37 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.761 1.224 . . . . 0.0 113.51 -176.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 88.0 t -83.96 120.91 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 173.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.66 -44.38 69.59 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.043 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 72.3 m80 -62.28 -42.3 99.23 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 50.2 t -64.91 -55.95 16.2 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.78 1.232 . . . . 0.0 111.311 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.61 -32.75 70.69 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.371 0.668 . . . . 0.0 112.482 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 74.2 m -73.63 -47.0 43.43 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.543 0.737 . . . . 0.0 111.549 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 69.6 m -62.27 -36.61 82.59 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.584 1.154 . . . . 0.0 112.1 178.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -61.65 -31.77 71.89 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.318 -0.864 . . . . 0.0 113.009 175.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -69.65 -28.53 65.97 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.146 0.884 . . . . 0.0 111.27 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.8 mm -70.83 -50.38 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 123.888 0.875 . . . . 0.0 109.645 174.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 12.9 mm -61.34 -42.22 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 124.949 1.299 . . . . 0.0 111.425 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 50.2 m -60.41 -20.81 61.03 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.431 0.901 . . . . 0.0 113.431 179.048 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.3 t60 -64.78 -55.9 16.89 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.474 1.034 . . . . 0.0 110.728 176.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 50.1 m95 -62.54 -24.72 67.66 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -74.08 -30.74 62.52 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.539 0.736 . . . . 0.0 112.461 176.527 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -100.05 -38.12 8.69 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.9 t -78.53 135.23 37.26 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.426 1.49 . . . . 0.0 112.373 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 79.7 p -129.97 2.17 4.81 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.518 1.527 . . . . 0.0 114.175 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -82.23 152.17 26.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.236 1.414 . . . . 0.0 113.499 -178.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 15.0 t60 -86.62 -37.92 17.59 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.862 0.865 . . . . 0.0 109.934 171.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 21.4 t0 -94.3 78.48 3.94 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.017 1.727 . . . . 0.0 111.336 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.8 t -132.67 135.44 26.11 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 126.819 2.047 . . . . 0.0 109.232 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -59.79 -24.24 75.1 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.798 2.332 . . . . 0.0 114.027 -178.616 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 8.1 t -92.22 -52.99 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-N 119.608 1.095 . . . . 0.0 111.855 176.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 15.2 m -68.97 -40.4 78.86 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -175.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.8 tt -55.92 -56.12 33.85 Favored Pre-proline 0 CA--C 1.545 0.785 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.571 -178.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -61.7 -30.15 84.7 Favored 'Trans proline' 0 C--N 1.355 0.873 0 CA-C-N 121.679 1.635 . . . . 0.0 113.287 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 91.2 mt -69.73 -45.7 67.58 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.873 1.215 . . . . 0.0 111.494 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -63.26 -35.85 81.72 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.917 0.887 . . . . 0.0 110.749 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 22.9 t30 -71.41 -40.12 70.68 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.004 1.322 . . . . 0.0 112.197 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.613 0 C-N-CA 124.804 1.242 . . . . 0.0 113.251 178.941 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 99.4 m . . . . . 0 N--CA 1.476 0.862 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -60.11 -29.3 68.52 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 177.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 69.8 m -70.55 -29.94 66.54 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.781 0.832 . . . . 0.0 112.911 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.9 t70 -90.22 -30.37 17.6 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.615 1.166 . . . . 0.0 113.156 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.5 tt -45.66 -59.96 2.46 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.88 2.072 . . . . 0.0 113.252 -177.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.4 p-90 -67.99 -8.5 37.94 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -174.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -111.99 -58.07 2.18 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 44.1 mt -120.15 19.95 12.13 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 116.061 1.874 . . . . 0.0 116.061 -171.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.1 tt . . . . . 0 CA--C 1.55 0.957 0 C-N-CA 125.871 1.668 . . . . 0.0 114.999 -178.216 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 35.6 tp . . . . . 0 CA--C 1.549 0.917 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 47.9 mmm -62.19 153.24 30.95 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 -177.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 94.7 mt -125.21 155.96 39.23 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 127.336 2.254 . . . . 0.0 112.337 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 33.5 p -75.95 160.01 79.5 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 170.431 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -61.81 -17.43 55.11 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 121.83 1.687 . . . . 0.0 114.139 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 28.8 t70 -77.08 -25.76 52.67 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.216 1.006 . . . . 0.0 112.877 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -77.89 -14.11 59.66 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.859 0.864 . . . . 0.0 112.703 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 77.7 mt -58.41 -37.46 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.892 1.277 . . . . 0.0 110.615 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -68.14 -9.96 50.52 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.068 1.747 . . . . 0.0 113.113 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -86.71 -27.05 23.94 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.666 1.186 . . . . 0.0 112.561 178.271 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 . . . . . 0 N--CA 1.477 0.913 0 C-N-CA 123.981 0.912 . . . . 0.0 112.349 174.871 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 33.4 mmtp . . . . . 0 N--CA 1.471 0.581 0 CA-C-O 118.233 -0.889 . . . . 0.0 112.116 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -54.35 -43.86 71.65 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 120.039 1.29 . . . . 0.0 112.106 178.228 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -60.7 -31.2 70.48 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 96.4 mt -71.41 -41.16 69.92 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.2 0.909 . . . . 0.0 111.705 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.9 mt -64.22 -51.75 64.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -55.94 -54.64 42.26 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.636 1.174 . . . . 0.0 111.258 177.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -35.6 80.79 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -177.281 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -66.35 -46.25 77.43 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.765 1.166 . . . . 0.0 109.773 176.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 10.3 tp -59.94 -42.03 93.11 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.118 0.567 . . . . 0.0 111.017 176.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 84.3 t -60.93 -31.01 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.661 1.119 . . . . 0.0 111.285 175.558 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.6 tp -74.79 -28.18 60.62 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.228 1.376 . . . . 0.0 112.816 174.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 8.6 mp -61.31 -28.13 68.98 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 120.288 1.404 . . . . 0.0 108.934 171.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.9 mt -74.55 -58.7 3.12 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.079 -0.962 . . . . 0.0 108.926 174.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 25.2 t60 -47.6 -55.37 9.43 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.062 0.846 . . . . 0.0 110.438 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -51.0 -36.08 37.35 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.355 1.062 . . . . 0.0 113.74 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -83.62 -37.8 22.41 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 178.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -70.06 -37.32 75.48 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 119.848 1.204 . . . . 0.0 110.578 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 36.5 t -65.95 -43.04 89.12 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.813 2.045 . . . . 0.0 110.899 176.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 24.5 tt0 . . . . . 0 N--CA 1.476 0.858 0 C-N-CA 124.631 1.172 . . . . 0.0 113.135 175.957 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 54.2 m80 . . . . . 0 CA--C 1.539 0.542 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 24.6 t -68.96 -53.13 22.45 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.532 1.133 . . . . 0.0 108.605 175.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 20.6 ttt85 -55.12 -32.45 62.06 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.517 1.527 . . . . 0.0 111.644 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.2 m -73.36 -59.06 2.89 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.17 1.388 . . . . 0.0 111.336 174.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.7 mmt -62.28 -36.25 81.5 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -65.15 -29.29 70.11 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 120.588 1.54 . . . . 0.0 112.711 178.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -74.9 -38.52 61.82 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.35 0.66 . . . . 0.0 110.447 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 84.1 t -63.17 -44.28 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.729 0.695 . . . . 0.0 110.011 175.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -47.65 84.06 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.189 0.996 . . . . 0.0 110.784 177.105 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -63.81 -22.96 67.17 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 176.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 71.5 t60 -83.94 -49.78 8.66 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.998 0.817 . . . . 0.0 109.632 174.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 34.8 ttp -57.57 -29.4 64.4 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.418 1.887 . . . . 0.0 113.559 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 20.2 p -69.85 -29.1 66.26 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 121.087 -1.008 . . . . 0.0 112.528 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -95.79 -26.34 15.7 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.894 1.678 . . . . 0.0 112.992 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 18.0 t -60.63 150.26 32.46 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.598 1.559 . . . . 0.0 112.873 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -121.25 -13.18 8.53 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.888 1.675 . . . . 0.0 113.638 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -95.57 -27.64 15.24 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.254 1.022 . . . . 0.0 112.421 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.55 -113.07 2.77 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 124.534 1.064 . . . . 0.0 113.132 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -63.46 -15.58 58.16 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.149 -1.206 . . . . 0.0 113.644 178.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -97.92 -1.71 42.28 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.242 1.417 . . . . 0.0 113.128 175.128 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 18.5 t -60.33 144.02 51.6 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 122.278 1.037 . . . . 0.0 110.839 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 58.1 mm-40 -78.88 -7.75 58.22 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.562 1.145 . . . . 0.0 113.0 -176.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 93.8 t -90.23 116.57 31.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 173.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.34 -38.6 68.97 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -65.93 -44.74 84.23 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.212 0.605 . . . . 0.0 112.247 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 40.4 t -59.94 -55.9 28.32 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.992 1.317 . . . . 0.0 110.728 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.95 -22.59 64.58 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.7 m -83.4 -51.56 7.29 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.882 0.873 . . . . 0.0 111.368 176.254 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 57.7 m -58.51 -35.98 73.1 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.269 -0.895 . . . . 0.0 112.354 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 37.3 tpt85 -63.7 -24.76 67.91 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.48 -0.762 . . . . 0.0 112.982 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -72.62 -30.4 64.31 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.015 0.825 . . . . 0.0 111.152 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.0 mm -70.51 -44.73 76.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 175.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 26.7 mm -60.22 -37.91 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.725 1.21 . . . . 0.0 110.645 176.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 67.4 m -61.64 -25.23 67.24 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.047 0.939 . . . . 0.0 113.324 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.2 t60 -62.84 -56.73 14.8 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.87 1.214 . . . . 0.0 110.838 179.301 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 51.8 m95 -62.85 -21.47 65.98 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 64.0 mttm -82.19 -26.77 33.07 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.331 1.052 . . . . 0.0 112.799 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -100.12 -43.64 6.26 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.955 1.302 . . . . 0.0 113.341 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 9.4 t -84.0 133.53 34.67 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.579 1.952 . . . . 0.0 110.958 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 69.4 p -129.97 -4.69 4.52 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.644 1.35 . . . . 0.0 114.644 -177.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 77.1 mtp85 -66.19 153.39 42.56 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.815 1.646 . . . . 0.0 113.64 -178.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -86.97 -26.45 23.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.444 0.698 . . . . 0.0 111.349 171.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 21.3 t0 -108.06 78.7 1.2 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.865 2.066 . . . . 0.0 111.433 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.0 t -136.48 136.01 21.49 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 127.289 2.236 . . . . 0.0 108.334 178.431 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -59.01 -24.28 72.62 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.763 2.309 . . . . 0.0 114.068 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.9 t -92.15 -52.01 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.694 1.134 . . . . 0.0 111.288 175.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 10.8 m -68.6 -42.1 78.63 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.974 1.472 . . . . 0.0 114.974 -175.507 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.2 tt -52.27 -57.48 15.18 Favored Pre-proline 0 CA--C 1.547 0.844 0 CA-C-O 117.802 -1.094 . . . . 0.0 113.316 -177.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -60.46 -31.65 92.79 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.78 1.654 . . . . 0.0 113.54 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.6 mt -73.25 -44.58 59.14 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.659 0.784 . . . . 0.0 112.255 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -58.94 -37.86 77.69 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.842 0.857 . . . . 0.0 110.305 174.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 38.5 t30 -73.37 -36.57 66.11 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.94 1.696 . . . . 0.0 113.385 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -178.207 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 91.2 m . . . . . 0 N--CA 1.477 0.893 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.35 -29.37 68.85 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.157 0.983 . . . . 0.0 112.956 174.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 18.2 m -69.26 -33.92 73.98 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -90.18 -28.07 19.15 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.062 0.945 . . . . 0.0 112.985 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -44.76 -60.13 2.18 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 126.761 2.024 . . . . 0.0 113.932 -176.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -68.03 -10.24 52.16 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -171.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.67 -56.59 2.36 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -176.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 53.2 mt -119.99 11.4 11.74 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 -171.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.552 1.03 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 27.8 tp . . . . . 0 CA--C 1.553 1.062 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.85 137.85 56.9 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -174.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -125.03 139.37 53.87 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 128.088 2.555 . . . . 0.0 111.994 -179.032 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 73.8 p -64.79 146.29 98.62 Favored Pre-proline 0 N--CA 1.473 0.725 0 C-N-CA 124.109 0.963 . . . . 0.0 113.237 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -60.79 -30.26 89.86 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.816 2.344 . . . . 0.0 114.393 -177.122 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.27 -22.57 66.31 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.526 -0.734 . . . . 0.0 112.623 176.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 13.6 t70 -90.06 -9.85 46.95 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 84.7 mt -55.92 -37.81 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-N 119.638 1.108 . . . . 0.0 111.035 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -64.07 -9.73 18.02 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.133 1.373 . . . . 0.0 113.961 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.4 tp60 -77.43 -37.87 50.8 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.079 -1.013 . . . . 0.0 111.323 174.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 . . . . . 0 N--CA 1.472 0.638 0 C-N-CA 123.486 0.714 . . . . 0.0 111.979 178.783 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 72.9 mmtt . . . . . 0 N--CA 1.469 0.499 0 CA-C-O 119.536 -0.269 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -53.64 -44.3 69.47 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.092 0.957 . . . . 0.0 112.16 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -63.5 -30.98 72.02 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 177.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 75.9 mt -70.14 -40.93 74.5 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.618 0.767 . . . . 0.0 110.031 175.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.5 mt -60.65 -50.78 79.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.19 -53.18 57.04 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.413 1.085 . . . . 0.0 111.516 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -35.45 79.56 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -69.41 -46.77 66.05 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.951 0.796 . . . . 0.0 110.865 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.7 tt -58.81 -43.1 90.51 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.034 0.934 . . . . 0.0 110.379 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 60.2 t -61.56 -31.81 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.979 0.809 . . . . 0.0 111.515 175.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 33.6 tp -67.02 -37.55 84.34 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.606 -1.309 . . . . 0.0 111.976 174.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.93 -25.57 63.58 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 119.326 0.966 . . . . 0.0 110.955 176.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 7.0 mt -74.07 -55.12 6.49 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.734 0.814 . . . . 0.0 109.737 176.047 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 14.2 t60 -56.96 -50.48 72.51 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 119.192 -0.432 . . . . 0.0 110.898 178.054 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -60.01 -22.53 62.71 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -178.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -90.14 -31.06 17.25 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.975 -1.078 . . . . 0.0 112.927 173.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 58.1 mttm -80.09 -40.01 28.45 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.104 1.362 . . . . 0.0 112.6 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.5 t -63.06 -45.79 90.53 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.527 1.931 . . . . 0.0 111.44 177.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.7 pt20 . . . . . 0 CA--C 1.545 0.772 0 O-C-N 121.292 -0.88 . . . . 0.0 111.783 175.382 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 35.9 m80 . . . . . 0 N--CA 1.472 0.647 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 40.4 t -62.32 -46.74 87.35 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.27 1.028 . . . . 0.0 109.91 176.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -54.92 -35.22 63.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.36 1.464 . . . . 0.0 112.146 175.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 49.3 m -72.07 -60.18 2.36 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.614 0.765 . . . . 0.0 110.807 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 15.6 mmt -60.34 -34.03 73.25 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -64.88 -33.58 76.35 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 120.566 1.53 . . . . 0.0 112.675 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -72.14 -37.91 69.34 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.131 0.572 . . . . 0.0 110.197 174.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 66.9 t -62.45 -46.61 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 122.948 0.499 . . . . 0.0 110.696 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.0 -43.7 98.5 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.975 0.91 . . . . 0.0 111.799 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -64.86 -32.89 74.81 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 176.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 61.0 t60 -75.04 -52.07 11.99 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.728 0.811 . . . . 0.0 110.204 175.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 40.6 ttp -56.73 -31.16 64.26 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.524 1.93 . . . . 0.0 114.304 -177.097 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.7 t -77.98 -9.94 59.35 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 120.059 1.3 . . . . 0.0 112.99 176.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -118.93 -14.0 9.43 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.749 1.619 . . . . 0.0 113.916 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 43.5 t -56.61 144.65 31.16 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.684 1.594 . . . . 0.0 113.045 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -96.71 -13.84 22.45 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.003 1.721 . . . . 0.0 113.588 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -118.7 -30.68 5.05 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.268 1.027 . . . . 0.0 113.558 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.21 -107.58 0.6 Allowed Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.717 1.151 . . . . 0.0 113.436 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -61.62 -20.59 63.52 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 121.053 -1.263 . . . . 0.0 112.945 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -100.51 1.52 41.11 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.062 1.745 . . . . 0.0 113.561 176.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.5 t -63.54 139.86 58.81 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.262 1.025 . . . . 0.0 110.013 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -81.44 0.14 38.98 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -175.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 16.6 t -90.49 125.3 43.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.732 1.213 . . . . 0.0 109.159 176.208 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.38 -28.1 51.83 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -175.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -90.06 -18.63 25.57 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.686 1.735 . . . . 0.0 115.686 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 52.7 t -83.17 -59.86 2.33 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.126 1.37 . . . . 0.0 111.076 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.02 -29.53 65.38 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 4.7 p -73.57 -54.92 7.06 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 124.958 1.303 . . . . 0.0 111.822 176.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 53.0 m -59.4 -34.68 72.74 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.47 0.708 . . . . 0.0 111.692 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 45.1 tpt85 -62.86 -30.02 71.2 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.229 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -67.78 -34.7 77.31 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.307 0.958 . . . . 0.0 110.963 175.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 10.2 mt -67.82 -45.64 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 124.15 0.98 . . . . 0.0 109.731 176.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 15.0 mm -60.76 -36.74 73.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.918 0.887 . . . . 0.0 111.229 176.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.14 -21.17 66.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 177.055 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.0 t60 -64.11 -59.97 3.8 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.422 1.01 . . . . 0.0 110.726 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 62.4 m95 -60.62 -26.95 67.39 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 63.4 mttm -71.5 -34.76 70.41 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.831 0.852 . . . . 0.0 112.787 178.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.14 -32.31 10.97 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 178.361 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 9.6 t -78.21 133.78 37.69 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.444 1.498 . . . . 0.0 111.996 -178.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 71.5 p -130.09 -1.04 4.64 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.335 1.454 . . . . 0.0 114.492 -178.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -80.14 150.26 30.27 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.738 1.215 . . . . 0.0 112.685 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.1 p-80 -84.37 -36.13 22.69 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.329 0.652 . . . . 0.0 111.569 175.216 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.8 t0 -94.19 70.05 3.8 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.069 1.748 . . . . 0.0 111.854 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 47.7 t -122.99 134.2 24.94 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 126.329 1.852 . . . . 0.0 109.524 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -58.33 -25.64 73.68 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.927 2.418 . . . . 0.0 114.36 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 39.3 t -92.12 -52.55 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 119.209 0.913 . . . . 0.0 111.65 176.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 7.8 m -69.73 -36.97 76.31 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -175.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -57.36 -57.12 27.26 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 117.625 -1.178 . . . . 0.0 112.337 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -59.94 -30.9 92.82 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.778 1.652 . . . . 0.0 113.197 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 94.5 mt -70.28 -47.02 63.1 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.183 0.901 . . . . 0.0 111.869 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -63.64 -37.97 89.36 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.725 0.693 . . . . 0.0 110.635 176.201 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 34.3 t30 -65.47 -36.55 84.23 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.638 1.175 . . . . 0.0 112.267 176.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.699 0 C-N-CA 124.304 1.041 . . . . 0.0 113.325 178.54 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 6.2 m . . . . . 0 N--CA 1.475 0.796 0 N-CA-C 110.832 -0.062 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -60.24 -31.14 69.92 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.527 0.731 . . . . 0.0 112.49 176.284 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 49.0 m -69.86 -29.32 66.52 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.863 0.756 . . . . 0.0 112.871 177.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.0 t70 -90.17 -29.76 18.05 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.776 1.231 . . . . 0.0 113.23 176.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.1 tt -45.49 -60.0 2.41 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.943 2.097 . . . . 0.0 113.42 -177.572 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.0 p-90 -69.6 -10.49 58.41 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -173.324 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -109.6 -53.77 2.63 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 115.748 1.759 . . . . 0.0 115.748 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 59.6 mt -119.9 11.61 11.86 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 116.263 1.949 . . . . 0.0 116.263 -172.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 7.0 tt . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 124.249 1.019 . . . . 0.0 111.279 178.914 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 98.5 mt . . . . . 0 CA--C 1.548 0.896 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 71.6 mmm -62.39 151.49 36.81 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.09 168.0 14.0 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.874 2.07 . . . . 0.0 110.866 178.38 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 59.4 m -75.49 145.6 79.51 Favored Pre-proline 0 CA--C 1.546 0.825 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 169.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -57.02 -18.66 29.35 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.755 2.303 . . . . 0.0 115.527 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -77.16 -24.29 51.52 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.531 1.133 . . . . 0.0 112.723 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 18.5 t70 -81.84 -9.91 59.47 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.028 0.931 . . . . 0.0 113.221 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 67.7 mt -55.88 -35.24 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.277 1.431 . . . . 0.0 110.283 175.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -67.06 -9.87 43.87 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.784 1.634 . . . . 0.0 113.643 178.038 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -82.28 -27.04 32.59 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.034 0.934 . . . . 0.0 111.7 176.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.3 p-90 . . . . . 0 N--CA 1.472 0.632 0 CA-C-O 118.106 -0.95 . . . . 0.0 112.316 176.362 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 54.5 mtpt . . . . . 0 N--CA 1.47 0.566 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -50.24 -43.76 53.1 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.77 1.628 . . . . 0.0 113.018 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -61.7 -32.61 72.83 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 177.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 83.2 mt -71.72 -39.34 70.18 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.345 1.058 . . . . 0.0 110.985 177.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 3.0 mt -62.79 -52.45 59.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.343 0.657 . . . . 0.0 109.583 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -56.18 -58.26 8.71 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.634 1.174 . . . . 0.0 111.218 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -35.78 81.72 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -177.447 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -65.62 -43.07 90.7 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.802 1.183 . . . . 0.0 110.332 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 8.0 tp -62.06 -39.89 93.92 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.25 0.62 . . . . 0.0 110.627 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 63.3 t -60.86 -34.3 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.131 0.878 . . . . 0.0 110.802 174.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 3.4 tp -71.48 -27.77 63.48 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 120.286 1.403 . . . . 0.0 112.853 175.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.9 mp -63.51 -29.2 70.51 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 120.523 1.51 . . . . 0.0 109.63 173.446 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.1 mt -75.55 -51.39 13.02 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.99 0.916 . . . . 0.0 108.739 174.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 30.6 t60 -53.31 -55.9 20.94 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 123.652 0.781 . . . . 0.0 110.827 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.97 -41.97 65.07 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.09 0.956 . . . . 0.0 113.338 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -72.34 -42.65 65.12 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.537 -0.727 . . . . 0.0 112.399 178.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 56.1 mttm -71.01 -36.47 72.43 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.638 1.175 . . . . 0.0 112.229 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 12.0 t -67.69 -41.44 83.61 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.44 1.896 . . . . 0.0 109.834 175.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.0 tt0 . . . . . 0 CA--C 1.543 0.679 0 C-N-CA 124.357 1.063 . . . . 0.0 110.347 172.392 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 41.2 m80 . . . . . 0 CA--C 1.538 0.494 0 N-CA-C 113.032 0.752 . . . . 0.0 113.032 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 40.7 t -67.55 -51.92 44.95 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.012 1.325 . . . . 0.0 109.678 177.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -57.15 -38.77 74.03 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.7 1.2 . . . . 0.0 111.123 174.082 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.9 m -65.98 -57.06 8.66 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.465 1.106 . . . . 0.0 111.596 177.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 15.0 mmt -63.41 -37.07 85.86 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 118.235 -0.888 . . . . 0.0 113.147 -177.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -65.34 -32.69 74.46 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 121.143 1.792 . . . . 0.0 112.084 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -69.92 -38.93 76.38 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.911 -0.493 . . . . 0.0 110.777 173.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 89.0 t -64.66 -42.73 95.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 118.791 0.723 . . . . 0.0 110.436 175.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.47 -45.98 84.21 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.344 1.057 . . . . 0.0 110.374 176.525 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -66.07 -21.54 66.37 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 177.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 60.3 t60 -86.43 -49.56 7.53 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.64 0.776 . . . . 0.0 109.697 174.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -58.31 -27.44 64.1 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.254 1.822 . . . . 0.0 113.532 -177.511 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 19.4 p -72.34 -26.54 61.96 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.519 1.128 . . . . 0.0 112.618 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 80.3 t60 -102.36 -21.83 14.22 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.06 1.744 . . . . 0.0 113.523 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 25.0 t -57.71 143.06 43.13 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.281 1.432 . . . . 0.0 113.144 -177.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -107.88 -15.7 14.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.999 1.72 . . . . 0.0 113.418 -178.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -103.23 -32.82 9.42 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.561 1.144 . . . . 0.0 112.281 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.56 -105.87 0.26 Allowed Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.979 1.276 . . . . 0.0 113.869 177.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -59.15 -22.13 60.45 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.31 -1.112 . . . . 0.0 112.943 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -102.59 1.78 35.24 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.398 1.879 . . . . 0.0 113.828 177.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 19.5 t -62.32 141.49 58.26 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.216 1.006 . . . . 0.0 110.575 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -81.74 -5.46 58.16 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.324 1.05 . . . . 0.0 113.333 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 97.8 t -86.86 115.57 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 172.417 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.09 -39.59 69.47 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -176.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.34 -40.89 96.78 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.659 0.784 . . . . 0.0 112.552 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.2 t -65.25 -57.16 9.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.469 1.508 . . . . 0.0 110.818 178.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -61.1 -27.65 68.52 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 68.5 m -76.85 -45.27 29.03 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.381 -0.825 . . . . 0.0 111.198 175.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 64.0 m -62.84 -35.98 81.71 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.239 1.016 . . . . 0.0 111.554 176.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 3.3 mmm-85 -61.81 -30.39 70.79 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -68.37 -29.56 68.3 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.363 0.983 . . . . 0.0 111.243 176.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 1.8 mm -73.28 -47.01 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 176.767 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 24.6 mm -61.15 -37.99 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.947 1.299 . . . . 0.0 111.571 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 49.1 m -62.78 -21.28 65.75 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.961 0.904 . . . . 0.0 113.222 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.6 t60 -66.24 -60.47 2.76 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.334 0.97 . . . . 0.0 110.448 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 67.2 m95 -59.6 -28.99 67.66 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 89.7 mttt -67.79 -36.09 79.83 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.652 0.781 . . . . 0.0 113.03 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.18 -31.82 11.2 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.1 t -79.22 135.19 36.71 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.198 1.399 . . . . 0.0 112.165 -177.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.7 p -130.1 -2.27 4.56 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.248 1.419 . . . . 0.0 114.644 -177.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -81.75 149.83 28.23 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.736 1.214 . . . . 0.0 112.876 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -84.56 -30.99 24.61 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.549 0.739 . . . . 0.0 111.493 174.297 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.3 t0 -97.33 69.93 2.28 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.228 1.811 . . . . 0.0 111.346 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.9 t -126.14 135.02 26.54 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 126.296 1.839 . . . . 0.0 109.723 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -57.76 -25.64 69.53 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 123.049 2.499 . . . . 0.0 114.606 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 14.7 t -92.23 -50.89 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 119.48 1.036 . . . . 0.0 111.795 176.282 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 6.9 m -70.44 -40.28 73.87 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -174.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.4 tt -54.43 -55.94 32.07 Favored Pre-proline 0 CA--C 1.547 0.862 0 CA-C-O 117.825 -1.083 . . . . 0.0 112.854 -178.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -60.92 -30.27 89.66 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.761 1.641 . . . . 0.0 113.454 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.88 -44.17 66.87 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.41 1.004 . . . . 0.0 111.645 177.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -64.97 -31.12 72.2 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.7 0.8 . . . . 0.0 111.35 175.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 32.4 t30 -75.98 -37.13 58.87 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.057 1.343 . . . . 0.0 112.074 176.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.653 0 C-N-CA 124.565 1.146 . . . . 0.0 113.53 -179.437 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 85.9 m . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 119.725 -0.179 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -60.01 -27.09 66.59 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.6 0.76 . . . . 0.0 112.71 176.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 45.5 m -74.79 -30.62 61.5 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.931 0.892 . . . . 0.0 113.06 178.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.2 t70 -90.12 -29.38 18.34 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.581 1.152 . . . . 0.0 112.878 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -43.31 -60.15 1.81 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 127.515 2.326 . . . . 0.0 113.933 -177.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 51.7 p-90 -68.59 -9.79 51.87 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 -172.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -111.96 -56.83 2.34 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 -177.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 63.9 mt -120.02 14.26 12.3 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -170.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.8 tt . . . . . 0 CA--C 1.552 1.054 0 C-N-CA 125.795 1.638 . . . . 0.0 113.842 179.388 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 25.3 tp . . . . . 0 CA--C 1.55 0.977 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.1 141.58 57.4 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -175.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.3 tt -125.16 142.39 51.52 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 128.657 2.783 . . . . 0.0 111.158 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 40.7 t -66.44 142.69 97.85 Favored Pre-proline 0 N--CA 1.477 0.878 0 C-N-CA 124.088 0.955 . . . . 0.0 112.372 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.66 -21.4 47.01 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.76 2.306 . . . . 0.0 115.445 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.7 t70 -75.78 -24.81 56.02 Favored 'General case' 0 CA--C 1.549 0.921 0 O-C-N 121.395 -0.815 . . . . 0.0 112.164 176.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -83.79 -9.72 58.59 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.371 1.869 . . . . 0.0 112.569 177.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 85.2 mt -56.02 -31.15 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.429 1.013 . . . . 0.0 109.678 174.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -67.85 -9.87 48.28 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.011 1.324 . . . . 0.0 113.703 176.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -80.78 -25.14 38.1 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.089 1.356 . . . . 0.0 111.803 177.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 4.5 p-90 . . . . . 0 N--CA 1.472 0.66 0 C-N-CA 124.6 1.16 . . . . 0.0 113.455 177.369 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 54.0 mttp . . . . . 0 N--CA 1.471 0.616 0 CA-C-O 119.036 -0.507 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -54.56 -46.05 73.59 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.22 0.918 . . . . 0.0 111.876 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -62.3 -30.16 70.95 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 177.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.49 -38.82 71.15 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.658 0.783 . . . . 0.0 110.649 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.6 mt -64.32 -53.14 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -53.17 -51.98 60.28 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.399 1.08 . . . . 0.0 111.461 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.53 -34.51 78.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -179.109 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -71.0 -49.62 43.19 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.815 0.734 . . . . 0.0 110.136 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.5 tt -58.0 -44.8 87.43 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.116 1.366 . . . . 0.0 111.178 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 88.5 t -59.57 -32.94 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 119.457 1.026 . . . . 0.0 111.662 176.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 4.4 tp -74.41 -24.45 59.1 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.847 1.203 . . . . 0.0 113.086 175.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.2 mp -62.77 -31.14 72.05 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 120.546 1.521 . . . . 0.0 109.08 171.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 5.6 mt -70.02 -53.19 18.73 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.123 0.969 . . . . 0.0 109.476 175.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.4 t60 -54.82 -56.04 23.68 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.09 0.556 . . . . 0.0 110.717 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.28 -27.23 54.63 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -86.78 -26.38 24.15 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.467 1.03 . . . . 0.0 113.392 176.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 43.9 mttm -89.94 -36.3 15.08 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.186 1.794 . . . . 0.0 112.683 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.3 t -61.68 -47.96 82.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.957 2.103 . . . . 0.0 111.273 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 13.3 pt20 . . . . . 0 CA--C 1.549 0.939 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 177.167 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 55.4 m80 . . . . . 0 N--CA 1.472 0.671 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.7 t -69.18 -50.72 45.03 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.763 1.225 . . . . 0.0 108.967 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 19.0 tpp85 -55.9 -36.15 67.34 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.412 1.485 . . . . 0.0 111.733 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 8.2 m -69.46 -57.59 5.05 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.145 1.378 . . . . 0.0 111.171 176.286 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.6 mmt -64.33 -35.48 80.99 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -177.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -63.94 -32.35 73.86 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 120.889 1.677 . . . . 0.0 112.359 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -72.32 -42.39 65.47 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.372 0.669 . . . . 0.0 110.46 174.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 76.8 t -60.51 -47.78 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 123.221 0.608 . . . . 0.0 110.797 176.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.18 -45.16 94.08 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.557 1.143 . . . . 0.0 112.377 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 24.4 m-80 -63.31 -33.59 75.85 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 177.292 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 66.9 t60 -75.24 -49.42 19.38 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.221 0.609 . . . . 0.0 110.827 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.7 ttp -57.37 -31.21 65.55 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.93 1.692 . . . . 0.0 114.286 -176.194 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 13.1 t -77.85 -14.41 59.57 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.974 1.261 . . . . 0.0 112.535 176.079 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 84.3 t60 -99.86 -29.39 12.62 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.771 1.628 . . . . 0.0 111.774 175.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 19.0 t -60.78 152.38 27.14 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.548 1.939 . . . . 0.0 112.513 179.081 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -127.44 -10.46 5.72 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.381 1.472 . . . . 0.0 114.024 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -92.28 -25.23 18.69 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.071 0.948 . . . . 0.0 112.593 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 55.15 -115.64 5.91 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.259 0.933 . . . . 0.0 112.582 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 62.7 tttp -60.63 -21.28 62.57 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.356 -1.085 . . . . 0.0 112.998 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.07 -1.66 57.75 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.753 1.221 . . . . 0.0 113.628 177.066 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.9 t -64.65 141.49 58.75 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.056 0.932 . . . . 0.0 109.83 177.439 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -80.48 -5.21 56.28 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 90.4 t -89.51 113.69 26.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.64 -40.82 66.14 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -176.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -67.62 -30.46 70.04 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.63 1.172 . . . . 0.0 113.609 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.5 t -74.18 -55.53 5.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.068 1.347 . . . . 0.0 109.257 177.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.34 -25.81 66.1 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 85.1 p -81.72 -49.26 10.66 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.34 0.973 . . . . 0.0 111.852 175.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 50.1 m -60.07 -34.49 73.51 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.462 0.705 . . . . 0.0 112.234 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 48.0 tpt85 -61.1 -29.92 70.04 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.464 -0.772 . . . . 0.0 113.028 177.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -69.95 -33.31 71.94 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.712 0.805 . . . . 0.0 110.974 176.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 16.8 mt -69.03 -43.88 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 124.638 1.175 . . . . 0.0 109.373 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 16.9 mm -62.85 -38.12 81.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 123.993 0.917 . . . . 0.0 110.793 174.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 5.6 t -62.44 -27.38 69.06 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.131 0.972 . . . . 0.0 112.65 177.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.9 t60 -60.81 -55.95 26.99 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.292 0.951 . . . . 0.0 111.011 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 43.7 m95 -61.96 -28.72 69.75 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 92.3 mttt -73.3 -28.0 61.85 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.143 0.977 . . . . 0.0 112.794 178.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -100.09 -38.58 8.49 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.5 t -76.7 134.6 39.18 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.787 1.635 . . . . 0.0 112.835 -176.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.5 p -130.07 -0.51 4.67 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.535 1.534 . . . . 0.0 114.361 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -82.85 153.52 25.12 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.019 1.327 . . . . 0.0 113.255 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 16.2 t60 -86.45 -40.38 15.38 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.831 0.853 . . . . 0.0 111.13 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.3 t0 -91.48 69.91 5.89 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.604 1.561 . . . . 0.0 111.852 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.4 t -121.32 132.59 24.18 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 126.297 1.839 . . . . 0.0 109.22 178.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -59.9 -24.41 76.07 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.596 2.197 . . . . 0.0 114.378 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.6 t -92.2 -50.87 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 119.525 1.057 . . . . 0.0 111.476 175.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 12.9 m -69.92 -38.64 76.3 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.9 tt -54.19 -56.37 26.94 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-O 117.752 -1.118 . . . . 0.0 113.006 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -61.41 -30.1 86.56 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 121.77 1.647 . . . . 0.0 113.327 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 93.5 mt -70.95 -46.22 62.79 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.341 0.973 . . . . 0.0 111.736 177.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -62.89 -31.75 72.86 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.636 0.774 . . . . 0.0 111.019 176.012 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 18.8 t30 -74.35 -39.84 62.53 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.332 1.453 . . . . 0.0 112.137 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.74 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -179.976 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 15.3 m . . . . . 0 N--CA 1.472 0.635 0 CA-C-O 119.444 -0.313 . . . . 0.0 110.218 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -60.07 -30.47 69.24 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.497 0.719 . . . . 0.0 112.289 174.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 50.6 m -70.16 -32.73 70.84 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.7 t70 -90.18 -29.87 17.97 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.098 0.959 . . . . 0.0 112.857 176.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.3 tt -41.46 -58.31 1.93 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 127.484 2.314 . . . . 0.0 113.497 -178.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 48.4 p-90 -71.77 -9.9 58.98 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -173.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.06 -60.16 1.9 Allowed 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 116.504 2.039 . . . . 0.0 116.504 -179.049 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 48.2 mt -120.16 19.72 12.17 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -170.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 CA--C 1.553 1.069 0 C-N-CA 126.045 1.738 . . . . 0.0 114.487 -177.561 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 94.6 mt . . . . . 0 CA--C 1.548 0.894 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 68.4 mmm -65.94 149.73 49.76 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.685 1.13 . . . . 0.0 113.502 -178.089 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.87 175.72 7.1 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.975 1.71 . . . . 0.0 111.436 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 74.5 p -78.72 151.16 76.68 Favored Pre-proline 0 CA--C 1.544 0.729 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 169.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.58 -12.23 27.2 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.188 2.592 . . . . 0.0 115.136 -179.14 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -95.55 -18.97 20.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.29 1.036 . . . . 0.0 112.974 177.248 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.68 -9.97 59.59 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.074 -1.016 . . . . 0.0 112.404 177.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 77.3 mt -54.81 -31.86 25.12 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 125.979 1.712 . . . . 0.0 110.8 175.202 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -66.09 -10.08 37.13 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.487 1.515 . . . . 0.0 113.544 177.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.1 tm0? -76.75 -33.85 58.09 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.001 -1.062 . . . . 0.0 111.488 177.282 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 . . . . . 0 N--CA 1.47 0.55 0 CA-C-O 117.918 -1.039 . . . . 0.0 113.124 178.298 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 81.7 mttt . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 119.208 -0.425 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -57.16 -45.6 83.49 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.543 0.737 . . . . 0.0 111.889 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -60.02 -41.8 92.97 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 118.842 0.746 . . . . 0.0 111.725 175.038 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.17 -40.05 90.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.746 0.819 . . . . 0.0 112.152 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.5 mt -64.0 -52.03 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 119.504 1.047 . . . . 0.0 109.714 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -53.51 -56.95 12.67 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.217 1.007 . . . . 0.0 111.171 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.87 -36.56 84.75 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.097 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -69.53 -42.99 73.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.724 1.147 . . . . 0.0 110.656 178.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 8.2 tp -61.51 -40.09 93.36 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.545 0.738 . . . . 0.0 110.395 176.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 95.8 t -60.52 -32.43 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 119.204 0.911 . . . . 0.0 110.929 174.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.8 tp -72.72 -27.58 62.14 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 120.055 1.298 . . . . 0.0 113.306 174.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -61.88 -33.73 74.73 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 120.412 1.46 . . . . 0.0 108.815 173.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.3 mt -68.89 -51.12 43.5 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.174 0.99 . . . . 0.0 110.046 175.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 19.6 t60 -56.79 -55.85 29.09 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.392 177.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -50.8 -45.8 59.47 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -70.19 -35.3 73.84 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 43.9 mttm -77.73 -38.45 47.09 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.22 1.008 . . . . 0.0 111.745 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 49.6 t -60.8 -46.65 89.7 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.47 2.308 . . . . 0.0 109.587 175.019 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.4 tt0 . . . . . 0 CA--C 1.541 0.632 0 C-N-CA 125.974 1.71 . . . . 0.0 111.062 173.725 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 36.3 m80 . . . . . 0 CA--C 1.536 0.405 0 CA-C-O 117.747 -1.12 . . . . 0.0 113.941 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . 0.322 0.8 OUTLIER -72.81 -35.15 67.28 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 120.326 1.421 . . . . 0.0 111.207 178.1 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -60.21 -40.85 91.6 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.752 1.221 . . . . 0.0 110.611 171.567 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.9 m -65.11 -55.37 19.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.688 1.195 . . . . 0.0 110.667 176.21 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.7 mmt -62.78 -39.2 93.46 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.604 0.965 . . . . 0.0 113.604 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -64.7 -29.61 70.6 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 120.794 1.634 . . . . 0.0 113.133 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -72.67 -39.42 67.11 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.01 0.524 . . . . 0.0 110.483 173.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 90.5 t -63.41 -45.83 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.194 0.598 . . . . 0.0 110.188 175.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.92 -42.86 90.69 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.983 1.313 . . . . 0.0 112.104 178.223 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -63.01 -32.79 74.23 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.224 0.609 . . . . 0.0 112.385 176.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 65.2 t60 -79.61 -49.31 12.36 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.642 0.777 . . . . 0.0 110.768 176.214 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 31.3 ttp -56.55 -34.04 66.7 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.717 1.607 . . . . 0.0 113.904 -176.378 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 10.2 t -73.21 -13.06 61.08 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 120.181 1.355 . . . . 0.0 113.085 176.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 58.9 m80 -107.1 -24.79 11.83 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.478 1.511 . . . . 0.0 112.595 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.4 t -61.59 150.06 37.33 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.538 1.535 . . . . 0.0 112.343 178.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -128.89 -8.86 4.93 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.87 1.668 . . . . 0.0 113.641 -179.219 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.76 -28.22 21.85 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.242 0.928 . . . . 0.0 111.86 178.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.65 -109.66 1.0 Allowed Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.952 1.263 . . . . 0.0 112.761 178.226 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -60.23 -22.98 63.68 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.155 0.982 . . . . 0.0 113.247 177.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.87 -1.46 49.36 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.296 1.438 . . . . 0.0 113.846 178.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.9 t -61.0 141.97 56.95 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 122.289 1.042 . . . . 0.0 110.62 178.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.8 mm-40 -78.62 -10.54 59.78 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.721 1.208 . . . . 0.0 113.115 -176.635 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 64.6 t -90.65 114.85 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 124.874 1.27 . . . . 0.0 107.582 174.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.32 -37.0 66.84 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -64.93 -41.63 95.38 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.445 1.098 . . . . 0.0 112.204 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.5 t -67.04 -56.38 10.31 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.594 1.558 . . . . 0.0 109.994 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.57 -26.94 62.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.28 1.032 . . . . 0.0 113.255 178.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 70.8 m -82.33 -47.27 12.55 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.049 0.94 . . . . 0.0 112.124 175.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 60.2 m -62.17 -34.8 77.11 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 121.56 -0.713 . . . . 0.0 111.873 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -59.07 -31.53 68.97 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.338 1.055 . . . . 0.0 112.503 176.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -67.71 -34.14 76.29 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.873 0.869 . . . . 0.0 111.299 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.4 mt -72.23 -46.04 59.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 124.343 1.057 . . . . 0.0 110.035 177.149 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 19.2 mm -62.57 -39.69 85.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.142 0.977 . . . . 0.0 111.301 176.443 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 16.5 t -60.39 -26.16 66.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.085 0.954 . . . . 0.0 112.712 177.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.6 t60 -61.54 -57.28 12.73 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.092 0.86 . . . . 0.0 111.159 177.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 59.5 m95 -62.45 -22.56 66.31 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 178.381 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -79.66 -29.92 41.03 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.509 1.123 . . . . 0.0 112.614 178.057 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -99.96 -36.32 9.42 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 179.315 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.4 t -74.04 139.33 44.64 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.354 1.461 . . . . 0.0 111.289 -178.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 74.2 p -130.12 -2.84 4.52 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 -177.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -96.09 141.51 29.38 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.227 1.411 . . . . 0.0 112.647 -177.425 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -74.34 -34.4 63.41 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 121.728 -0.607 . . . . 0.0 111.819 176.33 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 36.7 t0 -90.89 79.34 5.93 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.718 1.607 . . . . 0.0 111.038 178.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.4 t -135.13 137.43 26.85 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 127.106 2.162 . . . . 0.0 109.124 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -56.72 -26.54 66.27 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.858 2.372 . . . . 0.0 114.604 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.8 t -92.24 -51.65 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-N 119.783 1.174 . . . . 0.0 111.604 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 6.1 m -69.63 -39.72 76.97 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 -174.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 1.6 tt -56.24 -55.91 37.0 Favored Pre-proline 0 CA--C 1.546 0.823 0 CA-C-O 117.578 -1.201 . . . . 0.0 112.903 -177.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.18 -32.49 94.56 Favored 'Trans proline' 0 C--N 1.354 0.848 0 CA-C-N 121.845 1.695 . . . . 0.0 113.169 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 98.4 mt -69.31 -46.19 67.72 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.001 0.819 . . . . 0.0 111.47 177.418 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 48.7 mttm -62.63 -41.89 99.28 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.026 0.93 . . . . 0.0 110.472 176.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.0 t30 -63.71 -39.19 93.7 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.274 1.429 . . . . 0.0 112.252 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.74 0 C-N-CA 124.325 1.05 . . . . 0.0 113.662 178.576 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.477 0.883 0 CA-C-O 119.698 -0.191 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -60.17 -25.76 65.79 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 175.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 45.3 m -75.05 -31.89 61.4 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.378 -0.826 . . . . 0.0 112.642 177.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -90.06 -25.45 20.78 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.62 1.168 . . . . 0.0 112.902 175.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.9 tt -45.51 -60.01 2.41 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 127.451 2.3 . . . . 0.0 113.87 -178.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.2 p-90 -70.08 -8.36 48.76 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -173.515 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 10.2 ptmm? -112.15 -56.0 2.45 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 4.2 mp -120.12 16.88 12.44 Favored 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 117.055 2.243 . . . . 0.0 117.055 -176.425 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.9 tt . . . . . 0 N--CA 1.48 1.044 0 O-C-N 120.473 -1.392 . . . . 0.0 113.802 179.27 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 28.3 tp . . . . . 0 CA--C 1.552 1.027 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.4 tpt -62.75 145.52 54.64 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -175.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.89 149.29 47.71 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 128.251 2.621 . . . . 0.0 109.682 177.279 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 24.2 m -71.51 134.41 84.4 Favored Pre-proline 0 N--CA 1.474 0.737 0 CA-C-O 118.327 -0.844 . . . . 0.0 110.966 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -55.39 -28.8 65.19 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.002 2.468 . . . . 0.0 116.085 -176.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -70.72 -15.25 62.68 Favored 'General case' 0 CA--C 1.55 0.954 0 O-C-N 120.912 -1.118 . . . . 0.0 113.196 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.1 t70 -89.76 -9.83 47.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.243 1.817 . . . . 0.0 113.13 178.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 72.7 mt -52.56 -34.35 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 125.045 1.338 . . . . 0.0 111.33 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -67.44 -9.73 44.64 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.562 1.145 . . . . 0.0 113.697 177.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -75.65 -20.2 58.64 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 120.928 -1.108 . . . . 0.0 111.109 175.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.54 0.591 0 CA-C-N 119.022 0.828 . . . . 0.0 109.876 178.269 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 30.1 mtpp . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 77.9 mtm-85 -60.68 -39.27 87.82 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.868 0.867 . . . . 0.0 112.619 179.165 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -63.58 -27.87 69.54 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.091 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 86.3 mt -70.26 -37.71 74.96 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.176 0.59 . . . . 0.0 110.593 175.481 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.5 mt -62.1 -51.81 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 175.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -54.57 -54.01 46.98 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.966 0.906 . . . . 0.0 111.016 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -36.17 83.12 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.164 0.893 . . . . 0.0 113.352 -178.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -71.74 -44.15 64.59 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.888 0.767 . . . . 0.0 110.96 179.014 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 12.3 tp -63.76 -38.35 90.79 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.569 0.747 . . . . 0.0 110.784 177.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 87.8 t -61.87 -32.27 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 CA-C-N 119.735 1.152 . . . . 0.0 110.619 174.242 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 15.6 tp -69.53 -34.98 75.02 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 120.762 -1.211 . . . . 0.0 111.608 174.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.4 mp -59.14 -26.14 64.48 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 120.11 1.323 . . . . 0.0 110.271 174.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 4.0 mt -77.5 -53.25 7.84 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.289 -0.882 . . . . 0.0 109.933 176.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.6 t60 -54.93 -52.93 61.42 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.13 0.572 . . . . 0.0 110.226 177.64 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -58.19 -22.78 53.04 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.79 1.236 . . . . 0.0 113.968 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -90.07 -29.42 18.37 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.157 -0.964 . . . . 0.0 113.417 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 31.9 mttp -86.07 -34.67 20.62 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.682 1.193 . . . . 0.0 112.623 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 20.2 t -63.92 -44.83 91.72 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.277 1.831 . . . . 0.0 110.946 177.567 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.0 pt20 . . . . . 0 CA--C 1.546 0.825 0 O-C-N 120.797 -1.19 . . . . 0.0 111.819 174.178 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 7.6 m170 . . . . . 0 N--CA 1.47 0.573 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 33.6 t -62.44 -49.07 76.91 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.024 1.329 . . . . 0.0 109.716 177.11 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -55.41 -36.99 67.06 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.933 1.293 . . . . 0.0 111.813 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.6 m -70.67 -56.52 6.26 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.887 0.875 . . . . 0.0 111.772 176.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 14.6 mmt -65.07 -32.71 74.56 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -65.51 -32.21 73.69 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 120.753 1.615 . . . . 0.0 112.303 178.047 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -72.47 -38.55 68.18 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.534 0.734 . . . . 0.0 110.449 174.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 77.0 t -62.22 -47.24 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.277 0.631 . . . . 0.0 110.327 175.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.57 -45.11 95.15 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.878 0.871 . . . . 0.0 111.708 178.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -67.83 -21.22 65.21 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.2 t60 -83.86 -49.39 9.07 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 118.803 0.729 . . . . 0.0 109.339 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.0 ttp -57.55 -27.92 63.07 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.189 1.796 . . . . 0.0 113.778 -177.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 17.2 p -70.75 -30.35 66.83 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 119.507 1.049 . . . . 0.0 112.244 174.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 84.1 t60 -92.39 -27.08 17.73 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.831 1.652 . . . . 0.0 112.835 178.722 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 14.2 t -63.13 153.02 35.63 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.853 1.661 . . . . 0.0 112.776 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -133.15 -7.24 3.02 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.555 1.542 . . . . 0.0 114.23 -179.207 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -90.55 -22.85 21.09 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.385 0.993 . . . . 0.0 113.012 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.3 -116.61 5.91 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.448 1.023 . . . . 0.0 112.354 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 58.1 tptt -56.4 -24.3 43.91 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.774 1.23 . . . . 0.0 113.211 176.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.48 -1.86 57.41 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.576 1.151 . . . . 0.0 114.043 178.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 20.0 t -62.66 141.88 58.33 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.112 0.958 . . . . 0.0 110.586 178.612 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.7 mm-40 -78.09 -9.4 59.13 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.592 1.157 . . . . 0.0 113.163 -176.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 99.3 t -91.87 114.56 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 173.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.85 -42.99 72.68 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -64.42 -37.88 89.09 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.866 0.866 . . . . 0.0 112.945 -178.415 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 29.7 t -65.86 -59.59 3.71 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.508 1.523 . . . . 0.0 110.378 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.13 -30.86 64.77 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.874 0.87 . . . . 0.0 112.58 178.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.3 m -75.52 -50.63 15.08 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.757 0.823 . . . . 0.0 112.486 176.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 63.6 m -60.04 -36.39 77.18 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.663 -0.648 . . . . 0.0 111.801 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 48.2 tpt85 -59.81 -29.54 68.31 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.849 0.86 . . . . 0.0 113.047 177.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -70.29 -30.06 66.97 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.72 0.808 . . . . 0.0 111.245 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 6.6 mt -73.45 -44.63 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.168 0.987 . . . . 0.0 109.221 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 24.0 mm -58.71 -39.18 75.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 123.86 0.864 . . . . 0.0 109.887 174.724 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 4.1 t -60.72 -28.56 68.76 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.037 0.935 . . . . 0.0 113.054 176.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.1 t60 -61.76 -55.25 32.15 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.404 1.002 . . . . 0.0 110.44 177.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 44.2 m95 -61.69 -30.65 70.88 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 178.225 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -70.29 -27.95 64.81 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.703 0.801 . . . . 0.0 112.703 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -100.05 -38.98 8.34 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 179.242 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.8 t -75.62 137.66 40.9 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.796 1.638 . . . . 0.0 112.862 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 68.2 p -129.97 4.11 4.89 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.692 1.597 . . . . 0.0 114.045 -178.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 69.8 mtm180 -82.1 158.5 23.69 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.126 1.37 . . . . 0.0 113.551 -178.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 23.9 t60 -95.88 -40.22 9.42 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.34 1.056 . . . . 0.0 109.84 170.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.6 t0 -92.79 69.99 4.73 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.7 1.6 . . . . 0.0 111.655 178.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 52.7 t -123.27 133.65 24.67 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 126.653 1.981 . . . . 0.0 108.412 177.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -59.01 -25.61 78.44 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.709 2.273 . . . . 0.0 114.425 -176.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 6.3 t -92.13 -50.29 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 119.519 1.054 . . . . 0.0 111.649 176.258 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.4 m -68.86 -41.32 78.58 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -175.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.9 tt -50.75 -57.18 14.31 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.472 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -61.3 -31.77 89.42 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.021 1.814 . . . . 0.0 113.591 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 89.7 mt -70.87 -46.44 62.63 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.76 0.824 . . . . 0.0 111.676 178.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -62.26 -36.74 82.97 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.155 0.982 . . . . 0.0 110.397 176.805 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 13.9 t30 -69.92 -38.32 76.19 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.29 1.436 . . . . 0.0 112.448 175.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 113.777 1.028 . . . . 0.0 113.777 179.562 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 61.4 m . . . . . 0 N--CA 1.474 0.77 0 CA-C-O 119.419 -0.324 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -60.03 -21.94 62.0 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.504 0.928 . . . . 0.0 113.504 178.205 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 21.3 t -79.0 -33.65 44.77 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.32 1.048 . . . . 0.0 112.646 178.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 36.4 t70 -89.77 -26.5 20.57 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.838 0.855 . . . . 0.0 112.104 175.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.7 tt -45.82 -60.06 2.45 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 127.176 2.191 . . . . 0.0 113.367 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.2 p-90 -68.91 -8.96 49.07 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -172.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -111.89 -58.51 2.12 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 -178.324 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 58.0 mt -120.05 16.29 12.46 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -171.173 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.6 tt . . . . . 0 CA--C 1.551 0.989 0 C-N-CA 124.915 1.286 . . . . 0.0 113.046 179.977 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 83.8 mt . . . . . 0 CA--C 1.551 1.019 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.24 151.61 46.64 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -175.154 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 95.9 mt -125.19 170.28 11.4 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.778 2.831 . . . . 0.0 113.504 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.7 m -90.8 150.43 42.14 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 169.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -53.72 -25.1 32.75 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.069 2.512 . . . . 0.0 115.651 -178.347 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.8 t70 -69.87 -24.08 63.37 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.891 0.876 . . . . 0.0 112.889 178.098 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -76.17 -18.04 59.28 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.86 0.864 . . . . 0.0 112.361 178.282 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 93.3 mt -59.5 -34.02 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.59 0.756 . . . . 0.0 109.322 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -71.18 -9.87 58.8 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -84.15 -29.77 26.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.93 0.892 . . . . 0.0 111.521 176.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.3 p-90 . . . . . 0 CA--C 1.542 0.656 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 176.619 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 80.6 tttt . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 119.64 -0.219 . . . . 0.0 111.581 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 70.2 mtp180 -62.38 -41.49 98.68 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.779 0.832 . . . . 0.0 111.122 174.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -59.59 -33.04 70.96 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.065 0.946 . . . . 0.0 112.103 179.088 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 83.6 mt -65.67 -40.56 92.52 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.963 0.801 . . . . 0.0 112.018 178.115 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.1 mt -68.35 -51.19 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-N 118.342 0.519 . . . . 0.0 109.677 176.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -55.13 -54.41 43.58 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.576 1.15 . . . . 0.0 110.889 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -34.99 79.49 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.148 -0.97 . . . . 0.0 113.168 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -68.67 -48.99 62.54 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.092 0.86 . . . . 0.0 109.655 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 16.8 tp -59.82 -43.93 94.28 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.425 0.69 . . . . 0.0 111.413 177.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 61.0 t -61.43 -24.98 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 O-C-N 120.64 -1.288 . . . . 0.0 111.331 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 3.7 tp -79.81 -26.09 40.64 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.289 1.404 . . . . 0.0 112.408 172.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.5 mp -60.84 -45.27 95.15 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 120.596 1.544 . . . . 0.0 107.367 170.352 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.2 mp -61.41 -50.59 72.22 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.307 1.043 . . . . 0.0 111.102 175.352 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 31.0 t60 -55.61 -57.3 12.54 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.424 1.011 . . . . 0.0 110.285 177.351 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.59 -30.93 63.76 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.549 1.14 . . . . 0.0 114.032 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 43.1 t60 -75.48 -38.63 59.44 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.522 -0.736 . . . . 0.0 112.04 176.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 42.7 mttm -79.81 -33.62 40.26 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.521 1.128 . . . . 0.0 111.853 -179.317 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 13.6 t -63.26 -44.77 94.21 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 127.406 2.283 . . . . 0.0 111.677 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.6 pt20 . . . . . 0 N--CA 1.475 0.807 0 O-C-N 120.726 -1.234 . . . . 0.0 111.727 174.64 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 35.3 m80 . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 53.2 t -68.17 -51.03 50.35 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.813 1.245 . . . . 0.0 108.858 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 43.2 ttp-105 -54.42 -39.65 67.53 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.11 1.364 . . . . 0.0 111.283 173.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.2 m -65.43 -56.57 11.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.523 1.129 . . . . 0.0 111.394 176.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 19.9 mmt -66.45 -34.54 78.17 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -177.256 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -65.44 -32.25 73.77 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 120.88 1.673 . . . . 0.0 112.286 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -70.62 -39.71 73.56 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.034 0.534 . . . . 0.0 110.491 174.372 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 71.5 t -63.77 -46.9 93.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.261 0.625 . . . . 0.0 111.025 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.5 -43.38 93.37 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.647 0.779 . . . . 0.0 111.259 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -68.32 -18.09 64.42 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 176.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 66.6 t60 -88.03 -49.82 6.8 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.535 0.734 . . . . 0.0 109.432 173.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 27.2 ttp -57.15 -27.86 62.25 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.151 1.781 . . . . 0.0 113.616 -178.008 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 11.4 p -69.37 -26.52 64.7 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 121.114 -0.991 . . . . 0.0 112.641 175.255 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 68.8 m80 -104.32 -18.65 14.36 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.111 1.765 . . . . 0.0 113.947 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.0 t -62.84 150.77 40.84 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.282 1.433 . . . . 0.0 112.517 -179.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -121.52 -14.79 8.16 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.846 1.658 . . . . 0.0 113.743 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -97.29 -29.33 13.61 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.339 1.056 . . . . 0.0 112.598 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.92 -110.24 1.22 Allowed Glycine 0 CA--C 1.535 1.308 0 C-N-CA 124.484 1.04 . . . . 0.0 113.41 177.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -60.76 -20.27 60.98 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.095 -1.238 . . . . 0.0 113.3 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.49 -0.49 43.28 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.858 1.663 . . . . 0.0 113.588 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.7 t -63.7 142.46 58.39 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 122.106 0.955 . . . . 0.0 110.284 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -81.87 -3.2 53.52 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 86.2 t -89.75 115.81 30.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 173.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.42 -37.29 67.46 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -71.11 -27.36 63.53 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.125 0.97 . . . . 0.0 113.231 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 43.0 t -78.18 -56.86 4.13 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.6 1.56 . . . . 0.0 110.044 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.52 -27.69 66.41 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 179.104 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 16.2 p -77.18 -50.37 13.1 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.394 -0.816 . . . . 0.0 111.587 175.168 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 57.9 m -61.65 -36.37 80.59 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.524 -0.735 . . . . 0.0 112.55 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -61.1 -31.72 71.4 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 121.664 -0.647 . . . . 0.0 112.655 177.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -66.22 -29.94 70.29 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.018 0.826 . . . . 0.0 111.465 175.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.8 mt -76.29 -46.85 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 124.455 1.102 . . . . 0.0 109.807 176.679 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 33.3 mm -58.48 -36.91 61.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.157 0.983 . . . . 0.0 110.522 175.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 68.9 m -63.95 -21.38 66.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.358 1.063 . . . . 0.0 113.395 177.218 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.9 t60 -66.15 -57.45 7.62 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.88 1.218 . . . . 0.0 110.843 178.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 43.9 m95 -61.67 -21.25 64.27 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 177.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 92.8 mttt -79.38 -28.38 41.9 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.5 1.12 . . . . 0.0 112.713 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -100.13 -42.89 6.52 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.883 1.273 . . . . 0.0 113.697 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 12.7 t -81.39 133.2 35.38 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.463 1.905 . . . . 0.0 111.652 -178.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.9 p -130.04 -5.18 4.46 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -179.011 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 74.7 mtp85 -67.15 156.14 36.97 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.1 1.76 . . . . 0.0 114.18 -178.172 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -85.19 -34.05 22.15 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.846 0.858 . . . . 0.0 111.394 173.204 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 18.4 t0 -104.45 86.36 2.5 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.727 2.011 . . . . 0.0 111.278 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.0 t -136.5 137.0 22.89 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 126.572 1.949 . . . . 0.0 109.604 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -56.21 -29.11 74.33 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.386 2.724 . . . . 0.0 114.632 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 20.1 t -92.24 -54.86 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 CA-C-N 119.276 0.944 . . . . 0.0 111.934 175.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 9.7 m -66.39 -37.64 85.71 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -173.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.29 -57.98 17.48 Favored Pre-proline 0 CA--C 1.548 0.901 0 CA-C-N 120.046 1.294 . . . . 0.0 112.743 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.0 -29.03 87.18 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 121.806 1.671 . . . . 0.0 113.497 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 92.0 mt -70.44 -44.04 68.65 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.555 1.07 . . . . 0.0 111.482 177.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -62.32 -36.51 82.39 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 118.38 0.536 . . . . 0.0 110.766 175.2 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.0 t30 -69.21 -36.18 76.99 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 124.706 1.202 . . . . 0.0 112.349 176.457 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.706 0 C-N-CA 125.071 1.349 . . . . 0.0 114.203 178.767 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 22.8 m . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 119.399 -0.334 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.24 -30.66 69.56 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.754 0.706 . . . . 0.0 112.299 175.229 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 43.6 m -71.4 -31.37 67.19 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 31.7 t70 -90.11 -28.06 19.22 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.983 1.313 . . . . 0.0 113.391 176.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.5 tt -42.99 -59.99 1.8 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 127.335 2.254 . . . . 0.0 113.347 -177.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.3 p-90 -69.22 -9.43 52.99 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 -174.33 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -111.98 -59.88 1.93 Allowed 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -178.026 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 45.8 mt -120.25 20.25 12.02 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -171.635 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.7 tt . . . . . 0 CA--C 1.555 1.157 0 C-N-CA 125.764 1.626 . . . . 0.0 114.425 -177.211 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 25.3 tp . . . . . 0 CA--C 1.553 1.082 0 CA-C-O 120.765 0.317 . . . . 0.0 111.558 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.9 tpt -65.1 141.72 58.62 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 -175.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.5 tt -125.05 148.52 48.47 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.438 2.295 . . . . 0.0 111.75 -176.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 43.3 t -72.63 138.88 80.45 Favored Pre-proline 0 N--CA 1.474 0.755 0 C-N-CA 124.101 0.961 . . . . 0.0 111.383 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -57.15 -26.5 69.69 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 122.659 2.239 . . . . 0.0 114.71 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.6 t70 -69.3 -21.35 63.87 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 121.452 -0.78 . . . . 0.0 112.658 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 19.1 t70 -89.97 -9.89 47.07 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.809 1.644 . . . . 0.0 113.699 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 63.0 mt -51.63 -38.42 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 125.031 1.332 . . . . 0.0 111.244 177.329 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -67.16 -9.74 43.08 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.233 1.413 . . . . 0.0 113.611 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -78.32 -29.63 47.78 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.032 -1.042 . . . . 0.0 111.661 175.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.2 p-90 . . . . . 0 N--CA 1.473 0.714 0 CA-C-O 118.247 -0.882 . . . . 0.0 112.186 176.836 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 48.5 tptt . . . . . 0 N--CA 1.469 0.487 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.96 -41.29 11.83 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.666 1.587 . . . . 0.0 110.668 175.006 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.6 mtpt -59.4 -34.16 72.11 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.243 1.017 . . . . 0.0 112.257 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 54.7 mt -62.46 -37.82 87.41 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.332 0.969 . . . . 0.0 111.932 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.9 mt -67.82 -51.82 46.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.709 0.804 . . . . 0.0 109.552 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -54.75 -55.07 33.86 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.656 1.182 . . . . 0.0 111.032 178.112 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -34.84 78.85 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -177.785 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -69.35 -45.41 69.46 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.074 0.852 . . . . 0.0 110.518 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 7.2 tp -62.71 -39.36 93.81 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.365 0.666 . . . . 0.0 111.146 178.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 71.7 t -60.51 -31.99 50.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 119.656 1.116 . . . . 0.0 110.987 175.164 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 7.9 tp -72.62 -28.55 62.82 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 120.714 -1.241 . . . . 0.0 112.299 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.35 -28.54 70.07 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 120.403 1.456 . . . . 0.0 110.178 174.245 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 1.9 mt -74.15 -51.34 15.87 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.96 0.904 . . . . 0.0 108.772 175.527 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 20.4 t60 -55.3 -54.77 39.41 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.512 0.725 . . . . 0.0 111.167 177.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.43 -23.16 36.63 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -178.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -90.06 -38.02 13.87 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.274 -0.891 . . . . 0.0 112.318 174.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 52.1 mttm -78.34 -25.04 46.28 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.607 1.563 . . . . 0.0 113.467 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 50.8 t -77.9 -53.48 7.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.418 2.287 . . . . 0.0 111.9 178.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.9 pt20 . . . . . 0 N--CA 1.478 0.967 0 O-C-N 121.185 -0.947 . . . . 0.0 112.518 177.584 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 70.5 m80 . . . . . 0 CA--C 1.54 0.589 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 51.2 t -69.44 -52.61 25.18 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.023 1.329 . . . . 0.0 108.518 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -54.78 -34.81 63.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.378 1.471 . . . . 0.0 111.602 174.303 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 21.4 m -71.08 -59.02 3.01 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.779 1.231 . . . . 0.0 111.591 176.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.0 mmt -62.97 -33.68 75.9 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -64.99 -32.64 74.46 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 120.81 1.641 . . . . 0.0 112.482 177.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -72.79 -38.15 67.35 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.233 0.613 . . . . 0.0 110.452 174.194 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 96.0 t -63.47 -46.87 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.491 0.587 . . . . 0.0 110.456 176.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -46.47 85.93 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.04 0.836 . . . . 0.0 111.136 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -66.36 -19.52 65.83 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 177.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 65.3 t60 -86.61 -49.38 7.57 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.089 0.858 . . . . 0.0 109.49 173.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 34.9 ttp -57.01 -28.99 62.97 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.445 1.898 . . . . 0.0 113.59 -177.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 16.3 p -70.29 -27.93 64.79 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.954 0.902 . . . . 0.0 112.738 175.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 73.1 m80 -101.62 -18.24 15.98 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.762 1.625 . . . . 0.0 113.906 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 16.8 t -61.5 155.24 22.48 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.183 1.393 . . . . 0.0 112.562 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -126.7 -12.23 6.04 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.782 1.633 . . . . 0.0 113.702 -178.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -96.52 -27.67 14.75 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.351 1.06 . . . . 0.0 112.051 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.23 -114.41 4.19 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.777 1.18 . . . . 0.0 113.406 177.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -62.13 -16.38 52.2 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 121.325 -1.103 . . . . 0.0 113.444 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.24 -0.51 43.93 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.342 1.457 . . . . 0.0 113.382 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.6 t -60.32 142.61 54.51 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 122.403 1.097 . . . . 0.0 110.634 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.0 mm-40 -77.86 -9.44 59.06 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.696 1.198 . . . . 0.0 113.015 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 99.8 t -88.58 115.22 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.213 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.6 -41.76 66.97 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -65.76 -41.49 92.03 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.505 0.722 . . . . 0.0 112.884 -179.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 41.1 t -61.35 -56.4 20.82 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.718 1.207 . . . . 0.0 110.665 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.42 -30.97 69.96 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.293 0.637 . . . . 0.0 112.632 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 74.7 m -71.64 -51.05 25.15 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.981 0.912 . . . . 0.0 111.161 176.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 33.6 m -58.38 -36.61 73.77 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.952 0.901 . . . . 0.0 112.146 176.163 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.24 -30.46 71.12 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 118.092 -0.956 . . . . 0.0 113.179 175.623 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -69.11 -27.46 65.6 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.664 1.12 . . . . 0.0 110.828 176.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.3 mm -74.29 -48.41 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.772 0.829 . . . . 0.0 109.58 175.05 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 20.2 mm -59.14 -40.56 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.403 1.081 . . . . 0.0 110.714 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 49.9 m -62.14 -22.25 65.71 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.961 0.904 . . . . 0.0 113.068 177.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.3 t60 -66.52 -56.95 8.47 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.514 1.052 . . . . 0.0 109.966 176.605 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 42.9 m95 -61.47 -32.66 72.67 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.273 0.942 . . . . 0.0 112.966 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -65.45 -28.55 69.31 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.352 -0.843 . . . . 0.0 112.948 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -100.02 -50.02 4.13 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.776 1.23 . . . . 0.0 114.271 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 11.1 t -79.87 132.21 36.04 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.629 1.972 . . . . 0.0 112.525 -176.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 4.4 t -130.14 -2.36 4.54 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.2 1.4 . . . . 0.0 113.872 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 83.5 mtt-85 -69.51 145.74 52.43 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.94 1.296 . . . . 0.0 113.478 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 85.0 t60 -79.79 -34.72 39.41 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 169.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -86.5 69.95 10.42 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.764 1.625 . . . . 0.0 112.14 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.7 t -136.28 133.06 19.24 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 126.055 1.742 . . . . 0.0 109.743 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -58.83 -25.07 75.05 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 122.86 2.373 . . . . 0.0 114.149 -178.513 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 17.6 t -92.17 -51.66 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 119.28 0.945 . . . . 0.0 111.961 176.134 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.4 m -71.28 -35.66 71.42 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -174.465 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.37 -56.56 25.21 Favored Pre-proline 0 N--CA 1.474 0.749 0 CA-C-N 119.773 1.169 . . . . 0.0 113.204 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -60.52 -33.49 93.74 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.032 1.821 . . . . 0.0 113.089 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 94.9 mt -68.4 -45.56 72.34 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.973 0.806 . . . . 0.0 111.565 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 55.4 mttm -61.94 -45.01 95.57 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.911 0.884 . . . . 0.0 109.834 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 19.2 t30 -61.38 -40.9 96.04 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.938 1.295 . . . . 0.0 112.411 176.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.731 0 C-N-CA 124.468 1.107 . . . . 0.0 113.935 179.027 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 87.1 m . . . . . 0 N--CA 1.475 0.802 0 CA-C-O 119.412 -0.327 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -60.21 -31.85 70.55 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 49.9 m -68.45 -34.52 76.11 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.76 0.709 . . . . 0.0 112.804 178.726 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.1 t70 -90.3 -24.32 20.92 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 174.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.6 tt -46.09 -60.08 2.49 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.233 1.813 . . . . 0.0 113.588 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 51.0 p-90 -65.11 -10.24 29.08 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -173.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 58.4 pttt -111.97 -53.46 2.7 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 6.2 mp -120.16 20.03 12.11 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 116.774 2.138 . . . . 0.0 116.774 -175.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.217 0 O-C-N 120.223 -1.548 . . . . 0.0 114.885 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 27.4 tp . . . . . 0 CA--C 1.555 1.159 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 10.8 tpt -70.95 147.87 48.27 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 14.5 mt -118.81 160.9 21.06 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.852 1.661 . . . . 0.0 113.144 -178.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 43.3 t -71.71 145.0 89.13 Favored Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 169.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -58.19 -14.76 20.65 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 123.095 2.53 . . . . 0.0 116.357 -175.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -72.93 -22.99 60.64 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.32 -0.862 . . . . 0.0 112.886 177.717 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 14.9 t70 -84.8 -10.08 57.55 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.406 1.082 . . . . 0.0 113.006 178.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 91.7 mt -56.59 -34.94 43.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.569 1.148 . . . . 0.0 110.584 176.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -73.45 -9.89 59.16 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.819 1.248 . . . . 0.0 113.641 178.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -84.33 -24.61 29.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.067 0.947 . . . . 0.0 112.773 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.471 0.613 0 CA-C-N 119.476 1.034 . . . . 0.0 111.756 -179.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 20.7 tptm . . . . . 0 N--CA 1.472 0.661 0 N-CA-C 111.501 0.185 . . . . 0.0 111.501 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 78.4 mtm180 -76.76 -43.96 34.92 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.088 1.355 . . . . 0.0 111.311 175.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -56.72 -35.22 68.3 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.252 1.021 . . . . 0.0 112.111 175.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 57.3 mt -59.63 -37.94 80.01 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.202 0.91 . . . . 0.0 112.016 177.435 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -67.1 -54.59 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 118.703 0.683 . . . . 0.0 109.245 175.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -52.71 -51.75 59.1 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.462 1.105 . . . . 0.0 112.011 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -35.17 78.63 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.338 -0.851 . . . . 0.0 113.178 -179.087 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -71.41 -42.54 68.17 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.569 1.077 . . . . 0.0 109.693 178.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.5 tt -61.81 -44.44 96.86 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.706 1.602 . . . . 0.0 110.723 178.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 89.1 t -61.81 -26.64 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 O-C-N 120.589 -1.32 . . . . 0.0 110.904 174.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.78 -27.53 58.04 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 120.465 -1.397 . . . . 0.0 111.939 173.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.7 mp -61.14 -41.17 96.24 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.478 1.49 . . . . 0.0 107.878 169.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.84 -48.72 73.31 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.503 -0.76 . . . . 0.0 111.074 176.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 15.3 t60 -55.13 -52.47 63.18 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.033 0.833 . . . . 0.0 109.743 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -60.08 -24.34 64.52 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -178.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -88.26 -29.03 20.72 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.16 0.891 . . . . 0.0 112.467 175.066 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 59.7 mttm -85.37 -39.56 17.47 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.52 1.528 . . . . 0.0 113.084 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.8 t -60.62 -44.6 96.16 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.362 1.865 . . . . 0.0 110.755 176.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.4 pt20 . . . . . 0 CA--C 1.547 0.845 0 O-C-N 121.415 -0.803 . . . . 0.0 112.069 174.805 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 44.8 m80 . . . . . 0 N--CA 1.469 0.486 0 CA-C-O 118.748 -0.644 . . . . 0.0 112.286 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.0 t -65.12 -51.16 62.93 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.847 0.748 . . . . 0.0 109.174 174.273 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -53.6 -34.3 57.93 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.064 1.346 . . . . 0.0 111.972 174.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 52.7 m -73.6 -61.06 1.97 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.162 0.985 . . . . 0.0 111.679 176.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 21.9 mmm -64.28 -30.21 71.27 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 -175.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -65.31 -34.34 78.1 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 120.727 1.603 . . . . 0.0 112.084 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -70.8 -37.27 73.26 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.41 0.684 . . . . 0.0 110.353 175.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 90.3 t -64.6 -48.63 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.578 0.751 . . . . 0.0 110.379 176.029 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.13 -43.57 91.99 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.976 0.911 . . . . 0.0 111.703 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -68.66 -17.13 64.03 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 177.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 72.0 t60 -90.13 -50.84 5.77 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.727 1.211 . . . . 0.0 109.997 174.103 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 38.7 ttp -57.31 -26.46 60.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.581 1.953 . . . . 0.0 113.513 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 2.8 p -60.31 -35.45 75.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.803 1.241 . . . . 0.0 112.886 176.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -111.94 -10.2 13.98 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.86 1.264 . . . . 0.0 114.322 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 43.4 t -63.55 129.85 41.91 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.105 0.866 . . . . 0.0 111.434 178.081 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -101.05 -16.12 17.21 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.103 1.361 . . . . 0.0 114.072 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.31 -31.13 20.36 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.024 0.829 . . . . 0.0 111.758 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.36 -110.77 1.48 Allowed Glycine 0 CA--C 1.532 1.114 0 C-N-CA 124.494 1.045 . . . . 0.0 112.94 178.175 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.53 -20.39 60.13 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 121.384 -1.068 . . . . 0.0 113.187 177.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -96.54 -2.36 45.21 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.621 1.568 . . . . 0.0 113.567 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.7 t -62.5 142.38 57.96 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.145 0.974 . . . . 0.0 110.011 177.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -81.62 -5.28 57.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.254 1.022 . . . . 0.0 113.565 -176.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.0 t -89.22 115.44 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.91 -43.56 73.37 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -62.63 -38.19 89.27 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.509 0.724 . . . . 0.0 112.872 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.6 t -67.13 -57.74 6.21 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.488 1.515 . . . . 0.0 110.165 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -55.21 -36.39 65.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.033 0.933 . . . . 0.0 112.439 178.423 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 13.1 m -69.95 -51.56 31.7 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 124.045 0.938 . . . . 0.0 112.394 175.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 70.2 m -61.09 -37.35 82.43 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.19 -0.944 . . . . 0.0 112.066 -179.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.41 -33.78 68.23 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.141 0.976 . . . . 0.0 112.165 176.578 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -67.46 -31.02 70.89 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.934 0.893 . . . . 0.0 112.057 177.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.5 mt -77.46 -45.33 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-N 118.514 0.597 . . . . 0.0 110.01 176.347 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 28.5 mm -58.37 -38.58 70.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.832 0.853 . . . . 0.0 110.011 176.037 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 67.9 m -62.23 -24.98 67.56 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.17 0.988 . . . . 0.0 113.222 176.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.1 t60 -64.81 -55.88 16.91 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.836 1.198 . . . . 0.0 109.526 176.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 48.4 m95 -59.27 -33.48 71.1 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 178.249 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -68.41 -30.14 68.99 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 177.757 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -100.09 -34.86 9.89 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.5 t -75.86 131.58 39.79 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.41 1.484 . . . . 0.0 112.95 -175.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 67.7 p -130.07 0.6 4.72 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 126.022 1.729 . . . . 0.0 113.421 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 47.6 ttt85 -74.73 135.67 41.79 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.79 1.636 . . . . 0.0 111.22 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 43.2 p-80 -75.33 -36.6 61.01 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 121.897 -0.502 . . . . 0.0 112.166 178.383 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -101.74 69.98 1.23 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.546 1.538 . . . . 0.0 112.462 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 44.7 t -114.62 132.79 22.71 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 126.546 1.938 . . . . 0.0 108.427 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -59.12 -26.17 80.69 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.899 2.4 . . . . 0.0 115.03 -176.136 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 41.8 t -92.22 -49.59 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-N 119.232 0.923 . . . . 0.0 111.601 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 13.0 m -68.88 -43.99 74.16 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.297 1.221 . . . . 0.0 114.297 -176.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.1 tt -53.21 -56.57 22.77 Favored Pre-proline 0 CA--C 1.548 0.877 0 CA-C-O 117.891 -1.052 . . . . 0.0 113.105 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -60.95 -32.68 92.72 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 121.873 1.716 . . . . 0.0 113.188 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 92.6 mt -70.16 -44.06 69.57 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.215 0.916 . . . . 0.0 111.637 177.416 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -60.44 -37.71 81.81 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.496 1.119 . . . . 0.0 110.731 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 17.3 t30 -73.43 -41.32 63.41 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.653 1.581 . . . . 0.0 113.087 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.664 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -177.912 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 9.6 t . . . . . 0 CA--C 1.536 0.432 0 CA-C-O 118.582 -0.723 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -50.73 -31.95 18.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.089 1.356 . . . . 0.0 112.998 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 26.9 m -72.58 -30.84 64.74 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.932 0.893 . . . . 0.0 113.153 178.029 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 30.8 t70 -90.28 -30.15 17.69 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.53 1.532 . . . . 0.0 113.277 174.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 1.8 tt -45.68 -60.03 2.43 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 128.276 2.63 . . . . 0.0 112.969 -175.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.4 p-90 -63.33 -13.85 43.4 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -174.391 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -112.07 -52.33 2.79 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 117.557 2.428 . . . . 0.0 117.557 -177.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 69.8 mt -120.03 20.46 12.11 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 116.319 1.97 . . . . 0.0 116.319 -169.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 12.9 tp . . . . . 0 CA--C 1.549 0.931 0 N-CA-C 115.911 1.819 . . . . 0.0 115.911 -172.923 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 21.7 tp . . . . . 0 CA--C 1.554 1.122 0 CA-C-O 121.059 0.457 . . . . 0.0 111.641 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.8 tpt -70.25 143.97 51.97 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 116.369 1.988 . . . . 0.0 116.369 -174.265 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 71.2 mt -125.02 153.15 43.27 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 127.015 2.126 . . . . 0.0 113.63 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 37.0 p -81.61 161.91 59.91 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 123.454 0.702 . . . . 0.0 110.075 171.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -59.67 -21.35 62.5 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.468 2.112 . . . . 0.0 114.869 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -76.66 -22.04 54.58 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.727 0.811 . . . . 0.0 113.099 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -80.18 -19.4 47.19 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.751 0.82 . . . . 0.0 112.664 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 64.7 mt -55.03 -38.07 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.869 1.668 . . . . 0.0 111.57 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.82 -9.87 48.11 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -82.88 -26.75 31.26 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.943 0.897 . . . . 0.0 112.36 177.019 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.273 4.2 p-90 . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.413 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 58.5 mtpt . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 112.43 0.529 . . . . 0.0 112.43 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -76.28 -43.27 42.44 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.794 0.838 . . . . 0.0 111.285 175.401 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -61.86 -36.07 80.15 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.898 0.879 . . . . 0.0 111.892 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 64.3 mt -68.87 -38.45 79.73 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.659 1.184 . . . . 0.0 111.259 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 48.4 mt -61.76 -50.65 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 118.858 0.754 . . . . 0.0 109.257 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -56.01 -54.73 41.37 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.593 0.757 . . . . 0.0 111.039 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -35.21 80.3 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -177.06 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -68.36 -47.66 66.83 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.259 0.936 . . . . 0.0 109.892 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 10.7 tp -60.37 -39.29 86.7 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.479 0.711 . . . . 0.0 111.296 177.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 90.5 t -62.21 -31.12 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.791 1.178 . . . . 0.0 110.966 175.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.6 tp -73.61 -29.53 62.43 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.658 -1.276 . . . . 0.0 111.984 174.286 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.71 -29.8 69.57 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 120.219 1.372 . . . . 0.0 109.901 173.24 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.5 mt -74.19 -51.88 14.16 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.696 0.798 . . . . 0.0 109.302 175.131 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 24.4 t60 -55.07 -52.99 61.48 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.38 0.672 . . . . 0.0 111.597 178.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -59.12 -23.24 61.96 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -178.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -90.1 -32.88 16.49 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.171 0.896 . . . . 0.0 112.088 173.841 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 49.5 mttm -74.85 -38.24 62.04 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.842 1.257 . . . . 0.0 112.198 177.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 26.0 t -61.12 -50.0 74.98 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.22 2.208 . . . . 0.0 110.951 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.8 pt20 . . . . . 0 CA--C 1.548 0.879 0 O-C-N 121.33 -0.856 . . . . 0.0 112.216 175.435 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 59.5 m80 . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 45.3 t -67.4 -50.81 57.98 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.41 1.084 . . . . 0.0 108.389 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -55.82 -37.53 68.8 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.418 1.487 . . . . 0.0 111.433 173.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.3 m -67.96 -60.08 2.78 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.289 1.035 . . . . 0.0 111.241 176.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.8 mmt -62.17 -35.13 77.87 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -64.7 -32.52 74.23 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 120.922 1.692 . . . . 0.0 112.567 177.524 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.5 m-80 -72.87 -38.62 66.94 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.173 0.589 . . . . 0.0 110.592 174.528 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 58.1 t -63.76 -47.17 92.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-N 118.597 0.635 . . . . 0.0 110.558 176.435 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -44.94 86.22 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.54 0.736 . . . . 0.0 110.864 178.179 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -66.77 -17.66 64.98 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 176.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.7 t60 -90.04 -49.08 6.79 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.021 0.928 . . . . 0.0 109.951 173.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.1 ttp -56.47 -28.45 59.74 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.579 1.951 . . . . 0.0 113.258 -178.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 14.7 p -67.91 -29.4 68.47 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.383 1.073 . . . . 0.0 112.814 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -97.85 -28.9 13.64 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.645 1.578 . . . . 0.0 112.532 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.6 t -63.77 133.71 53.98 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.94 1.296 . . . . 0.0 112.966 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -109.25 -11.94 14.83 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.42 1.488 . . . . 0.0 113.833 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.53 -29.95 20.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.883 0.873 . . . . 0.0 111.409 178.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.41 -112.78 2.88 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.507 1.051 . . . . 0.0 112.963 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 59.5 tttm -60.86 -20.48 61.93 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.44 -1.035 . . . . 0.0 112.855 177.441 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -93.28 -2.64 54.79 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.955 1.302 . . . . 0.0 113.47 176.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 22.7 t -59.87 142.91 52.67 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 122.384 1.088 . . . . 0.0 110.277 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -78.81 -5.74 54.17 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.463 1.105 . . . . 0.0 113.488 -176.178 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 6.7 t -96.98 123.55 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.821 1.248 . . . . 0.0 108.715 175.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.28 -45.12 72.42 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -176.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -30.6 71.06 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 -178.357 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 54.0 t -72.27 -56.37 5.63 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.164 0.986 . . . . 0.0 109.738 178.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.73 -26.44 63.95 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 177.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 46.1 m -80.56 -45.31 17.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.819 0.847 . . . . 0.0 111.586 176.147 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 63.7 m -64.99 -34.55 78.71 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.316 1.046 . . . . 0.0 112.741 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.55 -30.86 70.92 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.332 -0.855 . . . . 0.0 111.879 176.461 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -68.41 -31.18 70.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.565 0.746 . . . . 0.0 111.764 177.02 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.3 mm -70.39 -45.6 74.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 30.1 mm -62.49 -39.35 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 124.887 1.275 . . . . 0.0 110.429 177.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 16.5 t -59.66 -29.95 68.41 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.413 1.085 . . . . 0.0 112.717 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.5 t60 -60.06 -51.76 68.24 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.146 0.884 . . . . 0.0 110.486 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 24.8 m95 -64.74 -24.52 67.59 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 14.2 mptt -75.91 -30.4 58.76 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.586 0.754 . . . . 0.0 112.509 176.007 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -100.04 -34.75 9.95 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -178.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.1 t -79.27 131.29 36.11 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.992 1.317 . . . . 0.0 112.924 -176.651 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.0 p -130.05 -3.88 4.51 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.815 1.646 . . . . 0.0 114.209 -178.765 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -82.44 141.76 32.47 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.551 1.54 . . . . 0.0 111.842 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 47.7 p-80 -77.45 -40.56 42.82 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.88 -0.513 . . . . 0.0 111.993 177.318 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.2 t70 -87.0 69.98 10.27 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.045 1.738 . . . . 0.0 111.518 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 41.9 t -121.34 133.55 24.24 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.305 1.842 . . . . 0.0 109.347 178.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -59.66 -24.0 73.71 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.608 2.205 . . . . 0.0 113.572 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 15.8 t -92.12 -54.97 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 119.268 0.94 . . . . 0.0 111.637 176.423 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 17.0 m -69.22 -35.29 76.03 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -174.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -57.08 -56.89 28.78 Favored Pre-proline 0 CA--C 1.548 0.889 0 CA-C-N 120.01 1.277 . . . . 0.0 112.629 -178.129 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -60.21 -32.8 94.89 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 121.84 1.693 . . . . 0.0 113.161 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.2 mt -68.7 -47.85 65.38 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 118.798 0.727 . . . . 0.0 111.929 178.183 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -59.65 -37.1 77.79 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.034 0.533 . . . . 0.0 111.772 176.729 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 14.0 t30 -70.46 -40.75 73.5 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.611 1.564 . . . . 0.0 112.33 177.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.707 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -179.708 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 28.9 m . . . . . 0 N--CA 1.479 0.993 0 N-CA-C 111.132 0.049 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -60.13 -24.92 65.07 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.786 0.835 . . . . 0.0 112.737 176.514 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 11.2 m -70.19 -35.99 74.33 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.119 0.872 . . . . 0.0 113.104 179.169 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.8 t70 -90.18 -27.91 19.24 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.69 0.796 . . . . 0.0 112.818 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.8 tt -43.09 -58.4 2.47 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 126.919 2.088 . . . . 0.0 113.685 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 52.9 p-90 -70.18 -10.42 58.79 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -173.265 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 9.3 ptmm? -112.19 -59.91 1.93 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.251 1.945 . . . . 0.0 116.251 -175.568 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 59.1 mt -119.45 17.31 12.96 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 116.165 1.913 . . . . 0.0 116.165 -171.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.554 1.113 0 C-N-CA 126.154 1.781 . . . . 0.0 113.536 179.037 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 22.7 tp . . . . . 0 CA--C 1.551 1.015 0 N-CA-C 111.701 0.259 . . . . 0.0 111.701 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 7.8 tpt -64.35 146.22 54.78 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 18.2 tp -125.02 151.5 45.5 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.032 2.133 . . . . 0.0 113.047 -174.747 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 62.0 m -82.87 145.18 49.42 Favored Pre-proline 0 N--CA 1.476 0.84 0 C-N-CA 123.501 0.72 . . . . 0.0 110.493 174.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.47 -30.58 74.39 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.839 2.359 . . . . 0.0 115.734 -177.508 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.47 -22.31 66.14 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 178.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -87.98 -10.06 51.58 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.568 1.147 . . . . 0.0 113.673 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 96.6 mt -58.43 -34.49 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 CA-C-N 119.29 0.95 . . . . 0.0 109.776 175.624 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -66.85 -9.9 42.5 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.432 1.893 . . . . 0.0 114.058 177.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -87.51 -26.84 22.98 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.821 0.848 . . . . 0.0 112.361 178.214 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 . . . . . 0 N--CA 1.472 0.648 0 C-N-CA 123.787 0.835 . . . . 0.0 112.336 176.887 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 92.8 mttt . . . . . 0 N--CA 1.473 0.699 0 CA-C-O 119.044 -0.503 . . . . 0.0 110.54 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -57.96 -46.63 84.83 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.68 0.792 . . . . 0.0 111.534 176.455 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -60.47 -40.13 90.11 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.548 0.739 . . . . 0.0 111.393 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 71.6 mt -66.15 -40.61 90.69 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 117.916 -1.04 . . . . 0.0 111.961 177.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -62.45 -52.93 53.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 CA-C-N 120.038 1.29 . . . . 0.0 109.267 175.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -54.02 -54.01 45.03 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.014 0.925 . . . . 0.0 111.148 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -65.06 -36.17 83.48 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.379 -0.826 . . . . 0.0 112.58 -179.201 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -68.04 -45.45 73.9 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.039 0.836 . . . . 0.0 110.599 177.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.6 tt -62.6 -41.29 98.88 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.185 0.994 . . . . 0.0 110.516 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 99.5 t -60.17 -32.16 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 CA-C-N 119.269 0.94 . . . . 0.0 111.031 174.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.8 tp -69.98 -31.21 68.79 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.812 -1.18 . . . . 0.0 112.313 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.41 -28.36 69.2 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 120.325 1.42 . . . . 0.0 110.062 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 5.2 mt -72.89 -50.45 23.69 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.365 1.066 . . . . 0.0 109.579 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.0 t60 -57.25 -55.95 28.07 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 122.768 0.427 . . . . 0.0 110.313 176.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.01 -25.24 43.57 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.879 1.272 . . . . 0.0 114.429 -178.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -90.11 -31.35 17.15 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 175.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 41.6 mttm -83.91 -36.16 23.54 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.598 1.159 . . . . 0.0 112.122 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.3 t -61.27 -53.75 52.79 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.092 2.157 . . . . 0.0 110.948 177.551 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.2 pt20 . . . . . 0 N--CA 1.475 0.797 0 O-C-N 121.042 -1.036 . . . . 0.0 113.121 176.978 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 57.8 m80 . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 33.2 t -66.92 -50.17 63.25 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.313 1.045 . . . . 0.0 108.748 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -54.69 -34.39 62.24 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.341 1.456 . . . . 0.0 111.91 174.44 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 26.2 m -72.82 -58.44 3.34 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.672 1.189 . . . . 0.0 111.607 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -37.58 82.46 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.549 -0.719 . . . . 0.0 112.603 -178.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -62.7 -34.44 77.14 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.424 1.466 . . . . 0.0 113.071 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -71.04 -39.69 72.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.061 0.544 . . . . 0.0 110.421 175.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 94.5 t -64.38 -46.57 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.361 0.664 . . . . 0.0 110.831 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.92 -42.29 93.62 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.124 0.969 . . . . 0.0 111.84 178.568 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -66.59 -30.64 70.98 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 55.8 t60 -77.78 -48.67 16.02 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.988 0.813 . . . . 0.0 110.213 175.329 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 35.7 ttp -56.42 -31.86 64.32 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.303 1.841 . . . . 0.0 114.199 -177.024 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.7 t -77.48 -10.13 59.3 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 119.805 1.184 . . . . 0.0 112.999 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 50.8 m80 -114.28 -18.99 11.46 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.797 1.639 . . . . 0.0 113.175 177.264 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 34.8 t -57.57 145.62 33.04 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.493 1.517 . . . . 0.0 112.879 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -109.41 -14.86 14.35 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.821 1.648 . . . . 0.0 113.648 -179.207 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -104.55 -30.16 10.19 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.465 1.106 . . . . 0.0 112.666 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.99 -110.66 1.59 Allowed Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.61 1.1 . . . . 0.0 113.822 177.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.32 -15.77 60.92 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 120.93 -1.335 . . . . 0.0 113.372 177.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -99.52 -0.21 41.07 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.937 1.695 . . . . 0.0 113.011 174.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 15.4 t -63.71 142.03 58.55 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.326 1.05 . . . . 0.0 110.033 178.128 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -81.58 -5.25 57.84 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.287 1.035 . . . . 0.0 113.489 -176.043 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.8 t -87.22 114.49 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 172.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.78 -39.41 65.4 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -176.467 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -67.78 -41.05 83.83 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.344 0.658 . . . . 0.0 112.585 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.9 t -62.12 -54.82 35.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.981 1.312 . . . . 0.0 110.198 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.6 -22.96 64.31 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.044 0.938 . . . . 0.0 113.078 177.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.4 m -82.01 -52.06 7.42 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.051 0.941 . . . . 0.0 111.939 176.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 41.7 m -61.05 -34.18 74.47 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 119.17 0.895 . . . . 0.0 112.056 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -60.04 -31.31 69.85 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.285 -0.885 . . . . 0.0 112.759 175.008 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -69.11 -30.7 69.04 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.707 1.14 . . . . 0.0 111.229 176.214 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 15.0 mt -74.27 -48.42 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.502 1.121 . . . . 0.0 109.929 176.026 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 25.8 mm -61.86 -37.47 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.939 0.895 . . . . 0.0 111.046 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 73.1 m -61.74 -24.83 67.06 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.395 -0.815 . . . . 0.0 112.869 176.509 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 10.0 t60 -64.91 -54.85 24.21 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.411 1.005 . . . . 0.0 109.963 176.56 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 46.3 m95 -62.05 -28.83 69.87 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 177.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -71.03 -29.93 65.99 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.784 0.834 . . . . 0.0 112.709 177.477 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -100.19 -40.85 7.36 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.2 t -77.76 135.45 38.0 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.472 1.509 . . . . 0.0 112.381 -177.316 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 3.8 t -130.11 2.76 4.77 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.542 1.537 . . . . 0.0 114.008 -179.604 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -78.25 153.49 31.82 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.207 1.403 . . . . 0.0 114.207 -177.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 80.6 t60 -86.89 -39.26 15.97 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.086 0.955 . . . . 0.0 109.859 170.743 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.7 t70 -93.71 78.59 4.25 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.654 1.582 . . . . 0.0 111.682 178.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.2 t -137.79 135.06 18.52 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 126.882 2.073 . . . . 0.0 108.887 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -58.56 -26.95 80.85 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 122.809 2.339 . . . . 0.0 114.799 -177.125 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 4.9 t -92.11 -50.68 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 119.653 1.115 . . . . 0.0 111.869 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.7 m -69.92 -39.21 76.29 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -175.13 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.5 tt -53.34 -57.7 15.73 Favored Pre-proline 0 N--CA 1.474 0.746 0 CA-C-O 117.588 -1.196 . . . . 0.0 112.781 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.62 -32.7 93.64 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-N 121.569 1.596 . . . . 0.0 113.424 -179.7 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.27 -46.8 63.62 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.636 1.107 . . . . 0.0 112.011 178.381 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -64.49 -30.52 71.55 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.346 1.059 . . . . 0.0 111.416 177.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 37.8 t30 -78.07 -41.58 34.97 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.797 1.639 . . . . 0.0 112.39 176.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.557 0 C-N-CA 124.761 1.224 . . . . 0.0 114.192 -179.253 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 76.8 m . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -60.21 -24.82 65.12 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 9.1 t -75.63 -31.05 59.7 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.897 0.879 . . . . 0.0 112.359 178.336 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.9 t70 -90.02 -28.07 19.32 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.001 0.92 . . . . 0.0 112.319 175.677 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.9 tt -46.49 -59.02 3.24 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 126.993 2.117 . . . . 0.0 112.847 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.6 p-90 -69.69 -9.24 53.6 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.021 1.489 . . . . 0.0 115.021 -173.172 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -112.0 -56.25 2.41 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -177.243 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 50.1 mt -120.14 15.86 12.36 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -172.159 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.2 tt . . . . . 0 CA--C 1.549 0.909 0 C-N-CA 126.07 1.748 . . . . 0.0 114.891 -179.18 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 23.9 tp . . . . . 0 CA--C 1.554 1.125 0 CA-C-O 121.051 0.453 . . . . 0.0 111.756 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 8.0 tpt -71.73 151.77 43.32 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 115.923 1.823 . . . . 0.0 115.923 -175.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 91.3 mt -125.03 162.98 23.36 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.061 2.144 . . . . 0.0 113.709 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 31.2 t -83.67 144.83 46.21 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 169.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -56.86 -20.32 35.49 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.248 1.965 . . . . 0.0 114.718 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -69.04 -25.08 64.3 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.863 0.865 . . . . 0.0 112.76 177.439 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.3 t70 -83.76 -12.76 55.3 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 80.3 mt -56.18 -36.39 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 124.571 1.148 . . . . 0.0 110.465 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -66.01 -10.0 35.68 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.014 1.326 . . . . 0.0 113.863 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 20.8 tp60 -84.64 -29.6 25.59 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.104 -0.998 . . . . 0.0 112.596 177.785 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 3.2 p-90 . . . . . 0 N--CA 1.473 0.705 0 C-N-CA 123.735 0.814 . . . . 0.0 111.907 176.655 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 45.2 mmtm . . . . . 0 N--CA 1.473 0.711 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -63.3 -42.35 99.04 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.652 0.66 . . . . 0.0 110.474 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -62.07 -33.4 74.33 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.213 1.005 . . . . 0.0 112.497 176.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 71.5 mt -64.27 -41.31 96.99 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 120.1 1.318 . . . . 0.0 111.451 175.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.8 mt -64.7 -51.47 66.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.054 0.541 . . . . 0.0 109.736 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -55.35 -55.16 34.69 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.396 1.078 . . . . 0.0 111.299 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -34.42 77.79 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -177.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -68.91 -44.84 72.34 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.103 0.865 . . . . 0.0 110.52 176.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 7.6 tp -62.65 -39.69 94.69 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.609 0.641 . . . . 0.0 110.896 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 58.0 t -60.29 -32.21 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 CA-C-N 119.449 1.022 . . . . 0.0 110.95 175.461 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 9.3 tp -71.37 -31.71 67.64 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 120.793 -1.192 . . . . 0.0 112.138 175.191 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.61 -28.91 69.7 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 120.211 1.369 . . . . 0.0 109.938 174.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.9 mt -72.55 -52.9 13.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.707 0.803 . . . . 0.0 109.584 175.277 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.0 t60 -55.02 -54.39 43.67 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 122.902 0.481 . . . . 0.0 110.531 177.74 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -57.22 -25.3 58.86 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -178.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -90.01 -31.42 17.21 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.467 1.031 . . . . 0.0 113.323 175.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 76.9 mttt -80.54 -39.59 27.5 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.4 1.48 . . . . 0.0 112.231 179.672 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 51.9 t -62.76 -51.25 67.86 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 127.635 2.374 . . . . 0.0 112.048 178.747 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.0 pt20 . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -179.947 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 45.0 m80 . . . . . 0 N--CA 1.471 0.617 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 36.0 t -66.09 -50.15 65.07 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.74 1.216 . . . . 0.0 108.948 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -54.99 -34.66 63.6 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.264 1.426 . . . . 0.0 111.824 174.407 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.8 m -71.83 -59.56 2.69 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.526 1.13 . . . . 0.0 111.446 176.688 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.46 -37.79 79.1 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.771 -0.633 . . . . 0.0 112.522 -178.435 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -63.83 -34.34 77.71 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 120.505 1.502 . . . . 0.0 113.1 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -71.17 -37.66 72.19 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.011 0.524 . . . . 0.0 110.519 175.334 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 91.6 t -65.67 -47.04 87.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 122.934 0.493 . . . . 0.0 110.623 176.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.78 -43.38 85.51 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.784 0.833 . . . . 0.0 111.156 178.12 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 33.7 m-80 -68.22 -17.64 64.36 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 176.813 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 62.7 t60 -90.11 -47.81 7.58 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.815 0.846 . . . . 0.0 109.497 173.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -57.28 -28.44 63.01 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.339 1.856 . . . . 0.0 113.293 -178.068 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 7.5 p -66.88 -27.05 67.2 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.488 1.115 . . . . 0.0 112.542 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 68.8 m80 -102.51 -22.2 14.07 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.059 1.744 . . . . 0.0 113.443 178.828 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 19.4 t -64.18 142.86 58.26 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.442 1.497 . . . . 0.0 112.692 -179.065 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -117.72 -12.77 10.22 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.651 1.58 . . . . 0.0 113.814 -179.121 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -91.44 -27.59 18.2 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.976 0.91 . . . . 0.0 112.058 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 55.69 -114.16 4.58 Favored Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.219 0.914 . . . . 0.0 112.605 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 82.2 tttt -62.18 -20.49 64.2 Favored 'General case' 0 N--CA 1.479 0.994 0 O-C-N 121.316 -1.109 . . . . 0.0 112.803 177.453 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.5 -1.96 57.36 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.917 1.287 . . . . 0.0 113.466 176.495 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 17.5 t -63.64 141.96 58.57 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 122.058 0.932 . . . . 0.0 109.599 177.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -80.54 -3.9 51.91 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -175.462 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 96.5 t -91.67 115.01 29.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 172.862 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.89 -39.51 68.81 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -176.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -65.84 -38.89 90.09 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.675 0.79 . . . . 0.0 112.517 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 40.7 t -66.69 -55.06 16.88 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.382 1.473 . . . . 0.0 110.163 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.72 -26.12 63.61 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.005 0.922 . . . . 0.0 113.393 177.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.4 m -81.93 -46.49 13.97 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 124.214 1.006 . . . . 0.0 111.535 175.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 66.8 m -61.98 -36.05 80.31 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.375 1.07 . . . . 0.0 112.284 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -61.16 -31.98 71.71 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.747 0.819 . . . . 0.0 112.16 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -68.91 -29.68 68.0 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.4 0.68 . . . . 0.0 111.714 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.1 mm -71.17 -46.74 64.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.604 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 18.9 mm -60.99 -38.45 79.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 124.96 1.304 . . . . 0.0 110.974 177.319 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 70.5 m -62.15 -21.91 65.44 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.283 1.033 . . . . 0.0 113.271 177.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.2 t60 -65.28 -60.21 3.23 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.474 1.034 . . . . 0.0 110.683 178.033 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 52.6 m95 -60.15 -24.13 64.46 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 177.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 61.8 mtpt -74.53 -35.95 63.15 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.95 0.9 . . . . 0.0 112.748 178.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.03 -32.72 10.81 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 8.9 t -82.29 132.92 35.22 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.522 1.529 . . . . 0.0 110.979 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.2 p -129.98 0.47 4.76 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.352 1.461 . . . . 0.0 114.427 -177.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -80.09 151.95 29.58 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.831 1.252 . . . . 0.0 113.093 -178.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 40.6 p-80 -86.41 -29.22 23.04 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.694 0.798 . . . . 0.0 111.444 173.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.8 t0 -100.27 70.05 1.5 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.46 1.904 . . . . 0.0 111.511 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 41.7 t -127.88 135.18 27.1 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 126.615 1.966 . . . . 0.0 109.22 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -58.56 -25.08 72.98 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 122.814 2.343 . . . . 0.0 114.204 -178.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.2 t -92.19 -52.49 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 119.682 1.128 . . . . 0.0 111.732 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 10.4 m -68.76 -40.25 79.85 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -175.217 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -53.42 -57.95 14.83 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-O 117.414 -1.279 . . . . 0.0 112.866 -178.087 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -59.93 -34.11 95.4 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 121.918 1.745 . . . . 0.0 113.565 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.5 mt -70.24 -47.13 62.74 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.977 0.808 . . . . 0.0 111.924 178.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -64.6 -34.75 79.0 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.982 0.913 . . . . 0.0 110.886 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.8 t30 -70.12 -43.15 71.6 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.254 1.421 . . . . 0.0 111.77 176.605 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.623 0 C-N-CA 123.939 0.896 . . . . 0.0 112.46 178.343 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 90.5 m . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 119.946 -0.073 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -60.08 -27.49 67.04 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.619 0.767 . . . . 0.0 112.967 176.084 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 24.2 m -68.01 -34.72 77.05 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.611 0.764 . . . . 0.0 112.663 178.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.31 -28.73 18.56 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 174.245 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 2.6 tt -43.24 -60.06 1.83 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.4 1.88 . . . . 0.0 113.318 -177.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 50.1 p-90 -63.0 -12.49 26.25 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -173.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 16.1 pttp -111.94 -50.25 2.93 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -177.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 66.2 mt -120.08 20.44 12.09 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 117.203 2.297 . . . . 0.0 117.203 -169.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 12.4 tp . . . . . 0 CA--C 1.551 1.019 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -173.943 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 93.0 mt . . . . . 0 CA--C 1.551 1.009 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.39 149.51 44.25 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.844 -1.16 . . . . 0.0 113.356 -177.578 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.14 179.66 4.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.31 1.844 . . . . 0.0 114.242 -175.785 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 6.1 p -79.92 160.13 69.55 Favored Pre-proline 0 CA--C 1.545 0.769 0 O-C-N 121.464 -0.773 . . . . 0.0 109.452 169.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.37 -15.16 47.1 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 121.725 1.617 . . . . 0.0 113.009 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -85.61 -28.86 24.53 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.346 1.058 . . . . 0.0 111.452 176.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -67.71 -21.0 65.33 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.674 0.79 . . . . 0.0 112.243 177.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 97.2 mt -57.43 -35.84 50.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.993 0.917 . . . . 0.0 109.678 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -72.86 -10.0 59.31 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 179.564 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -78.24 -30.46 48.73 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.052 -1.03 . . . . 0.0 111.336 175.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 7.4 p-90 . . . . . 0 CA--C 1.542 0.667 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 177.704 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 81.0 mttt . . . . . 0 N--CA 1.471 0.616 0 CA-C-O 117.792 -1.099 . . . . 0.0 112.021 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 10.5 ptt-85 -64.52 -35.97 82.69 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.641 1.564 . . . . 0.0 111.655 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -63.07 -38.39 91.01 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.171 0.896 . . . . 0.0 111.267 173.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 97.6 mt -63.69 -38.88 92.79 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.714 0.688 . . . . 0.0 111.198 176.345 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -68.05 -51.96 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 118.928 0.785 . . . . 0.0 109.851 175.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -52.89 -53.64 46.19 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.226 1.01 . . . . 0.0 111.373 179.108 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -38.06 88.14 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 119.282 0.946 . . . . 0.0 112.503 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -70.13 -45.91 65.85 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.681 0.673 . . . . 0.0 111.119 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.0 tt -63.05 -43.05 99.71 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.587 0.755 . . . . 0.0 109.948 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 61.9 t -63.94 -24.34 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 120.737 -1.227 . . . . 0.0 111.131 174.047 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.44 -31.25 57.74 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.292 -1.505 . . . . 0.0 111.612 173.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.7 mp -59.86 -41.65 91.93 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 169.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.3 mp -67.26 -47.46 70.65 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 117.704 -1.141 . . . . 0.0 111.997 176.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 30.2 t60 -55.06 -55.01 35.84 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.746 1.157 . . . . 0.0 108.719 176.065 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.38 -45.92 66.0 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.147 0.979 . . . . 0.0 113.27 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -69.43 -39.26 77.94 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.513 -0.742 . . . . 0.0 112.817 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 49.1 mttp -74.9 -32.8 61.92 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.007 -1.058 . . . . 0.0 111.736 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 8.3 t -68.52 -42.14 78.93 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.253 1.821 . . . . 0.0 109.424 173.816 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 14.4 tt0 . . . . . 0 CA--C 1.544 0.742 0 C-N-CA 125.232 1.413 . . . . 0.0 110.056 172.237 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 19.7 m170 . . . . . 0 N--CA 1.471 0.59 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 5.1 t -64.94 -51.84 59.6 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.091 1.357 . . . . 0.0 109.228 175.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -52.02 -41.87 62.58 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.179 1.792 . . . . 0.0 111.774 175.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 5.1 m -66.99 -58.63 4.58 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.934 1.294 . . . . 0.0 111.252 176.086 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.2 mmt -62.67 -33.1 74.38 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -177.201 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -67.09 -30.39 70.4 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 121.138 1.79 . . . . 0.0 112.51 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -72.07 -36.81 69.65 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 122.875 0.47 . . . . 0.0 110.264 172.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 71.2 t -62.61 -46.94 95.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 123.076 0.55 . . . . 0.0 110.13 175.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.23 -41.29 92.8 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.253 1.021 . . . . 0.0 112.002 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -63.6 -39.55 94.66 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.013 0.525 . . . . 0.0 111.762 175.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.8 -50.75 27.03 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.268 0.627 . . . . 0.0 111.15 176.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 30.1 ttp -57.54 -34.9 69.64 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.318 1.847 . . . . 0.0 114.378 -175.598 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 13.0 t -74.35 -16.1 60.92 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 120.06 1.3 . . . . 0.0 112.544 175.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -98.84 -30.64 12.29 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.53 1.532 . . . . 0.0 112.039 176.72 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 36.4 t -61.95 145.15 53.79 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.418 1.887 . . . . 0.0 112.279 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -121.33 -5.39 9.37 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.406 1.482 . . . . 0.0 114.718 -177.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -88.95 -15.5 34.12 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.486 1.039 . . . . 0.0 113.211 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 58.69 -126.9 43.9 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 121.38 -0.825 . . . . 0.0 112.007 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -66.48 -10.06 40.64 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -94.26 0.35 55.59 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.573 1.149 . . . . 0.0 113.445 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.1 t -59.17 140.77 55.57 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.331 1.062 . . . . 0.0 110.383 177.441 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 55.1 mm-40 -77.94 -9.0 58.87 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.853 1.261 . . . . 0.0 113.319 -176.339 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 10.9 t -93.94 124.13 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.491 1.116 . . . . 0.0 108.652 175.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.63 -50.36 65.88 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -176.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -62.4 -32.85 73.73 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -178.318 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 49.7 t -68.61 -59.37 3.17 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.937 0.789 . . . . 0.0 109.992 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.73 68.67 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.647 0.779 . . . . 0.0 112.419 178.058 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 19.8 m -69.32 -51.9 32.57 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.314 -0.866 . . . . 0.0 112.08 176.106 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 36.7 m -62.9 -33.64 75.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.853 1.206 . . . . 0.0 112.066 178.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -59.65 -34.15 72.45 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.474 -0.766 . . . . 0.0 111.872 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -65.93 -27.83 68.47 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 118.924 0.784 . . . . 0.0 111.697 175.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 11.6 mt -76.73 -48.02 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.171 0.989 . . . . 0.0 109.886 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 20.4 mm -59.25 -38.02 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 124.191 0.996 . . . . 0.0 110.741 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 22.3 t -58.46 -29.34 66.1 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.799 1.239 . . . . 0.0 112.8 176.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 10.8 t60 -61.53 -55.89 26.07 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.295 -0.878 . . . . 0.0 110.453 176.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 51.7 m95 -61.3 -31.96 71.8 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 178.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -67.23 -34.76 78.15 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 118.606 -0.711 . . . . 0.0 112.824 178.539 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.6 p30 -100.1 -30.76 11.77 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 11.1 t -78.58 125.7 29.73 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.775 1.23 . . . . 0.0 112.095 -178.201 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 54.4 p -111.32 1.66 17.23 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.858 1.663 . . . . 0.0 113.941 -178.132 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 64.7 mtm180 -85.35 162.07 19.22 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.346 1.458 . . . . 0.0 114.084 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 15.3 t-160 -106.67 -37.96 6.27 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.656 1.582 . . . . 0.0 108.425 170.032 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -85.75 69.88 10.64 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.094 1.758 . . . . 0.0 111.097 175.526 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 44.3 t -131.62 136.79 29.07 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 126.898 2.079 . . . . 0.0 109.224 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -55.29 -28.38 62.15 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.903 2.402 . . . . 0.0 114.566 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.9 t -92.14 -52.14 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 119.461 1.028 . . . . 0.0 111.941 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 4.9 m -68.39 -34.89 76.83 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 115.203 1.556 . . . . 0.0 115.203 -174.714 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -54.8 -58.9 12.22 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-O 117.678 -1.153 . . . . 0.0 113.083 -178.62 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.23 -31.83 93.56 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.983 1.789 . . . . 0.0 113.402 179.494 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.72 -48.09 60.78 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.706 0.802 . . . . 0.0 111.988 178.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -67.22 -25.19 65.99 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.115 0.966 . . . . 0.0 111.993 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 18.9 t30 -77.46 -40.37 43.43 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.112 1.365 . . . . 0.0 111.699 175.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.671 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -179.198 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 86.2 m . . . . . 0 N--CA 1.474 0.733 0 CA-C-O 119.893 -0.099 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -60.29 -27.31 67.19 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.661 -0.649 . . . . 0.0 112.462 174.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 53.7 m -71.54 -31.23 66.8 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.43 0.692 . . . . 0.0 112.802 178.571 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.1 t70 -90.15 -28.62 18.81 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.438 1.095 . . . . 0.0 112.966 175.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.1 tt -44.39 -60.1 2.1 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.926 2.09 . . . . 0.0 113.314 -178.227 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.8 p-90 -70.94 -4.81 26.57 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -112.02 -59.97 1.92 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.736 1.754 . . . . 0.0 115.736 -177.419 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 7.0 mp -120.23 14.27 12.12 Favored 'General case' 0 CA--C 1.554 1.135 0 N-CA-C 116.372 1.99 . . . . 0.0 116.372 -174.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 4.4 tt . . . . . 0 CA--C 1.552 1.048 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -178.437 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 29.5 tp . . . . . 0 CA--C 1.556 1.175 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 13.3 tpt -76.81 150.88 36.1 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -175.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.9 mp -125.04 159.91 30.25 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 125.602 1.561 . . . . 0.0 111.992 177.003 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.3 m -66.63 152.16 95.5 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 170.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -64.02 -11.49 27.57 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 122.25 1.967 . . . . 0.0 115.788 -174.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -80.08 -18.02 51.1 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.406 -0.809 . . . . 0.0 112.236 177.195 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -84.85 -9.97 57.61 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.481 1.112 . . . . 0.0 112.232 177.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 95.8 mt -58.55 -35.25 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.658 1.183 . . . . 0.0 109.711 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -65.58 -11.24 42.38 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.077 1.351 . . . . 0.0 113.167 177.329 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -82.94 -25.37 32.44 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.604 1.162 . . . . 0.0 112.286 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.3 p-90 . . . . . 0 CA--C 1.542 0.649 0 C-N-CA 124.517 1.127 . . . . 0.0 113.677 178.321 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 57.8 mtpt . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 119.397 -0.335 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 42.3 mtm105 -63.73 -38.16 90.07 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 118.617 -0.706 . . . . 0.0 111.665 175.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -58.08 -36.72 73.25 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 119.082 0.855 . . . . 0.0 111.492 173.232 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 55.6 mt -64.17 -45.0 90.34 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.646 0.657 . . . . 0.0 110.937 176.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -58.23 -51.11 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-N 118.142 0.428 . . . . 0.0 110.102 177.466 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -57.34 -53.08 62.23 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.531 1.133 . . . . 0.0 111.414 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.98 -33.29 75.47 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.458 1.026 . . . . 0.0 112.847 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -67.86 -46.19 72.45 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.315 0.962 . . . . 0.0 109.305 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 12.0 tp -61.78 -39.65 92.41 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.949 1.3 . . . . 0.0 111.861 177.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 96.1 t -60.29 -32.52 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.056 1.298 . . . . 0.0 110.331 174.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.4 tp -73.65 -29.49 62.36 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 120.86 -1.15 . . . . 0.0 112.779 175.01 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.37 -29.93 69.24 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 120.102 1.319 . . . . 0.0 109.56 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.5 mt -71.67 -53.68 12.8 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.483 -0.761 . . . . 0.0 109.768 175.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 12.4 t60 -54.62 -53.62 52.24 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.381 0.673 . . . . 0.0 110.925 178.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -59.91 -21.94 61.75 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -178.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -87.53 -32.99 19.11 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.119 0.872 . . . . 0.0 111.958 174.26 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 39.2 mttm -84.16 -41.5 16.97 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.043 1.337 . . . . 0.0 113.346 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 34.5 t -56.73 -45.74 81.76 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.382 1.873 . . . . 0.0 111.212 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 13.5 pt20 . . . . . 0 CA--C 1.547 0.845 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 176.387 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 72.8 m80 . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.4 t -62.27 -49.15 76.82 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.242 1.017 . . . . 0.0 110.379 178.021 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 31.5 tpt180 -55.21 -37.58 67.32 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.916 1.286 . . . . 0.0 111.96 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 52.0 m -68.84 -55.77 10.1 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.672 0.789 . . . . 0.0 111.389 177.374 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.9 mmt -64.45 -35.25 80.33 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.243 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -64.74 -33.29 75.62 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.711 1.596 . . . . 0.0 112.335 178.15 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -70.72 -40.89 72.52 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.49 0.716 . . . . 0.0 110.298 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 78.6 t -62.61 -47.54 92.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 123.353 0.661 . . . . 0.0 110.566 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.13 -42.83 95.63 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.182 0.993 . . . . 0.0 112.575 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -65.08 -30.33 71.28 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 177.287 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 64.8 t60 -78.32 -52.48 8.56 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.577 0.751 . . . . 0.0 110.3 174.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.6 ttp -55.6 -35.84 66.25 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.1 1.76 . . . . 0.0 113.698 -176.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 6.0 t -71.44 -11.46 60.9 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.101 1.319 . . . . 0.0 113.55 178.105 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -112.9 -22.74 10.48 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.365 1.466 . . . . 0.0 112.791 176.51 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 39.0 t -56.91 138.19 54.22 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.475 1.51 . . . . 0.0 112.452 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -103.48 -16.55 15.53 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.672 1.589 . . . . 0.0 113.699 -178.262 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -95.68 -31.18 13.36 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.34 1.056 . . . . 0.0 112.678 -178.617 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.76 -108.06 0.65 Allowed Glycine 0 CA--C 1.536 1.35 0 C-N-CA 124.561 1.076 . . . . 0.0 112.917 178.57 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 67.3 mttm -58.37 -25.08 61.62 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 121.446 -1.032 . . . . 0.0 113.13 177.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -96.09 -0.69 49.96 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.335 1.454 . . . . 0.0 114.005 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.2 t -60.07 144.24 50.08 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 122.341 1.067 . . . . 0.0 111.007 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -80.01 -8.77 59.53 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.611 1.165 . . . . 0.0 113.036 -177.07 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.9 t -89.56 117.41 32.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 173.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.58 -40.73 72.39 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -177.516 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -64.06 -38.37 90.82 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.664 0.786 . . . . 0.0 112.915 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 51.9 t -68.03 -57.14 6.64 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.458 1.503 . . . . 0.0 110.285 178.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.35 -28.09 62.85 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.296 1.039 . . . . 0.0 113.084 177.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 68.7 m -79.32 -49.77 11.91 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.739 0.816 . . . . 0.0 112.268 176.18 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.6 m -61.61 -33.98 74.86 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.498 -0.751 . . . . 0.0 111.962 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -58.75 -31.87 68.73 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.014 0.926 . . . . 0.0 112.546 176.508 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -68.74 -35.3 76.94 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.074 0.852 . . . . 0.0 111.592 176.757 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 7.9 mt -68.84 -45.23 81.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 123.846 0.858 . . . . 0.0 109.668 176.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 18.1 mm -62.44 -40.75 89.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.151 0.98 . . . . 0.0 110.911 175.31 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 70.8 m -61.09 -26.66 67.81 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.968 0.907 . . . . 0.0 113.106 178.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.5 t60 -62.14 -56.59 17.26 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.688 1.131 . . . . 0.0 109.889 177.216 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 41.5 m95 -60.19 -30.63 69.49 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 178.123 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -72.8 -28.13 62.4 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 178.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -100.14 -34.97 9.82 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 179.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.3 t -74.39 134.16 42.44 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.413 1.485 . . . . 0.0 111.225 -178.374 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 61.6 p -123.22 -9.65 8.11 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -176.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -78.91 159.81 27.56 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 0.0 113.499 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 39.2 p-80 -93.14 -25.22 17.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.695 1.198 . . . . 0.0 111.324 172.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 17.5 t0 -106.84 86.13 2.27 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.615 1.966 . . . . 0.0 110.797 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 50.9 t -138.69 135.87 18.25 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 126.842 2.057 . . . . 0.0 108.7 179.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -58.76 -26.55 80.45 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 123.049 2.5 . . . . 0.0 114.627 -177.146 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 39.4 t -92.07 -48.97 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.636 1.107 . . . . 0.0 111.643 176.363 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.5 m -69.96 -43.98 70.43 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -175.405 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.03 -54.31 48.62 Favored Pre-proline 0 CA--C 1.552 1.021 0 O-C-N 120.904 -1.123 . . . . 0.0 112.845 -178.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -65.8 -4.41 9.88 Favored 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 122.91 2.406 . . . . 0.0 114.996 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.6 mt -100.0 -47.61 4.94 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.91 1.284 . . . . 0.0 109.911 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -58.59 -36.86 74.65 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.204 1.402 . . . . 0.0 111.918 176.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 16.6 p30 -83.93 -10.02 58.27 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 179.033 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.584 0 C-N-CA 124.947 1.299 . . . . 0.0 113.619 -178.664 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.523 0 CA-C-O 121.35 0.416 . . . . 0.0 113.986 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.4 p -75.48 -17.06 60.23 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 22.3 p80 -146.28 168.36 21.27 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.3 1.84 . . . . 0.0 111.668 179.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 26.7 ptt? -104.92 155.95 18.47 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.053 1.341 . . . . 0.0 112.415 178.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -88.99 -4.17 58.51 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.442 1.097 . . . . 0.0 113.431 177.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -43.97 -45.38 18.99 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 115.054 1.501 . . . . 0.0 115.054 -178.193 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -60.38 -15.03 33.05 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 123.296 2.664 . . . . 0.0 115.076 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -113.32 -25.81 8.66 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.434 1.893 . . . . 0.0 112.966 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 89.5 p -106.77 -14.12 15.08 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 -177.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 9.9 t70 -111.52 121.83 39.05 Favored Pre-proline 0 CA--C 1.554 1.111 0 CA-C-N 120.227 1.376 . . . . 0.0 112.742 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -64.49 -14.4 44.1 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 123.575 2.85 . . . . 0.0 115.489 -177.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 7.4 t -74.62 -19.76 60.17 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.173 0.897 . . . . 0.0 112.624 177.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 7.6 p -123.8 -23.08 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 125.282 1.433 . . . . 0.0 114.028 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -55.32 122.51 44.03 Favored Pre-proline 0 CA--C 1.552 1.057 0 CA-C-N 119.599 1.091 . . . . 0.0 112.126 176.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 7.0 Cg_endo -107.11 67.05 0.01 OUTLIER 'Trans proline' 0 CA--C 1.559 1.75 1 C-N-CA 125.302 4.001 . . . . 0.0 113.744 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -70.0 165.17 32.12 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.129 2.553 . . . . 0.0 113.827 -178.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 6.2 tt -67.58 147.14 53.15 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.863 1.265 . . . . 0.0 111.809 177.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 34.1 t -110.75 160.2 16.94 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.246 1.818 . . . . 0.0 112.045 178.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -60.72 -26.41 67.15 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.029 -1.044 . . . . 0.0 113.372 178.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -83.9 -14.14 51.8 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.489 0.716 . . . . 0.0 112.807 177.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 34.5 m -61.08 -51.9 67.19 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.801 0.728 . . . . 0.0 110.575 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -60.02 -27.37 66.84 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 177.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 67.0 m -74.53 -34.49 63.01 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 178.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.7 t70 -90.25 -27.43 19.49 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.426 1.09 . . . . 0.0 113.229 176.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -42.9 -54.38 4.22 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.731 2.412 . . . . 0.0 112.966 -178.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 42.1 p-90 -75.3 -4.84 41.5 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -175.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 87.1 mttt -107.91 -60.32 1.73 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -177.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 26.0 mt -120.14 12.14 11.79 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -169.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.5 tt -51.96 136.07 37.51 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 125.191 1.396 . . . . 0.0 114.028 -176.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -77.47 158.83 32.62 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.915 3.077 . . . . 0.0 112.325 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -76.15 10.06 2.17 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 116.201 1.926 . . . . 0.0 116.201 -178.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 46.9 p-10 -116.19 16.69 15.88 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.869 1.668 . . . . 0.0 114.13 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -65.58 151.51 46.3 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 123.865 0.866 . . . . 0.0 112.537 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 34.5 m -115.42 -1.14 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 115.974 1.842 . . . . 0.0 115.974 -176.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 50.8 tp -77.27 -11.37 59.82 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -179.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 19.8 m -35.08 100.04 0.18 Allowed Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 128.672 2.789 . . . . 0.0 115.62 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -66.58 126.53 15.63 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.473 2.782 . . . . 0.0 111.074 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 75.3 mt -92.15 142.57 26.39 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 123.456 0.703 . . . . 0.0 111.779 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -56.0 -22.16 37.54 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.516 2.811 . . . . 0.0 114.93 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 43.3 p -73.24 -17.48 61.34 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.559 1.544 . . . . 0.0 113.837 177.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -127.31 -23.41 3.54 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.183 1.393 . . . . 0.0 114.318 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -71.73 137.07 47.46 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.228 1.011 . . . . 0.0 111.564 178.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.84 47.43 0.63 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.801 1.64 . . . . 0.0 113.603 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 37.6 t70 -66.13 -18.63 65.47 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.096 1.358 . . . . 0.0 112.722 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -62.32 -21.22 65.1 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.893 1.277 . . . . 0.0 113.458 177.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 86.5 mt -89.8 16.77 7.48 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.464 1.906 . . . . 0.0 112.861 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.27 152.75 32.7 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -174.267 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 90.9 mt -125.19 179.96 4.84 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 129.209 3.004 . . . . 0.0 113.557 -177.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 88.0 p -100.11 152.58 37.87 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.85 1.66 . . . . 0.0 106.999 169.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_exo -56.48 -23.78 49.41 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.569 2.179 . . . . 0.0 114.889 -178.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.2 t70 -71.42 -29.15 64.56 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.945 0.898 . . . . 0.0 112.98 178.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 15.5 t70 -76.58 -15.0 59.96 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 93.8 mt -58.13 -35.38 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 O-C-N 121.435 -0.791 . . . . 0.0 109.947 175.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -69.14 -9.85 54.83 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.75 1.22 . . . . 0.0 113.391 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -83.73 -29.06 27.81 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.285 1.034 . . . . 0.0 111.715 177.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -96.78 -37.37 10.3 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.847 0.859 . . . . 0.0 112.498 176.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -109.52 109.66 20.53 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 105.088 -2.189 . . . . 0.0 105.088 169.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 3.1 m -75.57 140.92 42.97 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 116.202 1.926 . . . . 0.0 116.202 -170.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -120.1 143.83 47.94 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.389 2.276 . . . . 0.0 106.616 169.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -60.7 129.37 89.69 Favored Pre-proline 0 CA--C 1.552 1.042 0 O-C-N 121.009 -1.057 . . . . 0.0 113.629 -175.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -75.5 -21.19 15.2 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 123.319 2.68 . . . . 0.0 112.524 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 174.96 171.21 38.84 Favored Glycine 0 CA--C 1.54 1.604 0 C-N-CA 127.537 2.494 . . . . 0.0 110.594 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -65.15 -18.83 62.43 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.419 2.746 . . . . 0.0 113.82 -179.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -94.47 -3.32 50.22 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.829 1.652 . . . . 0.0 114.204 179.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 64.32 43.28 97.12 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 119.067 0.849 . . . . 0.0 113.681 -178.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 4.9 p -60.54 103.59 0.26 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.87 1.268 . . . . 0.0 110.873 178.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 26.9 p -68.76 158.03 35.15 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.587 1.555 . . . . 0.0 114.535 -175.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 18.7 p90 -145.53 168.38 20.74 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.874 1.67 . . . . 0.0 111.681 -175.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 58.0 m-20 -53.22 -37.25 61.85 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 120.89 -1.131 . . . . 0.0 113.069 -177.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -65.98 -8.21 40.94 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 125.332 1.444 . . . . 0.0 115.867 178.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 39.7 p -128.4 -34.02 2.08 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 118.902 1.351 . . . . 0.0 112.763 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -93.72 -36.26 12.4 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.695 1.369 . . . . 0.0 114.695 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 24.9 m -93.68 -42.64 9.06 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.93 0.892 . . . . 0.0 111.934 -178.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -131.25 82.66 0.32 Allowed Glycine 0 CA--C 1.534 1.271 0 C-N-CA 125.415 1.483 . . . . 0.0 111.004 177.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.69 159.03 18.18 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 124.512 3.475 . . . . 0.0 115.682 -177.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 38.5 p -58.85 -21.29 56.65 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.726 1.61 . . . . 0.0 114.432 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -80.15 -4.31 52.45 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.975 1.31 . . . . 0.0 114.095 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -65.63 143.9 98.75 Favored Pre-proline 0 CA--C 1.546 0.802 0 O-C-N 121.25 -0.906 . . . . 0.0 111.618 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -60.68 -33.49 93.22 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.742 2.295 . . . . 0.0 113.281 -178.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -68.37 -32.42 72.49 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.184 -0.947 . . . . 0.0 112.377 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -62.55 -37.96 88.18 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 118.793 0.724 . . . . 0.0 110.524 174.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -64.99 -39.5 93.57 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.819 0.848 . . . . 0.0 111.34 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -59.0 -41.0 86.62 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.132 0.878 . . . . 0.0 111.11 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 94.3 mt -64.84 -38.44 90.97 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.683 0.793 . . . . 0.0 111.848 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -65.5 -53.83 35.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 CA-C-N 119.066 0.848 . . . . 0.0 109.454 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -52.29 -52.06 55.05 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.184 0.994 . . . . 0.0 111.563 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -35.53 80.46 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -179.11 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 14.0 tp60 -74.21 -44.05 54.75 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.044 0.838 . . . . 0.0 110.88 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.8 tt -59.63 -46.25 89.56 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.863 1.265 . . . . 0.0 110.435 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 92.4 t -58.24 -32.13 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.008 0.822 . . . . 0.0 111.221 175.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.58 -26.15 61.6 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.827 -1.17 . . . . 0.0 113.854 175.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.8 mp -63.6 -32.59 74.11 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 120.104 1.32 . . . . 0.0 108.911 173.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 4.1 mt -69.14 -50.42 48.09 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.708 1.203 . . . . 0.0 109.564 175.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 17.9 t60 -55.79 -53.55 55.28 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 122.603 0.361 . . . . 0.0 110.365 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -58.31 -27.29 63.96 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -86.28 -28.36 23.81 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.996 0.816 . . . . 0.0 112.885 176.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 40.9 mttm -86.06 -36.21 19.81 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.017 1.327 . . . . 0.0 112.223 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 49.5 t -60.85 -48.4 82.0 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 127.067 2.147 . . . . 0.0 111.051 177.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -61.12 -34.96 75.8 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.322 -0.861 . . . . 0.0 112.335 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -72.25 -37.86 69.03 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.64 1.176 . . . . 0.0 112.069 177.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.7 -39.77 85.69 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.914 1.285 . . . . 0.0 110.78 176.202 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -68.68 -35.87 77.77 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 118.388 0.54 . . . . 0.0 111.137 175.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -66.72 -36.48 82.58 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.135 -0.978 . . . . 0.0 111.28 176.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -74.13 -27.25 60.77 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.648 1.179 . . . . 0.0 113.646 177.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 58.8 t-20 -137.54 101.06 4.38 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.538 1.135 . . . . 0.0 112.083 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . -71.82 -7.16 65.14 Favored Glycine 0 CA--C 1.54 1.599 0 N-CA-C 115.515 0.966 . . . . 0.0 115.515 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -81.43 -13.31 58.38 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 119.107 1.454 . . . . 0.0 112.796 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 26.9 m -118.15 162.19 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 126.062 1.745 . . . . 0.0 112.318 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 84.8 mtp180 -121.51 147.75 45.38 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.561 1.545 . . . . 0.0 111.413 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -65.02 165.96 10.15 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.262 1.425 . . . . 0.0 113.665 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 16.4 m -49.31 145.93 4.15 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.224 2.21 . . . . 0.0 116.409 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 67.1 m -93.5 -3.45 52.9 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.339 1.455 . . . . 0.0 111.193 171.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 41.5 tp -64.66 115.04 16.96 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 127.897 2.479 . . . . 0.0 109.238 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -59.74 -32.25 95.36 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.592 2.195 . . . . 0.0 113.841 -176.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -69.4 -37.09 77.33 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.588 -0.695 . . . . 0.0 112.578 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.7 t -67.61 -50.44 58.16 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.3 1.44 . . . . 0.0 109.258 175.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -55.49 -40.83 72.21 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.123 1.369 . . . . 0.0 111.585 174.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.3 m -64.74 -56.53 13.08 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.526 1.13 . . . . 0.0 111.044 177.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.7 mmt -64.25 -36.81 85.31 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.79 -32.08 73.41 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.909 1.686 . . . . 0.0 112.667 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -71.48 -41.4 69.37 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.165 0.586 . . . . 0.0 110.398 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 76.1 t -62.56 -48.06 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.467 0.707 . . . . 0.0 110.839 177.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.71 -44.63 90.44 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.918 0.887 . . . . 0.0 111.635 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -67.74 -17.43 64.55 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 177.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 58.2 t60 -88.75 -49.75 6.65 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.857 0.863 . . . . 0.0 109.512 173.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.2 ttp -56.77 -28.15 60.76 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.273 1.829 . . . . 0.0 113.591 -177.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.9 p -67.77 -27.7 66.99 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.569 1.148 . . . . 0.0 112.783 175.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -105.26 -17.55 14.42 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.775 1.63 . . . . 0.0 113.853 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 30.4 t -62.1 146.97 48.92 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.24 1.416 . . . . 0.0 112.218 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -116.79 -13.72 10.75 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.53 1.532 . . . . 0.0 113.881 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -94.81 -27.24 15.87 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.096 0.959 . . . . 0.0 112.373 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.34 -112.89 2.58 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.619 1.105 . . . . 0.0 113.007 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -61.78 -18.18 58.9 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 121.392 -1.064 . . . . 0.0 113.309 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.26 -0.25 44.35 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.45 1.5 . . . . 0.0 113.644 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 15.4 t -59.69 144.01 49.15 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 122.473 1.13 . . . . 0.0 110.779 179.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 56.4 mm-40 -78.52 -8.39 58.51 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.5 1.12 . . . . 0.0 113.053 -176.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 90.8 t -91.05 115.04 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 173.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.34 -36.88 66.76 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -177.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -67.49 -32.63 73.59 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.374 1.07 . . . . 0.0 112.809 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 47.9 t -74.73 -55.42 5.87 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.357 1.463 . . . . 0.0 109.72 177.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -54.91 -45.81 74.8 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.261 1.025 . . . . 0.0 112.624 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 23.8 p -63.9 -46.33 85.36 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 177.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 62.8 m -63.17 -33.22 75.01 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 118.859 0.754 . . . . 0.0 112.039 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -63.7 -30.8 71.86 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 118.168 -0.92 . . . . 0.0 112.674 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -63.98 -37.98 89.4 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.213 1.37 . . . . 0.0 110.692 173.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.9 mt -66.99 -42.49 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.205 1.002 . . . . 0.0 110.365 178.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 19.4 mm -66.09 -36.74 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 123.599 0.76 . . . . 0.0 110.911 176.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 54.1 m -66.11 -24.08 66.62 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.422 1.089 . . . . 0.0 113.251 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -62.35 -59.03 5.58 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.243 0.928 . . . . 0.0 110.852 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 56.5 m95 -60.61 -26.22 66.84 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 48.1 mttp -72.95 -33.75 66.1 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.869 0.868 . . . . 0.0 113.144 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.7 p30 -100.05 -29.56 12.45 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 6.3 t -79.05 133.92 36.78 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.439 1.096 . . . . 0.0 112.315 -178.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 74.2 p -130.12 2.14 4.74 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.658 1.583 . . . . 0.0 114.311 -178.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -78.31 155.78 29.98 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.203 1.401 . . . . 0.0 113.612 -178.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -88.56 -33.11 17.83 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.875 0.87 . . . . 0.0 110.646 171.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 19.8 t0 -103.03 80.24 1.84 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.851 2.06 . . . . 0.0 111.478 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 42.8 t -132.19 134.97 25.69 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 126.995 2.118 . . . . 0.0 107.958 177.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -59.96 -22.9 70.86 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 122.252 1.968 . . . . 0.0 113.52 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 5.0 t -92.14 -51.49 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 119.409 1.004 . . . . 0.0 111.634 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 19.6 m -65.68 -44.06 87.36 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -177.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.52 -56.4 27.27 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.149 -175.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -63.34 -30.65 73.25 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 121.789 1.675 . . . . 0.0 113.068 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 97.8 mt -69.84 -44.16 70.45 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.47 1.032 . . . . 0.0 111.288 176.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -64.74 -35.06 79.86 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.192 0.997 . . . . 0.0 111.184 175.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 57.4 t30 -68.12 -40.3 82.56 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.458 1.103 . . . . 0.0 111.065 175.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -72.76 -37.47 67.66 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.378 1.071 . . . . 0.0 112.763 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 89.7 p -87.77 31.58 0.76 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.474 1.91 . . . . 0.0 114.34 -179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 26.4 t0 -75.01 55.21 0.7 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.571 1.948 . . . . 0.0 112.669 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -71.61 43.29 0.09 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 128.15 2.58 . . . . 0.0 116.246 -176.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 48.8 mtm105 . . . . . 0 N--CA 1.477 0.917 0 C-N-CA 125.947 1.699 . . . . 0.0 111.941 178.736 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.313 0 CA-C-O 121.179 0.322 . . . . 0.0 113.859 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.7 m -57.11 -19.55 20.42 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -178.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -78.25 -14.31 59.49 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.877 1.271 . . . . 0.0 113.745 178.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 46.9 tpp -84.88 149.38 25.71 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.811 1.244 . . . . 0.0 112.306 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -79.9 169.27 18.13 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.815 1.246 . . . . 0.0 113.283 178.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -127.68 147.53 63.07 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.049 1.339 . . . . 0.0 112.204 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -71.97 152.99 57.98 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.348 2.699 . . . . 0.0 112.88 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -139.07 152.37 47.49 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.887 1.675 . . . . 0.0 110.835 178.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 56.8 m -135.8 153.01 51.65 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.163 1.385 . . . . 0.0 112.352 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 14.7 t70 -74.53 130.71 81.3 Favored Pre-proline 0 CA--C 1.553 1.089 0 C-N-CA 123.949 0.899 . . . . 0.0 111.416 178.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -82.16 -18.15 7.53 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 123.398 2.732 . . . . 0.0 115.279 -177.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 33.9 m -83.93 -31.13 25.79 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -176.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 8.4 p -76.63 147.98 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.269 1.028 . . . . 0.0 111.839 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -133.63 151.92 78.04 Favored Pre-proline 0 CA--C 1.547 0.858 0 C-N-CA 125.282 1.433 . . . . 0.0 111.102 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.32 -48.08 19.3 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.127 2.551 . . . . 0.0 116.447 -178.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -84.2 158.82 13.19 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 122.878 2.385 . . . . 0.0 112.558 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 8.9 tt -80.36 139.27 36.63 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.332 0.653 . . . . 0.0 110.548 175.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 29.2 t -121.75 161.3 22.86 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.419 1.888 . . . . 0.0 109.124 174.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 32.5 tp60 -61.68 -24.02 66.48 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.691 -1.255 . . . . 0.0 112.216 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -89.31 -6.61 56.58 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 176.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 95.9 m -58.32 -58.06 10.15 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.631 1.105 . . . . 0.0 111.07 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -60.19 -28.48 68.0 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.61 0.764 . . . . 0.0 112.924 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 42.5 m -70.19 -34.2 72.66 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.853 0.861 . . . . 0.0 112.631 178.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -90.1 -26.61 20.14 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.593 1.157 . . . . 0.0 113.365 175.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.2 tt -45.41 -60.04 2.37 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 126.913 2.085 . . . . 0.0 113.498 -176.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 40.0 p-90 -66.72 -10.52 47.71 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -173.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 9.1 ptmm? -112.12 -57.72 2.23 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 47.2 mt -116.05 13.96 15.95 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 -171.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.9 tt -55.06 135.98 67.47 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 125.701 1.6 . . . . 0.0 113.703 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.23 170.59 20.03 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.935 3.09 . . . . 0.0 113.667 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -67.42 2.17 1.87 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 -178.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 15.3 t30 -140.04 134.18 31.04 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.402 1.481 . . . . 0.0 110.444 177.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -149.72 163.56 37.62 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.017 0.927 . . . . 0.0 112.567 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 35.0 m -108.48 -17.29 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 125.481 1.513 . . . . 0.0 114.307 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.45 -1.81 56.25 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.574 1.55 . . . . 0.0 113.428 -178.203 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 15.4 m -57.88 109.87 2.11 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.391 1.877 . . . . 0.0 114.074 -177.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -67.65 134.87 34.08 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.311 2.674 . . . . 0.0 111.59 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 11.1 mp -77.85 131.13 71.11 Favored Pre-proline 0 CA--C 1.546 0.794 0 CA-C-O 118.216 -0.897 . . . . 0.0 111.661 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -54.78 -33.92 82.73 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 123.483 2.788 . . . . 0.0 114.388 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 52.6 p -71.31 -13.23 61.81 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.259 1.424 . . . . 0.0 113.962 178.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -124.69 10.11 8.36 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.763 2.025 . . . . 0.0 112.027 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.49 156.89 38.56 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -175.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.57 23.8 3.34 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 128.473 2.709 . . . . 0.0 112.949 178.251 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 35.3 t70 -60.28 -24.73 65.17 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.261 1.424 . . . . 0.0 114.414 -176.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -68.45 -16.4 63.89 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 113.674 0.991 . . . . 0.0 113.674 178.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 24.0 tp -105.45 7.73 33.23 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.939 1.696 . . . . 0.0 112.521 179.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 62.1 mmm -67.3 159.5 29.11 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.732 1.753 . . . . 0.0 115.732 -177.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 96.3 mt -125.06 170.51 11.1 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 127.666 2.386 . . . . 0.0 112.766 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 30.7 t -86.36 146.65 42.67 Favored Pre-proline 0 CA--C 1.543 0.696 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 169.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.8 Cg_exo -54.14 -21.45 22.14 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.89 2.394 . . . . 0.0 115.087 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 32.7 t70 -73.27 -22.07 60.46 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.342 1.057 . . . . 0.0 113.006 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -78.92 -17.44 55.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.062 0.945 . . . . 0.0 112.994 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.65 -34.26 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 125.134 1.374 . . . . 0.0 110.667 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -68.41 -10.03 52.43 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.702 1.201 . . . . 0.0 113.814 178.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 52.6 tp60 -82.35 -39.11 23.24 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.093 -1.004 . . . . 0.0 111.373 177.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.255 3.9 p-90 -90.9 -26.35 19.36 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -117.72 109.73 16.98 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 104.225 -2.509 . . . . 0.0 104.225 169.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.18 147.07 27.08 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -171.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 23.3 mp0 -75.9 168.36 20.17 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.772 1.229 . . . . 0.0 111.386 176.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 13.6 t70 -59.9 136.46 90.38 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 124.082 0.953 . . . . 0.0 112.631 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.01 -20.49 57.33 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.822 3.015 . . . . 0.0 115.364 -178.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 65.06 -143.62 46.68 Favored Glycine 0 CA--C 1.543 1.814 0 O-C-N 121.317 -0.865 . . . . 0.0 112.538 -178.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -78.45 -6.11 15.3 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 123.953 3.102 . . . . 0.0 115.574 -177.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -136.76 -44.65 0.59 Allowed 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -177.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 64.67 20.78 66.47 Favored Glycine 0 CA--C 1.54 1.61 0 CA-C-N 119.338 0.972 . . . . 0.0 115.326 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 20.7 m -50.71 -37.69 42.96 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 -176.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 62.2 m -57.51 -26.41 61.27 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.524 1.53 . . . . 0.0 114.433 -178.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -64.68 -23.34 67.22 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.007 0.821 . . . . 0.0 112.961 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -67.72 -28.65 67.83 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.248 -0.907 . . . . 0.0 111.461 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -73.54 -12.59 80.36 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 125.336 1.446 . . . . 0.0 114.759 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 3.7 t -124.97 4.38 8.0 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.365 1.466 . . . . 0.0 113.197 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -61.82 -21.42 64.61 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.952 1.301 . . . . 0.0 113.877 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 33.0 p -73.05 -15.26 61.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.485 1.514 . . . . 0.0 112.777 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -155.25 81.32 0.17 Allowed Glycine 0 CA--C 1.535 1.335 0 C-N-CA 125.994 1.759 . . . . 0.0 111.159 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.24 155.26 30.33 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 124.117 3.211 . . . . 0.0 113.315 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 33.1 p -49.89 -36.37 27.1 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.883 1.438 . . . . 0.0 114.883 -178.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -76.44 -4.28 41.62 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.498 1.519 . . . . 0.0 114.969 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 13.7 t70 -65.9 138.05 96.25 Favored Pre-proline 0 CA--C 1.549 0.93 0 O-C-N 121.12 -0.987 . . . . 0.0 111.219 178.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 81.3 Cg_exo -49.57 -35.23 36.71 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.546 2.83 . . . . 0.0 115.373 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -67.87 -25.3 65.45 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -90.19 -39.17 12.98 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.29 1.436 . . . . 0.0 111.232 173.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 6.9 mmp_? -58.47 -42.98 88.7 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.957 0.903 . . . . 0.0 111.544 176.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -64.43 -28.65 69.82 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 177.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 98.7 mt -69.92 -37.86 76.06 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.534 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -63.13 -52.75 55.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 174.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -52.51 -55.71 20.22 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.949 0.9 . . . . 0.0 111.412 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -34.26 77.41 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -178.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -69.47 -44.87 70.29 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.485 1.039 . . . . 0.0 110.365 177.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 5.1 tt -60.07 -43.8 95.21 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.603 1.161 . . . . 0.0 110.017 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 85.4 t -58.94 -31.43 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.1 0.864 . . . . 0.0 111.525 175.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 4.4 tp -72.26 -29.61 64.07 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.137 1.335 . . . . 0.0 112.816 175.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -60.97 -33.83 73.82 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 120.394 1.452 . . . . 0.0 109.14 174.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 7.0 mt -66.7 -51.84 51.47 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.307 1.043 . . . . 0.0 109.998 175.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 31.4 t60 -57.3 -57.35 13.0 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 119.19 -0.433 . . . . 0.0 110.291 177.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -51.79 -41.21 61.51 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.419 1.088 . . . . 0.0 113.548 -178.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -75.32 -35.99 61.13 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 36.9 mttm -73.31 -46.84 47.2 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.954 0.902 . . . . 0.0 110.844 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 35.3 t -55.79 -45.51 78.19 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 127.123 2.169 . . . . 0.0 111.151 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -52.16 -51.42 58.1 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.782 1.633 . . . . 0.0 112.659 175.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -88.55 -16.47 32.52 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 113.985 1.106 . . . . 0.0 113.985 -174.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -33.6 69.34 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 125.406 1.483 . . . . 0.0 112.161 175.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.09 -29.98 65.97 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.817 -0.552 . . . . 0.0 111.687 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -61.68 -27.6 68.8 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.005 0.922 . . . . 0.0 112.534 179.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -78.39 -9.94 59.49 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.835 1.254 . . . . 0.0 114.112 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -124.74 -50.92 1.71 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.582 1.153 . . . . 0.0 114.075 -177.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 75.16 3.22 68.89 Favored Glycine 0 CA--C 1.54 1.641 0 N-CA-C 117.088 1.595 . . . . 0.0 117.088 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -125.64 -32.49 2.86 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.012 1.906 . . . . 0.0 114.271 -178.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 27.3 m -70.47 153.83 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 O-C-N 121.215 -0.928 . . . . 0.0 112.217 179.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -82.97 158.0 22.75 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.355 1.062 . . . . 0.0 112.212 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -76.95 174.7 10.3 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.784 1.234 . . . . 0.0 113.567 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -62.9 160.81 13.96 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.409 1.884 . . . . 0.0 114.936 -177.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 62.5 m -105.5 -7.05 18.89 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.711 1.604 . . . . 0.0 113.704 178.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 4.4 mp -77.74 130.53 73.21 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 119.046 0.839 . . . . 0.0 112.207 -179.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -68.51 -37.05 13.71 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.563 2.175 . . . . 0.0 111.341 178.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 37.7 m80 -71.23 -31.09 67.14 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.949 0.9 . . . . 0.0 112.745 178.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.5 t -66.42 -51.84 52.7 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.806 1.243 . . . . 0.0 109.019 175.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -55.87 -38.86 70.69 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.806 1.242 . . . . 0.0 111.367 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 33.1 m -66.16 -57.14 8.29 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.959 0.904 . . . . 0.0 111.538 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.2 mmt -64.35 -36.33 83.79 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -177.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -64.71 -28.9 69.91 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 120.738 1.608 . . . . 0.0 112.773 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -74.06 -39.74 63.27 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.129 0.572 . . . . 0.0 110.449 173.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 92.8 t -63.01 -44.84 99.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 121.753 -0.592 . . . . 0.0 110.744 176.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.54 -44.8 95.71 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.957 0.903 . . . . 0.0 110.576 177.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -63.52 -31.4 72.55 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.127 0.876 . . . . 0.0 113.202 175.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 74.5 t60 -74.73 -50.64 16.74 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.324 -0.86 . . . . 0.0 109.303 175.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.7 ttp -58.65 -30.95 67.71 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.32 1.848 . . . . 0.0 114.127 -177.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 25.0 p -70.22 -27.85 64.81 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 119.958 1.254 . . . . 0.0 112.307 174.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 78.6 t60 -96.83 -24.02 16.1 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.032 1.733 . . . . 0.0 113.556 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 20.0 t -60.06 148.68 34.87 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.373 1.469 . . . . 0.0 113.182 -177.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -113.87 -14.59 12.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.303 1.841 . . . . 0.0 113.503 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -103.9 -31.98 9.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.453 1.101 . . . . 0.0 112.536 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.55 -107.78 0.58 Allowed Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.559 1.076 . . . . 0.0 113.601 177.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 64.6 tttp -59.29 -25.51 64.17 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.034 -1.274 . . . . 0.0 112.48 177.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -94.97 -0.23 54.05 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.453 1.501 . . . . 0.0 113.833 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.1 t -61.71 143.64 55.87 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 122.407 1.099 . . . . 0.0 110.581 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.8 mm-40 -80.15 -6.14 57.24 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.513 1.125 . . . . 0.0 113.373 -176.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 16.8 t -92.82 124.53 45.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.748 1.219 . . . . 0.0 108.653 175.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.59 -46.25 70.3 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -176.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.56 -31.88 71.4 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 -178.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 51.2 t -67.65 -57.48 6.32 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.914 0.886 . . . . 0.0 109.859 178.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -61.76 -15.53 41.93 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.7 m -89.05 -55.61 3.61 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.341 1.057 . . . . 0.0 112.121 176.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.2 m -61.34 -31.98 71.86 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.478 1.036 . . . . 0.0 111.989 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -61.43 -32.75 72.72 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.548 -0.72 . . . . 0.0 111.987 175.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -66.26 -32.28 73.6 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.503 1.047 . . . . 0.0 111.481 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 12.3 mt -71.18 -46.83 64.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.252 1.021 . . . . 0.0 109.675 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 23.2 mm -60.87 -44.06 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 123.942 0.897 . . . . 0.0 110.687 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 44.9 m -57.56 -22.44 44.69 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 178.065 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.0 t60 -63.31 -53.06 58.71 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.636 1.107 . . . . 0.0 110.277 176.338 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 64.6 m95 -65.05 -27.91 69.12 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -68.72 -33.02 73.22 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.579 0.752 . . . . 0.0 112.31 175.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -100.04 -35.64 9.63 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 -177.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.2 t -80.53 137.18 36.4 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.352 1.461 . . . . 0.0 112.555 -176.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 22.1 m -129.99 -19.77 3.19 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.476 1.511 . . . . 0.0 113.274 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -68.39 140.78 55.84 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.514 1.525 . . . . 0.0 112.048 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -77.81 -38.11 47.16 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.222 0.609 . . . . 0.0 112.387 177.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 24.0 t70 -86.98 69.95 10.28 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.055 1.742 . . . . 0.0 111.745 179.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.8 t -124.17 135.22 26.14 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 126.543 1.937 . . . . 0.0 109.763 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -58.89 -25.47 77.11 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.964 2.443 . . . . 0.0 114.405 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.5 t -92.21 -51.16 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 119.748 1.158 . . . . 0.0 111.726 176.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.8 m -69.6 -39.64 77.14 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -175.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.5 tt -56.44 -55.65 40.31 Favored Pre-proline 0 CA--C 1.547 0.852 0 O-C-N 120.893 -1.129 . . . . 0.0 112.76 -178.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -61.44 -28.79 84.24 Favored 'Trans proline' 0 C--N 1.353 0.765 0 CA-C-N 121.609 1.61 . . . . 0.0 113.264 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 91.2 mt -70.15 -45.53 66.59 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.807 1.185 . . . . 0.0 111.401 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -63.84 -33.27 75.32 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.191 0.597 . . . . 0.0 111.229 176.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 59.1 t30 -72.81 -40.63 65.67 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.79 1.236 . . . . 0.0 111.833 176.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -73.68 -27.03 61.01 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.044 1.338 . . . . 0.0 113.892 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 47.8 t -58.53 134.02 56.34 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.113 0.965 . . . . 0.0 112.993 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 24.6 t70 -77.24 -2.76 36.31 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.63 1.172 . . . . 0.0 113.521 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 62.2 mttm -70.93 -0.65 9.7 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.257 1.423 . . . . 0.0 114.756 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 72.2 mtm-85 . . . . . 0 N--CA 1.479 1.006 0 C-N-CA 127.595 2.358 . . . . 0.0 110.973 176.666 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.392 0 N-CA-C 114.804 0.682 . . . . 0.0 114.804 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.1 p -85.54 -5.33 59.29 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.857 1.663 . . . . 0.0 114.223 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -64.06 147.95 50.94 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.729 1.612 . . . . 0.0 113.104 -179.027 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 56.8 ttm -76.04 145.89 39.85 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.471 1.108 . . . . 0.0 111.718 178.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -73.54 155.43 39.17 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.991 0.916 . . . . 0.0 113.279 178.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -146.67 -43.33 0.01 OUTLIER Pre-proline 0 CA--C 1.551 1.005 0 N-CA-C 114.841 1.423 . . . . 0.0 114.841 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -56.68 143.1 90.64 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 122.95 2.434 . . . . 0.0 114.667 -178.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -115.9 158.59 22.76 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.88 1.672 . . . . 0.0 111.523 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 22.6 p -72.15 -53.96 11.13 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.069 0.947 . . . . 0.0 112.327 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 39.8 t0 -157.63 122.09 2.27 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 125.617 1.567 . . . . 0.0 110.294 177.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.75 -26.35 79.63 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 123.269 2.646 . . . . 0.0 115.177 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 66.4 m -137.2 100.77 4.35 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.563 1.545 . . . . 0.0 110.585 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 24.6 m -80.65 -28.93 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -178.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -137.74 60.87 26.81 Favored Pre-proline 0 CA--C 1.553 1.09 0 C-N-CA 124.658 1.183 . . . . 0.0 112.587 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.31 -29.23 38.82 Favored 'Trans proline' 0 CA--C 1.553 1.451 0 C-N-CA 122.691 2.26 . . . . 0.0 117.501 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -80.48 157.45 22.19 Favored 'Trans proline' 0 C--N 1.358 1.052 0 CA-C-N 123.957 2.449 . . . . 0.0 113.132 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 8.1 tt -83.27 136.01 34.54 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.276 1.03 . . . . 0.0 111.18 177.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 41.9 t -90.38 144.43 25.83 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.465 1.106 . . . . 0.0 110.957 176.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -58.0 -24.4 58.03 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.842 0.857 . . . . 0.0 113.247 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -64.26 -23.13 67.19 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.024 0.93 . . . . 0.0 111.964 176.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 20.9 m -66.75 -60.18 2.91 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.746 0.819 . . . . 0.0 109.909 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -60.26 -31.37 70.15 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.772 0.829 . . . . 0.0 112.738 174.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 54.0 m -69.45 -32.8 71.96 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.1 t70 -90.08 -29.52 18.29 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.74 1.216 . . . . 0.0 113.058 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -45.2 -58.14 3.46 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.843 2.057 . . . . 0.0 113.508 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -69.99 -9.76 56.29 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -112.06 -51.78 2.83 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 116.835 2.161 . . . . 0.0 116.835 -176.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 55.4 mt -117.04 20.19 13.92 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -170.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 7.5 tp -51.6 136.01 34.01 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.911 1.685 . . . . 0.0 115.012 -174.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -69.72 163.92 36.45 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.472 2.781 . . . . 0.0 111.498 175.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -69.77 -11.27 60.73 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.971 1.841 . . . . 0.0 115.971 -177.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 27.4 m120 -128.81 119.09 23.88 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.57 1.148 . . . . 0.0 111.1 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -158.31 150.26 21.61 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.273 1.429 . . . . 0.0 111.096 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 34.0 m -133.54 20.95 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 125.096 1.359 . . . . 0.0 114.334 -178.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 4.3 tt -66.56 -47.33 73.16 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.713 1.205 . . . . 0.0 112.704 -178.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 29.1 p -74.56 152.66 87.5 Favored Pre-proline 0 N--CA 1.473 0.704 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -177.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -70.88 149.25 59.41 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.247 2.631 . . . . 0.0 112.051 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 90.1 mt -79.21 157.12 76.01 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 124.599 1.159 . . . . 0.0 110.688 176.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -53.43 -29.1 47.28 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.543 2.829 . . . . 0.0 115.278 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 51.3 p -72.15 -14.06 61.72 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.329 1.452 . . . . 0.0 114.21 177.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -134.95 15.35 3.57 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.213 1.805 . . . . 0.0 113.447 -179.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.33 160.99 31.46 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.727 1.211 . . . . 0.0 113.149 -179.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 71.7 mtm -90.92 31.85 1.04 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.173 1.389 . . . . 0.0 113.076 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -64.98 -17.62 64.57 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -178.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -66.63 -17.77 65.01 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 121.385 -0.822 . . . . 0.0 112.106 174.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 83.7 mt -111.32 11.43 21.63 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.992 2.117 . . . . 0.0 112.338 178.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 5.6 tpt -62.98 135.41 57.28 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -173.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.5 tt -124.99 144.88 50.15 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.391 2.276 . . . . 0.0 111.379 -177.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 52.2 m -73.24 151.53 90.08 Favored Pre-proline 0 N--CA 1.475 0.811 0 C-N-CA 124.946 1.299 . . . . 0.0 113.141 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -60.78 -23.92 77.65 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.574 2.849 . . . . 0.0 115.252 -177.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -78.71 -23.76 45.33 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.47 -0.769 . . . . 0.0 112.315 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -83.48 -9.86 58.71 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.61 1.564 . . . . 0.0 112.526 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 89.2 mt -57.87 -32.16 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 119.131 0.878 . . . . 0.0 109.46 173.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -69.74 -9.92 56.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.372 1.069 . . . . 0.0 113.476 177.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -77.89 -28.78 49.98 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.109 0.964 . . . . 0.0 111.7 177.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.4 p-90 -102.06 -35.54 8.9 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.068 0.947 . . . . 0.0 112.853 177.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 16.8 m-30 -111.13 109.6 19.74 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 169.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 6.7 t -125.26 168.45 13.47 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.19 1.396 . . . . 0.0 113.583 179.184 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -97.22 176.54 5.88 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.375 1.87 . . . . 0.0 111.794 176.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 10.3 t70 -65.68 124.57 87.76 Favored Pre-proline 0 CA--C 1.555 1.136 0 O-C-N 120.765 -1.209 . . . . 0.0 110.284 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -77.87 -11.16 16.75 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.327 2.685 . . . . 0.0 115.473 -175.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 55.54 -123.54 30.56 Favored Glycine 0 CA--C 1.543 1.791 0 CA-C-O 118.943 -0.921 . . . . 0.0 112.825 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -68.27 -16.67 44.31 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.37 2.714 . . . . 0.0 113.901 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 29.3 t70 -87.74 4.39 44.38 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.781 1.232 . . . . 0.0 112.978 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -61.14 -12.59 31.23 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 125.383 1.468 . . . . 0.0 116.471 -178.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 25.4 p -62.53 -27.09 68.92 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.183 1.492 . . . . 0.0 113.684 178.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 90.3 m -91.47 -2.99 57.06 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.293 1.437 . . . . 0.0 113.408 177.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -96.85 125.32 41.21 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -176.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 55.5 t-20 -148.42 -103.03 0.08 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.575 1.95 . . . . 0.0 108.441 177.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -66.5 -15.23 63.55 Favored Glycine 0 CA--C 1.542 1.751 0 CA-C-N 119.482 1.037 . . . . 0.0 112.768 173.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 1.8 p -75.38 -10.78 59.76 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 129.292 3.037 . . . . 0.0 113.387 175.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -96.44 150.81 20.18 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.094 1.358 . . . . 0.0 112.007 178.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 29.3 m -74.39 132.92 42.42 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.891 0.877 . . . . 0.0 111.039 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 143.81 -56.34 0.55 Allowed Glycine 0 CA--C 1.539 1.582 0 CA-C-O 118.448 -1.196 . . . . 0.0 115.043 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -56.48 136.47 75.96 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.881 3.054 . . . . 0.0 114.894 -177.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 41.9 p -105.85 -5.85 19.43 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.945 1.698 . . . . 0.0 113.767 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -74.46 -9.48 58.62 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.6 1.334 . . . . 0.0 114.6 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 10.3 t70 -100.6 109.88 58.75 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.944 1.298 . . . . 0.0 111.657 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.75 -28.32 9.76 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.029 2.486 . . . . 0.0 113.685 -179.302 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -62.91 -47.92 81.18 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.794 0.838 . . . . 0.0 111.142 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -58.13 -47.59 82.82 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.401 -0.812 . . . . 0.0 110.476 176.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 27.3 ttp-105 -57.04 -51.29 69.84 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.535 1.134 . . . . 0.0 112.509 178.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -67.41 -29.69 69.26 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.112 0.869 . . . . 0.0 112.766 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 60.4 mt -66.37 -42.13 88.46 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.941 0.791 . . . . 0.0 111.192 174.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.4 mt -64.22 -51.23 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.527 1.058 . . . . 0.0 109.569 175.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -53.88 -52.13 61.45 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.533 0.733 . . . . 0.0 111.558 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -37.05 85.68 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.176 0.898 . . . . 0.0 113.099 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 16.1 tp60 -69.82 -44.08 70.69 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.794 0.724 . . . . 0.0 111.045 178.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.0 tt -63.45 -41.91 98.64 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.471 0.709 . . . . 0.0 110.231 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 94.5 t -59.8 -32.21 49.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 119.398 0.999 . . . . 0.0 111.15 174.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 1.6 tp -71.2 -26.31 62.9 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.913 -1.117 . . . . 0.0 112.995 175.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.33 -29.13 70.22 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 120.597 1.544 . . . . 0.0 109.612 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.3 mt -73.37 -53.63 10.28 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.734 1.213 . . . . 0.0 108.906 175.107 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 15.4 t60 -54.98 -56.06 23.95 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 122.887 0.475 . . . . 0.0 110.792 177.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -55.99 -23.49 32.9 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -90.07 -33.6 16.24 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.144 -0.972 . . . . 0.0 113.112 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 42.4 mttm -82.34 -31.13 30.02 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.441 1.497 . . . . 0.0 112.693 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.1 t -68.98 -51.91 34.52 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.227 2.211 . . . . 0.0 111.488 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -54.45 -30.85 54.09 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 121.062 -1.024 . . . . 0.0 113.405 178.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -67.09 -24.02 65.9 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.821 1.248 . . . . 0.0 113.08 177.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -36.42 84.16 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.771 1.169 . . . . 0.0 112.109 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -78.15 -35.01 49.43 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.444 1.098 . . . . 0.0 110.965 177.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 15.6 tp60 -66.73 -36.21 81.92 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.491 -0.755 . . . . 0.0 110.96 175.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -78.91 -24.7 43.91 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.651 1.18 . . . . 0.0 113.443 178.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 60.2 t-20 -144.47 108.13 4.66 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.512 1.125 . . . . 0.0 112.605 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . -72.33 -9.19 72.41 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 115.433 0.933 . . . . 0.0 115.433 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -81.17 -13.24 58.82 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.061 1.431 . . . . 0.0 112.869 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 30.5 m -126.26 165.66 23.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 126.233 1.813 . . . . 0.0 112.006 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -119.29 158.53 25.88 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.966 1.707 . . . . 0.0 111.999 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -80.31 178.01 8.58 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.736 1.214 . . . . 0.0 111.667 176.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 2.2 m -51.91 146.09 8.91 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 116.328 1.973 . . . . 0.0 116.328 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 68.7 p -97.68 -4.63 36.93 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.677 1.991 . . . . 0.0 111.197 170.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 3.4 tt -59.77 115.8 14.27 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 128.393 2.677 . . . . 0.0 108.67 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -51.03 -43.44 47.93 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.678 2.918 . . . . 0.0 116.054 -174.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 75.7 m80 -73.68 -29.36 62.26 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.9 t -68.03 -50.23 56.65 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 174.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -56.06 -37.2 68.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.577 1.551 . . . . 0.0 111.563 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 24.1 m -68.26 -58.18 4.82 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.511 1.124 . . . . 0.0 111.296 176.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -39.14 91.09 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.564 -0.732 . . . . 0.0 112.729 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -63.27 -33.77 76.22 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.483 1.492 . . . . 0.0 112.956 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -70.83 -41.06 72.01 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.118 0.567 . . . . 0.0 110.582 174.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 70.1 t -63.84 -47.28 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.381 0.672 . . . . 0.0 110.989 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.58 -43.99 89.65 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.998 0.919 . . . . 0.0 111.237 179.034 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -68.39 -17.07 64.14 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 176.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 56.6 t60 -89.99 -48.33 7.28 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.916 0.886 . . . . 0.0 109.963 174.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.7 ttp -56.41 -27.77 57.46 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.377 1.871 . . . . 0.0 113.392 -178.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 12.4 p -69.53 -24.27 63.71 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.976 1.31 . . . . 0.0 113.037 175.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 66.0 m80 -108.96 -17.77 13.84 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.261 1.824 . . . . 0.0 114.093 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.9 t -61.19 149.05 38.74 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.542 1.537 . . . . 0.0 112.72 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -118.38 -15.15 9.72 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.891 1.676 . . . . 0.0 113.747 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -98.8 -28.89 13.28 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.325 1.05 . . . . 0.0 112.802 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.13 -111.24 1.89 Allowed Glycine 0 CA--C 1.536 1.376 0 C-N-CA 124.336 0.969 . . . . 0.0 113.112 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.7 mttt -61.28 -20.82 63.32 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 121.22 -1.164 . . . . 0.0 113.226 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.95 -0.6 50.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.637 1.575 . . . . 0.0 113.537 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.5 t -63.95 141.53 58.73 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.114 0.959 . . . . 0.0 109.935 177.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -80.33 -5.14 55.86 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.208 1.003 . . . . 0.0 113.675 -175.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 84.1 t -89.21 112.98 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 172.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.55 -38.76 64.14 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -69.31 -30.98 69.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.481 1.113 . . . . 0.0 113.423 -178.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 41.5 t -73.1 -54.82 7.54 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.135 1.374 . . . . 0.0 108.997 176.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.83 -25.59 65.11 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 90.1 p -82.24 -48.88 10.73 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.386 0.993 . . . . 0.0 112.151 175.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 69.8 m -61.59 -33.59 74.14 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.372 -0.83 . . . . 0.0 112.259 178.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 43.9 tpt85 -61.63 -29.99 70.41 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.486 -0.759 . . . . 0.0 112.934 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -71.0 -32.61 69.47 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.019 0.927 . . . . 0.0 111.212 176.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 27.9 mt -70.78 -44.76 75.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 124.156 0.982 . . . . 0.0 109.227 176.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 22.7 mm -61.79 -36.71 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.984 0.914 . . . . 0.0 110.947 174.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 61.0 m -63.02 -23.56 67.51 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.676 0.79 . . . . 0.0 113.121 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 6.8 t60 -63.63 -58.35 7.2 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.331 0.969 . . . . 0.0 110.694 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 56.2 m95 -61.69 -23.19 65.94 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 177.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 94.4 mttt -76.49 -35.57 58.31 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.937 0.895 . . . . 0.0 112.768 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -100.03 -30.31 12.04 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 179.014 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.6 t -76.14 136.52 39.81 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.099 1.359 . . . . 0.0 111.469 -179.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.8 p -127.72 -6.98 5.64 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -176.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 -81.76 147.22 29.55 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.353 1.061 . . . . 0.0 113.335 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.7 p-80 -81.67 -27.8 33.86 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.738 0.815 . . . . 0.0 110.534 171.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 16.1 p-10 -98.69 69.93 1.88 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.487 2.315 . . . . 0.0 111.94 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 54.0 t -127.14 134.71 26.43 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 126.533 1.933 . . . . 0.0 109.248 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -57.0 -26.97 71.3 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 123.099 2.533 . . . . 0.0 114.551 -178.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 8.1 t -92.14 -52.96 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-N 119.441 1.019 . . . . 0.0 111.59 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.4 m -67.22 -39.11 86.22 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -174.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.1 tt -54.24 -57.79 16.71 Favored Pre-proline 0 CA--C 1.547 0.844 0 CA-C-O 117.804 -1.093 . . . . 0.0 113.209 -177.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.53 -31.25 92.14 Favored 'Trans proline' 0 C--N 1.352 0.736 0 CA-C-N 121.644 1.623 . . . . 0.0 113.041 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.13 -49.87 46.33 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.01 0.924 . . . . 0.0 112.44 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -65.52 -28.92 69.52 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.108 0.867 . . . . 0.0 111.862 176.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 9.4 t30 -71.87 -43.1 66.02 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.71 1.204 . . . . 0.0 111.949 175.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -76.89 -28.08 55.22 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -179.008 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 47.5 t -58.7 139.93 55.43 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 -175.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 36.9 t70 -76.61 -13.87 60.03 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.849 1.259 . . . . 0.0 111.843 174.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.06 -1.41 57.86 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.508 1.523 . . . . 0.0 112.976 177.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 . . . . . 0 N--CA 1.477 0.899 0 C-N-CA 126.612 1.965 . . . . 0.0 111.862 178.366 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.381 0 N-CA-C 114.709 0.643 . . . . 0.0 114.709 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.0 m -58.28 -19.52 35.12 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.884 1.674 . . . . 0.0 114.848 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 41.1 m80 -80.43 -10.64 59.74 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.085 1.354 . . . . 0.0 113.972 178.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 50.7 tpp -72.78 142.77 48.09 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.341 1.056 . . . . 0.0 112.097 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -148.93 139.07 22.24 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.162 1.385 . . . . 0.0 110.757 178.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -152.8 153.07 29.6 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.575 1.55 . . . . 0.0 110.87 178.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -58.05 129.17 31.79 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.017 2.478 . . . . 0.0 114.168 -178.195 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -128.22 1.3 5.78 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.797 1.639 . . . . 0.0 114.045 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 61.6 p -97.05 -0.34 47.38 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.976 1.71 . . . . 0.0 114.725 -178.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 15.9 t70 -66.91 126.39 92.36 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 124.319 1.047 . . . . 0.0 112.535 -179.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -86.23 -16.22 4.17 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.542 2.828 . . . . 0.0 114.846 -178.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 27.6 m -83.72 -26.01 30.12 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 -175.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 10.2 p -71.06 145.92 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 124.324 1.05 . . . . 0.0 112.193 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -134.93 153.83 78.85 Favored Pre-proline 0 CA--C 1.549 0.904 0 C-N-CA 125.443 1.497 . . . . 0.0 111.644 179.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -58.5 -44.52 36.81 Favored 'Trans proline' 0 CA--C 1.547 1.162 0 C-N-CA 123.503 2.802 . . . . 0.0 118.193 -177.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -81.11 163.27 20.18 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.897 2.398 . . . . 0.0 114.619 -176.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 8.0 tt -74.91 144.23 43.39 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.76 1.224 . . . . 0.0 111.284 176.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 39.4 t -99.93 146.54 26.56 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.254 1.422 . . . . 0.0 112.247 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 9.1 pm0 -59.43 -24.36 63.43 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -63.06 -27.1 69.17 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.556 -0.715 . . . . 0.0 112.065 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 90.8 m -67.83 -60.0 2.86 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.357 1.063 . . . . 0.0 110.122 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.19 -30.88 69.64 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 175.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 22.9 t -70.13 -33.65 72.09 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.5 t70 -90.15 -26.13 20.33 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.849 -1.157 . . . . 0.0 113.437 174.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -42.63 -58.02 2.47 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.891 2.076 . . . . 0.0 113.106 -179.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 45.3 p-90 -70.52 -11.91 61.23 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -172.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 50.4 pttt -112.03 -60.27 1.88 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -177.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 58.2 mt -120.21 18.59 12.28 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 116.65 2.092 . . . . 0.0 116.65 -172.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 5.4 tt -52.58 133.67 45.12 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 125.266 1.426 . . . . 0.0 113.595 -178.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.26 163.22 38.7 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 124.357 3.371 . . . . 0.0 114.209 -177.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 30.7 mp0 -59.67 -15.99 23.34 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 126.026 1.731 . . . . 0.0 115.203 -177.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 55.2 t30 -134.82 138.19 44.02 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.441 1.496 . . . . 0.0 110.844 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -150.34 151.42 32.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.56 1.544 . . . . 0.0 110.571 178.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 8.8 p -67.98 -29.24 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 55.5 tp -92.0 110.1 21.45 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.324 1.05 . . . . 0.0 111.012 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 22.7 t -115.23 99.82 52.84 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 124.076 0.95 . . . . 0.0 110.103 172.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -83.94 105.02 1.12 Allowed 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.507 2.805 . . . . 0.0 111.06 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 82.4 mt -75.05 152.92 86.54 Favored Pre-proline 0 CA--C 1.546 0.811 0 O-C-N 121.415 -0.803 . . . . 0.0 112.275 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.75 -28.87 68.88 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 123.225 2.617 . . . . 0.0 114.172 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 40.2 p -75.19 -22.06 58.27 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.647 1.579 . . . . 0.0 113.228 176.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -95.01 -29.76 14.45 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.283 1.833 . . . . 0.0 111.538 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -64.95 155.06 35.71 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.333 1.453 . . . . 0.0 112.754 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 65.5 mtm -90.15 28.49 1.4 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.559 1.543 . . . . 0.0 113.744 -178.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 35.1 t70 -56.71 -22.06 32.38 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -178.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.1 t70 -63.77 -18.01 63.63 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 121.126 -0.984 . . . . 0.0 112.88 176.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 22.7 tp -111.07 12.43 22.0 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 127.077 2.151 . . . . 0.0 111.923 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 7.7 tpt -71.95 154.65 41.06 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -176.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 25.7 mt -124.26 169.81 11.39 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.503 2.321 . . . . 0.0 112.546 -176.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.2 m -76.92 151.44 82.06 Favored Pre-proline 0 CA--C 1.544 0.729 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 169.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -60.07 -14.59 29.13 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 123.086 2.524 . . . . 0.0 115.264 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.0 t70 -78.96 -19.17 52.36 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 120.916 -1.115 . . . . 0.0 112.978 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -81.65 -13.31 58.08 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.356 1.062 . . . . 0.0 113.081 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 91.3 mt -54.84 -36.93 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.471 1.509 . . . . 0.0 111.495 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -76.1 -9.91 59.0 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -84.53 -25.09 29.01 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.138 0.975 . . . . 0.0 113.526 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -72.27 -44.19 63.17 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.556 1.071 . . . . 0.0 112.301 -178.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -80.2 109.83 15.04 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 178.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 1.2 m -74.86 137.31 41.71 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.068 0.947 . . . . 0.0 113.053 -174.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -79.4 163.76 24.56 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.048 1.339 . . . . 0.0 112.338 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -68.78 145.89 97.16 Favored Pre-proline 0 CA--C 1.551 0.986 0 O-C-N 121.363 -0.836 . . . . 0.0 112.467 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -72.16 -24.28 20.33 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.116 2.544 . . . . 0.0 114.06 -179.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 70.43 -124.2 12.76 Favored Glycine 0 CA--C 1.544 1.849 0 CA-C-O 118.55 -1.139 . . . . 0.0 111.83 -178.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -72.28 -24.17 20.06 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.152 2.568 . . . . 0.0 115.265 -177.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 4.2 p30 -154.36 147.33 24.54 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.776 1.171 . . . . 0.0 113.416 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -83.99 15.42 38.19 Favored Glycine 0 CA--C 1.532 1.146 0 N-CA-C 116.747 1.459 . . . . 0.0 116.747 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 63.2 m -67.18 111.16 3.78 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 119.756 1.778 . . . . 0.0 109.317 177.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 20.0 p -72.07 160.44 32.48 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.018 1.727 . . . . 0.0 114.252 -175.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 29.5 p90 -147.35 -177.63 5.8 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.959 1.703 . . . . 0.0 112.327 -173.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 9.5 t30 -52.93 125.73 18.05 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 120.868 -1.145 . . . . 0.0 111.648 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . 94.95 -40.97 2.59 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.365 1.459 . . . . 0.0 113.072 -177.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 78.5 p -85.69 -47.25 9.96 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 118.994 1.397 . . . . 0.0 111.408 178.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -64.4 -29.02 70.09 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.603 1.161 . . . . 0.0 110.857 173.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 3.5 m -68.46 -20.67 64.63 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 126.736 2.014 . . . . 0.0 112.374 178.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 175.82 95.32 0.1 OUTLIER Glycine 0 CA--C 1.537 1.426 0 CA-C-O 118.464 -1.187 . . . . 0.0 114.01 178.323 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -63.62 179.21 1.03 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 124.076 3.184 . . . . 0.0 113.323 176.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 35.1 p -56.33 -26.41 52.3 Favored 'General case' 0 N--CA 1.482 1.172 0 O-C-N 120.768 -1.208 . . . . 0.0 114.171 178.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -90.66 -0.36 57.66 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.417 1.487 . . . . 0.0 114.28 178.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.22 125.01 91.9 Favored Pre-proline 0 CA--C 1.55 0.944 0 O-C-N 120.868 -1.145 . . . . 0.0 112.061 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.02 -34.78 13.08 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.753 2.302 . . . . 0.0 113.779 -177.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -67.53 -37.88 83.38 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 120.933 -1.104 . . . . 0.0 111.337 179.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -59.12 -39.27 81.78 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.256 -0.902 . . . . 0.0 110.697 174.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -42.37 93.79 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.783 0.833 . . . . 0.0 111.136 174.573 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -58.84 -40.36 83.99 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.037 0.835 . . . . 0.0 111.289 174.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.8 -36.68 83.94 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 118.395 -0.812 . . . . 0.0 111.676 177.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -67.36 -55.14 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 119.216 0.916 . . . . 0.0 109.479 174.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -49.68 -52.33 31.85 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.687 1.195 . . . . 0.0 111.51 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 4.0 pp0? -65.22 -36.77 85.18 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 112.924 0.712 . . . . 0.0 112.924 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -69.69 -46.0 67.03 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.061 0.846 . . . . 0.0 110.139 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.11 -41.44 96.7 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.756 1.222 . . . . 0.0 111.156 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 83.8 t -60.15 -32.45 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-N 119.44 1.018 . . . . 0.0 110.937 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.37 -29.14 62.44 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.17 -0.956 . . . . 0.0 113.18 176.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -62.15 -37.45 85.26 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.445 1.02 . . . . 0.0 108.692 171.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.2 mt -65.59 -49.17 69.78 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.659 0.784 . . . . 0.0 110.077 177.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 28.5 t60 -56.58 -54.58 44.25 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 118.702 -0.666 . . . . 0.0 110.228 177.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.36 -46.27 66.09 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 118.603 0.638 . . . . 0.0 112.035 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -64.51 -45.2 88.26 Favored 'General case' 0 C--N 1.345 0.373 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 58.4 mttm -69.4 -25.34 64.09 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.688 1.195 . . . . 0.0 113.054 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.8 t -80.68 -52.26 7.75 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 127.11 2.164 . . . . 0.0 110.654 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -59.93 -41.06 90.97 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.202 -1.561 . . . . 0.0 112.791 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.25 -32.02 69.67 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 121.47 -0.769 . . . . 0.0 112.33 175.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -66.49 -39.23 88.62 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.85 1.26 . . . . 0.0 110.695 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 7.8 tm-20 -70.96 -46.73 61.87 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 174.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -57.66 -34.39 69.33 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.879 0.871 . . . . 0.0 112.79 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -69.52 -13.93 62.6 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.692 1.197 . . . . 0.0 113.96 177.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -115.9 -47.65 2.78 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.55 1.54 . . . . 0.0 113.196 -178.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 76.26 -0.12 64.52 Favored Glycine 0 CA--C 1.539 1.533 0 N-CA-C 117.206 1.642 . . . . 0.0 117.206 178.064 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -122.6 -32.58 3.56 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 119.925 1.862 . . . . 0.0 114.284 -178.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 27.1 m -70.92 154.63 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.985 0.914 . . . . 0.0 112.873 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 58.1 ttt85 -85.01 134.76 34.22 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.704 1.202 . . . . 0.0 111.052 178.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -81.84 172.22 13.58 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.297 1.039 . . . . 0.0 112.743 178.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 2.4 m -53.65 138.38 34.97 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.579 1.552 . . . . 0.0 114.542 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 61.7 p -89.05 -9.54 50.82 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.627 1.571 . . . . 0.0 111.689 172.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 30.0 tp -59.68 112.4 5.24 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 128.468 2.707 . . . . 0.0 110.298 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -55.03 -38.37 93.43 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.378 2.719 . . . . 0.0 114.886 -176.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -69.44 -34.41 74.39 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.5 t -68.38 -50.42 53.12 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.906 1.282 . . . . 0.0 109.035 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -55.29 -39.07 69.43 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.028 1.331 . . . . 0.0 111.582 174.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 21.5 m -67.39 -57.43 6.59 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.459 1.104 . . . . 0.0 111.063 176.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.9 mmt -62.03 -37.07 83.54 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -177.283 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -65.23 -37.14 86.34 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.319 1.418 . . . . 0.0 113.053 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -65.14 -39.06 92.48 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 122.653 0.381 . . . . 0.0 110.539 175.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 96.9 t -65.12 -48.08 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 123.058 0.543 . . . . 0.0 110.459 175.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -39.35 92.23 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.161 0.984 . . . . 0.0 112.449 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 43.9 m-20 -61.31 -39.05 89.06 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.461 0.704 . . . . 0.0 111.501 175.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.2 t60 -78.75 -50.08 11.96 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.197 0.999 . . . . 0.0 111.733 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -56.84 -32.88 66.21 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.832 1.653 . . . . 0.0 114.116 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 6.6 t -72.71 -15.07 61.69 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 119.91 1.232 . . . . 0.0 112.818 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 81.7 t60 -105.27 -28.99 10.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.897 1.679 . . . . 0.0 112.639 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 30.4 t -58.5 144.77 41.32 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.105 1.762 . . . . 0.0 112.836 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -117.9 -12.25 10.18 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.602 1.561 . . . . 0.0 113.726 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -91.21 -27.16 18.65 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.209 1.004 . . . . 0.0 112.175 178.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.48 -112.33 2.32 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.764 1.173 . . . . 0.0 112.75 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.3 mttt -61.49 -19.57 62.21 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 121.588 -0.948 . . . . 0.0 113.417 178.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.85 -2.44 47.43 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.179 1.391 . . . . 0.0 113.625 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 18.1 t -59.93 144.46 48.93 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 122.323 1.058 . . . . 0.0 110.737 178.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -79.03 -8.3 58.83 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.463 1.105 . . . . 0.0 113.17 -176.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 97.6 t -89.99 115.01 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 173.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.66 -38.84 70.14 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -176.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -67.39 -37.99 83.99 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.796 0.838 . . . . 0.0 112.461 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 43.0 t -66.08 -56.63 10.55 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.687 1.595 . . . . 0.0 109.536 176.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -56.84 -31.44 64.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.389 1.076 . . . . 0.0 112.968 177.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.5 m -77.01 -49.89 14.36 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.027 0.931 . . . . 0.0 112.351 177.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 70.8 m -60.08 -36.0 76.42 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 121.529 -0.732 . . . . 0.0 111.6 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -58.87 -33.03 70.01 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.132 0.973 . . . . 0.0 112.782 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -67.09 -32.75 74.12 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 118.876 0.762 . . . . 0.0 111.671 177.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 1.7 mt -76.39 -45.42 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 123.289 0.636 . . . . 0.0 109.816 177.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 35.7 mm -60.57 -37.66 75.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.268 1.027 . . . . 0.0 110.735 176.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 22.7 t -58.14 -29.9 65.91 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.328 1.051 . . . . 0.0 112.252 176.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.3 t60 -63.94 -52.84 57.89 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.161 0.891 . . . . 0.0 109.995 176.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 39.1 m95 -61.74 -30.28 70.67 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 10.7 mtpm? -70.88 -28.61 64.69 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.458 0.703 . . . . 0.0 112.758 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -100.11 -38.12 8.67 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.951 1.464 . . . . 0.0 114.951 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.6 t -78.23 134.64 37.55 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.474 1.51 . . . . 0.0 112.929 -176.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 79.9 p -130.09 -1.67 4.6 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.646 1.578 . . . . 0.0 114.242 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 22.9 ttt-85 -83.07 145.68 29.13 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.193 1.397 . . . . 0.0 112.683 -177.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 41.9 p-80 -78.06 -30.11 49.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.509 0.724 . . . . 0.0 112.35 176.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 20.7 t0 -103.1 84.16 2.31 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.044 1.738 . . . . 0.0 111.316 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 46.8 t -139.67 135.79 17.06 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 126.85 2.06 . . . . 0.0 108.468 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -57.47 -27.48 76.44 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.17 2.58 . . . . 0.0 115.383 -176.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 16.6 t -92.14 -49.86 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 CA-C-N 119.805 1.184 . . . . 0.0 111.387 176.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 4.1 m -69.54 -39.91 77.17 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -174.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.1 tt -55.09 -57.02 21.88 Favored Pre-proline 0 N--CA 1.475 0.804 0 CA-C-O 117.748 -1.12 . . . . 0.0 112.934 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.54 -31.08 91.94 Favored 'Trans proline' 0 C--N 1.354 0.824 0 CA-C-N 121.682 1.636 . . . . 0.0 113.082 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.8 mt -70.55 -45.13 66.04 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.211 0.914 . . . . 0.0 111.601 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 60.1 mttm -60.99 -37.65 83.25 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.423 1.089 . . . . 0.0 110.898 175.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 20.4 t30 -73.3 -41.56 63.42 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.354 1.461 . . . . 0.0 112.745 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -73.06 -34.14 66.07 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.05 0.94 . . . . 0.0 113.453 -179.149 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 32.1 t -71.26 138.79 49.7 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 118.414 0.552 . . . . 0.0 112.409 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 25.7 t70 -85.84 -6.69 59.05 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.397 0.679 . . . . 0.0 112.155 176.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 28.4 tptp -80.39 52.78 1.68 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.28 2.232 . . . . 0.0 110.701 178.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 11.0 ptm85 . . . . . 0 N--CA 1.476 0.828 0 C-N-CA 126.639 1.976 . . . . 0.0 112.897 -176.953 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.442 0 N-CA-C 114.178 0.431 . . . . 0.0 114.178 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.7 p -153.71 168.05 27.57 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.167 1.387 . . . . 0.0 111.975 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -61.71 -18.54 60.07 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 49.6 ttm -67.32 -21.86 65.64 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.96 1.304 . . . . 0.0 113.44 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -81.61 -15.59 54.19 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.014 -1.054 . . . . 0.0 113.403 178.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -63.45 -55.74 32.68 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-O 117.542 -1.218 . . . . 0.0 113.282 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.54 -24.89 62.91 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 122.065 1.843 . . . . 0.0 112.492 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -77.68 -13.35 59.93 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.538 1.135 . . . . 0.0 112.582 176.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 68.1 m -90.72 -16.97 27.54 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.781 1.232 . . . . 0.0 113.141 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -139.22 45.82 0.99 Allowed Pre-proline 0 CA--C 1.558 1.285 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -68.97 -15.71 40.28 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.406 2.737 . . . . 0.0 114.045 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 17.7 m -76.81 -1.27 27.37 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.593 1.557 . . . . 0.0 114.895 -178.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 13.7 p -138.54 149.45 24.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.275 1.43 . . . . 0.0 111.891 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -125.47 111.39 25.81 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 125.263 1.425 . . . . 0.0 109.934 179.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -56.22 -43.98 50.97 Favored 'Trans proline' 0 CA--C 1.55 1.32 0 C-N-CA 123.747 2.965 . . . . 0.0 117.253 -179.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -77.05 160.02 33.6 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 122.504 2.136 . . . . 0.0 113.68 -178.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 6.9 tt -73.78 137.22 43.76 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.843 1.257 . . . . 0.0 111.58 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 36.9 t -88.22 146.34 25.41 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.672 1.189 . . . . 0.0 111.407 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 12.3 tm0? -53.54 -34.51 58.45 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.691 1.196 . . . . 0.0 113.618 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -71.04 -14.11 62.22 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.117 0.967 . . . . 0.0 113.385 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 19.3 m -61.7 -57.26 12.67 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.925 -1.11 . . . . 0.0 109.871 178.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.6 m-85 -60.28 -29.15 68.63 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.408 0.683 . . . . 0.0 112.277 174.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 35.9 m -68.01 -34.62 76.85 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.231 0.923 . . . . 0.0 112.916 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.4 t70 -90.03 -30.29 17.84 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.218 1.007 . . . . 0.0 113.136 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.1 tt -43.4 -58.38 2.6 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.105 2.162 . . . . 0.0 113.168 -178.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 44.5 p-90 -71.08 -11.45 60.96 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 -173.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -110.1 -60.08 1.84 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 116.312 1.967 . . . . 0.0 116.312 -175.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 77.9 mt -120.28 16.78 12.3 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 116.665 2.098 . . . . 0.0 116.665 -172.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 6.1 tt -54.68 130.6 64.56 Favored Pre-proline 0 CA--C 1.554 1.127 0 C-N-CA 125.243 1.417 . . . . 0.0 113.349 -178.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -79.42 -179.95 5.83 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 125.016 3.81 . . . . 0.0 114.26 -177.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -65.69 -10.04 33.02 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 115.586 1.699 . . . . 0.0 115.586 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 50.1 t30 -136.02 134.0 38.04 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.105 1.362 . . . . 0.0 110.799 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -146.74 158.0 43.81 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.546 1.138 . . . . 0.0 112.219 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 29.2 m -70.46 -25.4 26.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.853 1.261 . . . . 0.0 114.176 179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 1.6 tt -97.6 111.52 23.76 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.879 1.271 . . . . 0.0 109.191 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 66.3 m -115.0 99.97 53.02 Favored Pre-proline 0 N--CA 1.475 0.785 0 C-N-CA 124.236 1.014 . . . . 0.0 112.165 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -79.97 169.11 18.25 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.934 3.089 . . . . 0.0 111.912 177.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 24.4 tp -144.63 136.97 13.3 Favored Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 124.886 1.275 . . . . 0.0 111.064 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -54.59 -35.42 86.24 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.273 2.649 . . . . 0.0 113.963 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 14.7 m -64.79 -13.64 56.2 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.812 1.245 . . . . 0.0 113.803 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -111.98 2.58 16.96 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.219 1.808 . . . . 0.0 112.623 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.56 142.91 48.45 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.217 -0.927 . . . . 0.0 112.312 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 65.2 mtm -87.39 48.75 1.69 Allowed 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.389 1.476 . . . . 0.0 112.774 -179.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 32.6 t70 -59.36 -22.61 61.59 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.446 1.098 . . . . 0.0 113.396 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -64.71 -19.96 66.06 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.176 1.39 . . . . 0.0 113.517 175.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 85.8 mt -115.5 -0.38 13.09 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.199 1.799 . . . . 0.0 113.756 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 68.0 mmm -66.03 148.07 52.37 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -177.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.05 178.18 5.67 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.688 1.995 . . . . 0.0 111.372 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 74.4 m -89.02 152.85 48.82 Favored Pre-proline 0 CA--C 1.546 0.791 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 169.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.74 -18.56 49.14 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 122.546 2.164 . . . . 0.0 115.781 -176.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -76.47 -17.08 59.48 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.04 -1.038 . . . . 0.0 112.596 177.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -82.79 -12.44 57.48 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.313 1.045 . . . . 0.0 112.535 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 96.4 mt -59.07 -35.88 59.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.869 1.268 . . . . 0.0 110.753 178.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -73.32 -9.8 59.08 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.811 1.244 . . . . 0.0 113.265 178.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -79.6 -20.72 46.19 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.964 0.906 . . . . 0.0 111.138 175.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.8 p-90 -109.92 -49.68 3.06 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.437 1.095 . . . . 0.0 113.033 177.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -81.08 109.83 16.02 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 170.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 4.2 m -122.67 138.62 54.55 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.237 1.015 . . . . 0.0 112.9 -171.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -97.82 170.65 8.82 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.578 1.551 . . . . 0.0 111.011 176.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 9.9 t70 -62.5 120.38 58.85 Favored Pre-proline 0 CA--C 1.556 1.191 0 O-C-N 120.93 -1.106 . . . . 0.0 110.39 178.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -83.37 -4.13 10.91 Favored 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 123.461 2.774 . . . . 0.0 115.181 -175.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 58.65 -118.78 14.88 Favored Glycine 0 CA--C 1.541 1.709 0 CA-C-O 118.805 -0.997 . . . . 0.0 112.359 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -75.72 -8.92 19.59 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 123.723 2.949 . . . . 0.0 113.984 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -101.42 -174.75 2.67 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.607 1.563 . . . . 0.0 112.419 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 76.83 -7.47 34.29 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 125.088 1.328 . . . . 0.0 115.948 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 64.4 p -80.14 -0.97 38.23 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.78 1.632 . . . . 0.0 114.479 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 84.7 m -61.09 -23.68 65.66 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.986 1.714 . . . . 0.0 113.61 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -136.67 167.68 20.95 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.176 1.79 . . . . 0.0 110.628 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 26.9 m120 -74.88 -60.39 2.31 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.54 -0.725 . . . . 0.0 111.942 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -55.44 -36.2 63.05 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.16 0.886 . . . . 0.0 115.176 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 39.5 p -69.3 -10.43 57.81 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.271 1.028 . . . . 0.0 113.741 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -119.35 -33.01 4.21 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.369 1.468 . . . . 0.0 113.888 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 74.7 p -84.13 -29.83 26.39 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 168.55 83.78 0.05 OUTLIER Glycine 0 CA--C 1.534 1.233 0 C-N-CA 124.237 0.923 . . . . 0.0 112.108 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -55.5 -38.49 93.99 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.523 2.816 . . . . 0.0 115.215 -176.122 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 35.5 p -86.33 4.68 38.1 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.58 1.552 . . . . 0.0 115.179 -177.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -70.11 -18.81 63.26 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 15.9 t70 -76.49 129.37 79.93 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 123.935 0.894 . . . . 0.0 112.093 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.7 -38.29 14.28 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.092 2.528 . . . . 0.0 114.465 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -65.56 -35.13 79.94 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.128 -0.983 . . . . 0.0 110.659 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -62.92 -34.89 78.41 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.302 -0.874 . . . . 0.0 111.495 175.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 96.9 mtm-85 -69.12 -33.28 73.22 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.427 -0.796 . . . . 0.0 111.181 174.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -65.36 -33.24 75.5 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 118.826 0.739 . . . . 0.0 111.367 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.44 -36.36 83.49 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 118.872 0.76 . . . . 0.0 111.052 175.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -67.01 -52.96 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 118.551 0.614 . . . . 0.0 109.63 175.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -51.94 -56.07 16.44 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.848 0.859 . . . . 0.0 111.443 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -36.05 83.05 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.26 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.0 tp60 -70.96 -41.76 70.63 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 119.234 0.925 . . . . 0.0 110.393 178.043 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.9 tt -62.18 -40.86 97.47 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.578 0.751 . . . . 0.0 109.919 177.129 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 97.1 t -59.62 -33.37 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.13 0.877 . . . . 0.0 110.942 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.0 tp -73.23 -25.55 60.78 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.875 1.216 . . . . 0.0 113.835 175.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -62.72 -30.19 71.23 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.788 1.176 . . . . 0.0 109.044 172.232 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.3 mt -72.95 -54.38 8.81 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.118 0.967 . . . . 0.0 108.513 174.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 20.4 t60 -49.4 -55.87 11.55 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.678 0.672 . . . . 0.0 111.273 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -57.65 -22.96 48.75 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -90.04 -24.65 21.12 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -88.0 -41.54 13.05 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 119.843 1.201 . . . . 0.0 112.211 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 25.4 t -59.59 -41.61 90.65 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.107 1.363 . . . . 0.0 111.108 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -61.99 -27.71 69.06 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 120.651 -1.281 . . . . 0.0 113.055 174.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -83.2 -30.07 28.03 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.738 1.215 . . . . 0.0 112.18 178.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -57.52 -38.6 74.92 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.561 1.144 . . . . 0.0 110.026 174.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -69.43 -51.36 37.09 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.381 1.072 . . . . 0.0 111.279 175.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 16.2 tp60 -63.97 -35.08 79.53 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -70.77 -24.6 62.62 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.269 1.028 . . . . 0.0 113.104 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -100.18 -42.55 6.65 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.496 1.518 . . . . 0.0 112.957 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 84.06 -4.83 82.08 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 125.686 1.612 . . . . 0.0 116.879 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -125.23 -36.94 2.45 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 119.943 1.872 . . . . 0.0 114.136 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 32.7 m -73.64 158.08 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.059 0.944 . . . . 0.0 113.307 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -107.1 172.58 6.75 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.142 1.777 . . . . 0.0 112.403 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -68.95 169.55 11.45 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.327 1.451 . . . . 0.0 113.354 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 16.5 p -70.05 176.02 4.08 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 125.589 1.556 . . . . 0.0 113.756 179.088 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 74.1 p -85.23 -2.59 58.21 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -178.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 41.1 tp -80.42 117.84 69.61 Favored Pre-proline 0 CA--C 1.553 1.076 0 C-N-CA 125.128 1.371 . . . . 0.0 111.521 -178.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.25 -29.27 47.0 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 122.145 1.896 . . . . 0.0 112.823 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 39.0 m80 -64.72 -32.65 74.42 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.291 -0.881 . . . . 0.0 113.053 178.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 30.8 t -64.16 -50.05 69.71 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.643 1.177 . . . . 0.0 109.752 176.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -53.92 -43.58 69.87 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.222 1.409 . . . . 0.0 111.015 174.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 19.4 m -64.02 -55.34 22.99 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.699 0.8 . . . . 0.0 111.787 176.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.7 mmt -65.0 -34.64 78.92 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -67.37 -34.94 78.33 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 121.142 1.792 . . . . 0.0 112.081 178.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -66.19 -37.82 86.54 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.214 0.461 . . . . 0.0 110.46 174.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 78.7 t -64.96 -52.17 57.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 123.49 0.716 . . . . 0.0 110.448 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.11 -44.86 87.91 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.722 1.209 . . . . 0.0 112.666 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 37.7 m-20 -66.41 -20.39 66.05 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.562 0.745 . . . . 0.0 112.653 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 63.7 t60 -90.17 -50.92 5.72 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.362 1.065 . . . . 0.0 109.933 172.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.1 ttp -54.99 -34.53 63.49 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.646 1.978 . . . . 0.0 113.474 -177.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 14.8 t -64.12 -27.33 69.01 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 119.276 0.944 . . . . 0.0 112.403 177.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 41.6 m80 -98.28 -26.25 14.58 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.362 1.465 . . . . 0.0 113.302 177.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 49.6 t -63.38 132.49 51.63 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.509 1.523 . . . . 0.0 112.889 -178.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -106.67 -14.15 15.1 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.38 1.472 . . . . 0.0 113.717 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -84.31 -32.96 24.04 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.283 0.947 . . . . 0.0 111.216 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.55 -106.55 0.32 Allowed Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.066 1.317 . . . . 0.0 113.188 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.74 -21.56 63.11 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.753 -0.851 . . . . 0.0 113.2 177.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -97.86 -2.66 40.31 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.639 1.576 . . . . 0.0 113.571 177.049 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.8 t -60.13 144.59 49.44 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 122.304 1.049 . . . . 0.0 110.612 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -81.26 -10.06 59.66 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.962 1.305 . . . . 0.0 113.234 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 98.2 t -89.16 115.98 29.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 174.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.32 -41.46 72.44 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -64.08 -42.16 97.05 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.478 0.711 . . . . 0.0 112.389 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.7 t -63.12 -53.37 54.52 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.033 1.333 . . . . 0.0 109.974 176.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -56.06 -38.86 71.21 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.97 0.908 . . . . 0.0 112.375 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 25.5 m -67.06 -53.37 31.68 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.975 0.91 . . . . 0.0 113.135 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.8 m -59.34 -26.95 65.48 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.162 0.892 . . . . 0.0 112.823 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.6 -31.5 71.57 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 118.335 -0.841 . . . . 0.0 112.229 175.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -65.93 -38.67 89.25 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.921 1.237 . . . . 0.0 110.89 174.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 9.4 mt -68.39 -48.15 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.129 0.972 . . . . 0.0 110.323 179.216 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 16.8 mm -62.13 -36.29 73.49 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 123.918 0.887 . . . . 0.0 111.232 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 71.9 m -61.63 -23.71 66.22 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 176.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.7 t60 -64.58 -56.46 13.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.584 1.084 . . . . 0.0 110.268 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 55.5 m95 -61.21 -29.35 69.77 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -70.28 -30.29 67.27 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.939 0.896 . . . . 0.0 112.782 177.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -100.06 -38.91 8.36 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.2 t -80.07 133.4 36.11 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.483 1.513 . . . . 0.0 112.611 -176.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 71.7 p -130.0 1.61 4.78 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.929 1.692 . . . . 0.0 113.893 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -75.91 154.71 35.79 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.273 1.429 . . . . 0.0 113.299 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 18.8 t60 -88.26 -39.2 14.61 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.588 0.755 . . . . 0.0 110.365 172.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 20.1 t0 -94.96 80.49 3.66 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.915 1.686 . . . . 0.0 111.374 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.5 t -134.97 135.45 23.11 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.736 2.014 . . . . 0.0 109.123 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -59.05 -25.18 76.87 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.751 2.3 . . . . 0.0 114.153 -178.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.7 t -92.16 -52.97 9.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 119.817 1.189 . . . . 0.0 111.618 176.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 9.0 m -68.61 -37.73 80.02 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.235 1.569 . . . . 0.0 115.235 -174.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -56.27 -57.53 22.17 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-O 117.63 -1.176 . . . . 0.0 112.8 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -61.08 -31.62 90.9 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 121.933 1.755 . . . . 0.0 113.411 179.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 93.3 mt -68.13 -48.49 65.25 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.888 0.767 . . . . 0.0 111.175 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -63.95 -35.79 81.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.753 0.821 . . . . 0.0 111.37 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 49.4 t30 -64.51 -46.72 81.72 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.525 1.13 . . . . 0.0 110.894 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -69.01 -31.0 69.51 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.901 0.88 . . . . 0.0 112.515 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 9.9 m -96.25 26.68 4.13 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.555 1.942 . . . . 0.0 113.728 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 27.4 t0 -74.82 77.37 2.11 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.451 1.1 . . . . 0.0 111.178 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 21.2 pttp -58.31 -7.53 0.89 Allowed 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 128.623 2.769 . . . . 0.0 118.218 -175.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 . . . . . 0 N--CA 1.482 1.142 0 CA-C-N 119.952 1.251 . . . . 0.0 113.906 -178.45 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.381 0 N-CA-C 113.95 0.34 . . . . 0.0 113.95 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.5 t -143.29 151.21 40.26 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.949 1.299 . . . . 0.0 112.38 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -63.0 -27.14 69.21 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.508 1.123 . . . . 0.0 112.532 176.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 92.8 mmm -97.5 9.47 42.34 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.653 1.581 . . . . 0.0 113.542 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -70.01 128.95 38.12 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.07 -1.019 . . . . 0.0 112.481 -179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -154.72 152.54 25.95 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 125.52 1.528 . . . . 0.0 111.515 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.96 145.32 67.52 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.014 2.476 . . . . 0.0 111.763 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -75.4 -35.23 61.06 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 55.4 m -144.8 152.48 40.38 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.374 1.47 . . . . 0.0 112.041 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -146.09 142.01 17.21 Favored Pre-proline 0 CA--C 1.546 0.808 0 C-N-CA 125.702 1.601 . . . . 0.0 110.451 177.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 30.9 Cg_exo -64.79 -32.16 56.71 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.624 2.216 . . . . 0.0 114.412 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 41.6 m -84.4 65.4 8.89 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.813 1.645 . . . . 0.0 112.893 -177.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 10.3 p -140.32 139.49 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.662 1.185 . . . . 0.0 111.881 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -120.19 84.31 33.75 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 125.786 1.634 . . . . 0.0 110.093 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -62.67 -36.21 64.85 Favored 'Trans proline' 0 CA--C 1.549 1.238 0 C-N-CA 122.676 2.25 . . . . 0.0 117.411 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -84.51 154.69 12.13 Favored 'Trans proline' 0 C--N 1.355 0.891 0 CA-C-N 123.629 2.332 . . . . 0.0 113.177 -179.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 8.9 tt -71.0 141.0 50.99 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.974 0.909 . . . . 0.0 110.92 176.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 42.3 t -123.02 159.22 28.85 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 126.41 1.884 . . . . 0.0 109.408 175.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -60.52 -26.69 67.04 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 121.358 -0.839 . . . . 0.0 110.886 175.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -84.32 -11.55 56.17 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.064 1.346 . . . . 0.0 113.666 177.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 86.6 m -60.48 -60.04 4.43 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 119.718 1.145 . . . . 0.0 111.25 -178.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -60.11 -29.54 68.67 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.403 0.681 . . . . 0.0 112.602 176.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 70.5 m -71.04 -31.09 67.46 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.888 0.875 . . . . 0.0 113.215 178.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.1 t70 -90.05 -31.14 17.29 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.811 1.244 . . . . 0.0 112.826 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.8 tt -42.59 -60.02 1.69 Allowed 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 127.665 2.386 . . . . 0.0 113.489 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.4 p-90 -70.18 -11.36 60.84 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 115.272 1.582 . . . . 0.0 115.272 -174.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -111.5 -60.03 1.9 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 116.034 1.864 . . . . 0.0 116.034 -175.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 6.6 mp -120.18 20.21 12.07 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -174.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 3.0 tt -52.06 135.25 39.21 Favored Pre-proline 0 N--CA 1.476 0.829 0 C-N-CA 124.979 1.311 . . . . 0.0 114.137 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -66.19 164.62 27.21 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 124.035 3.157 . . . . 0.0 112.779 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -73.03 -2.94 23.15 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -177.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 49.9 t30 -129.36 134.13 47.73 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.567 1.547 . . . . 0.0 109.66 176.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -149.82 160.4 43.59 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.948 0.899 . . . . 0.0 112.664 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 10.0 p -111.67 -16.41 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 125.653 1.581 . . . . 0.0 113.475 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -87.49 33.9 0.7 Allowed 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.821 2.048 . . . . 0.0 112.095 -179.091 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 24.0 m -94.63 110.5 49.51 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 125.112 1.365 . . . . 0.0 112.626 -176.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -76.3 128.56 10.56 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.73 2.287 . . . . 0.0 111.098 179.016 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 21.1 tp -76.34 133.22 71.69 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.513 1.125 . . . . 0.0 111.77 -178.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -52.04 -32.75 49.99 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 123.808 3.005 . . . . 0.0 115.18 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 24.7 m -60.88 -19.85 60.96 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 23.3 mp0 -131.47 20.26 4.75 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.702 1.601 . . . . 0.0 111.894 177.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -75.62 156.48 34.85 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.73 17.68 3.24 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 128.49 2.716 . . . . 0.0 113.724 178.303 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 37.4 t70 -61.71 -22.68 65.57 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.566 1.546 . . . . 0.0 114.663 -176.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.1 t70 -65.57 -16.28 63.55 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 21.3 tp -108.5 14.57 24.55 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 126.139 1.775 . . . . 0.0 113.128 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 76.5 mmm -66.33 155.37 37.48 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 -177.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.07 167.18 15.12 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.071 2.148 . . . . 0.0 114.984 -178.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 88.2 p -91.58 162.26 32.02 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 127.202 2.201 . . . . 0.0 108.749 169.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -62.78 -24.56 74.6 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.023 1.815 . . . . 0.0 113.327 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.0 t70 -63.54 -29.12 70.43 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.756 0.823 . . . . 0.0 112.944 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 11.5 t70 -90.12 -17.58 27.42 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 75.5 mt -59.88 -38.33 75.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 CA-C-N 119.792 1.178 . . . . 0.0 110.942 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . 0.304 0.0 OUTLIER -67.98 -9.82 48.56 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 176.628 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -79.37 -29.84 42.3 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.105 -0.997 . . . . 0.0 111.77 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.27 15.0 p-90 -101.13 -13.0 18.35 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 178.314 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -134.5 109.84 8.98 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 105.866 -1.901 . . . . 0.0 105.866 169.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 2.7 m -125.18 150.02 47.36 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.003 0.921 . . . . 0.0 113.05 -174.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.67 178.92 7.81 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.923 1.289 . . . . 0.0 111.221 175.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 13.3 t70 -60.42 127.31 86.38 Favored Pre-proline 0 CA--C 1.557 1.23 0 O-C-N 120.854 -1.154 . . . . 0.0 111.427 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -81.47 1.63 9.13 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 124.074 3.183 . . . . 0.0 115.955 -175.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 85.22 170.56 47.31 Favored Glycine 0 CA--C 1.54 1.634 0 C-N-CA 125.449 1.499 . . . . 0.0 113.386 -177.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -64.87 -22.14 63.57 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.725 2.95 . . . . 0.0 113.907 -178.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -95.8 -2.16 48.17 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.451 1.501 . . . . 0.0 113.536 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 63.78 31.37 80.56 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 124.438 1.018 . . . . 0.0 114.312 -179.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 23.2 t -51.2 -54.79 22.25 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.788 1.294 . . . . 0.0 113.531 -176.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 77.6 m -69.87 -29.75 67.05 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.226 0.61 . . . . 0.0 112.537 179.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 58.0 t80 -68.97 -39.85 79.19 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.725 -0.609 . . . . 0.0 111.597 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -59.13 -25.93 64.29 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.422 -0.799 . . . . 0.0 112.046 176.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -79.31 -8.32 87.88 Favored Glycine 0 CA--C 1.54 1.642 0 C-N-CA 124.875 1.226 . . . . 0.0 114.853 175.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 4.7 t -136.1 0.1 2.57 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -178.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -56.18 -21.6 23.95 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.287 1.435 . . . . 0.0 114.821 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 10.7 t -69.87 -20.38 63.4 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.769 1.228 . . . . 0.0 112.696 176.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -160.55 78.95 0.17 Allowed Glycine 0 CA--C 1.537 1.425 0 C-N-CA 125.788 1.661 . . . . 0.0 111.297 178.021 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -60.03 166.01 9.51 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.356 3.37 . . . . 0.0 115.067 -177.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 44.4 p -52.45 -31.56 35.22 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 125.918 1.687 . . . . 0.0 114.891 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -89.2 -2.05 58.33 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 14.1 t70 -64.45 140.32 97.95 Favored Pre-proline 0 CA--C 1.55 0.962 0 O-C-N 121.22 -0.925 . . . . 0.0 111.88 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -50.77 -36.87 53.2 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 123.515 2.81 . . . . 0.0 115.446 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -67.06 -40.5 87.1 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.193 -0.942 . . . . 0.0 110.772 176.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 14.2 mptt -67.12 -40.13 86.76 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.96 0.904 . . . . 0.0 110.387 177.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -55.79 -43.93 77.3 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 119.615 1.098 . . . . 0.0 111.586 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -60.71 -38.56 85.46 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.699 0.8 . . . . 0.0 111.582 176.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 93.2 mt -66.3 -38.79 88.54 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.36 0.664 . . . . 0.0 111.637 177.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -62.29 -54.57 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 119.027 0.83 . . . . 0.0 109.754 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -53.63 -55.57 24.72 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.818 1.247 . . . . 0.0 111.095 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -33.36 75.65 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -69.75 -46.56 65.59 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.809 1.186 . . . . 0.0 109.781 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 5.9 tp -59.22 -41.95 89.84 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.56 0.744 . . . . 0.0 111.195 177.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 63.4 t -59.08 -31.89 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-N 119.996 1.271 . . . . 0.0 111.485 176.171 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 5.8 tp -72.49 -31.42 65.38 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.707 -1.245 . . . . 0.0 112.871 175.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.0 mp -60.48 -31.14 70.18 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 120.249 1.386 . . . . 0.0 109.603 172.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.6 mt -71.1 -51.7 23.6 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.546 0.738 . . . . 0.0 109.975 176.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 21.6 t60 -56.29 -55.8 28.93 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.264 0.625 . . . . 0.0 111.071 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -50.39 -41.74 52.5 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.717 1.207 . . . . 0.0 114.004 -175.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -73.93 -44.44 55.04 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.212 0.915 . . . . 0.0 112.569 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 44.4 mttm -65.73 -43.13 89.96 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.364 1.066 . . . . 0.0 111.229 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 42.2 t -62.21 -47.35 84.83 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.196 1.798 . . . . 0.0 110.388 175.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -54.57 -46.39 73.68 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.302 -0.874 . . . . 0.0 112.881 177.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 48.7 mtp180 -82.12 -17.93 44.71 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 -178.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -62.65 -33.06 74.28 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 120.926 1.693 . . . . 0.0 111.777 177.744 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.62 -46.85 74.52 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.396 1.078 . . . . 0.0 110.337 176.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -64.72 -32.82 74.67 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.328 1.051 . . . . 0.0 112.619 178.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -69.69 -12.97 62.05 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 178.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -127.82 -43.89 1.51 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.649 1.18 . . . . 0.0 114.182 -175.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 77.96 -12.38 17.84 Favored Glycine 0 CA--C 1.541 1.697 0 N-CA-C 117.091 1.597 . . . . 0.0 117.091 178.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -104.13 -37.34 7.36 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.619 1.71 . . . . 0.0 112.133 178.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 22.1 m -76.91 170.85 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 124.513 1.125 . . . . 0.0 111.382 175.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 65.4 ttt-85 -127.39 148.23 50.27 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.461 1.504 . . . . 0.0 111.905 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -77.96 179.86 6.5 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.257 1.423 . . . . 0.0 112.448 177.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 3.7 m -56.26 148.12 19.27 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 67.0 m -95.74 -4.85 43.31 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.718 1.607 . . . . 0.0 110.652 169.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 38.3 tp -63.22 114.72 13.68 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 128.646 2.779 . . . . 0.0 111.175 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -54.98 -40.0 88.05 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.103 2.536 . . . . 0.0 114.961 -177.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 32.6 m80 -66.09 -37.07 84.87 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.005 0.82 . . . . 0.0 112.995 179.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 43.5 t -67.15 -51.45 53.69 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.292 1.437 . . . . 0.0 109.656 177.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -57.11 -34.93 68.85 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.912 1.285 . . . . 0.0 111.6 174.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.5 m -69.21 -60.97 1.99 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.239 1.016 . . . . 0.0 110.908 175.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.1 mmt -59.4 -35.34 73.78 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -177.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -66.56 -34.47 77.98 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 120.659 1.572 . . . . 0.0 112.722 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -69.73 -37.36 76.47 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.914 -0.491 . . . . 0.0 110.311 173.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 59.3 t -64.78 -40.84 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-O 118.966 -0.54 . . . . 0.0 110.264 175.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.94 -43.78 94.78 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.908 1.283 . . . . 0.0 111.014 175.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -63.7 -36.6 84.37 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.222 0.609 . . . . 0.0 112.006 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 63.5 t60 -74.72 -52.55 11.27 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.741 0.816 . . . . 0.0 110.687 177.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.3 ttp -58.24 -33.27 69.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.741 1.616 . . . . 0.0 113.668 -176.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 3.9 t -75.45 -10.06 59.12 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 119.657 1.117 . . . . 0.0 113.275 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 46.6 m80 -117.37 -16.72 10.24 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.761 1.625 . . . . 0.0 113.717 177.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 38.1 t -57.57 144.72 36.2 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.466 1.506 . . . . 0.0 112.946 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -103.77 -15.12 15.82 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.046 1.738 . . . . 0.0 113.564 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -106.94 -34.0 7.34 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.329 1.052 . . . . 0.0 112.448 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.5 -105.73 0.24 Allowed Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.828 1.204 . . . . 0.0 114.096 177.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -60.09 -21.9 62.07 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 121.133 -1.216 . . . . 0.0 112.828 177.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -100.78 0.2 38.32 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.272 1.829 . . . . 0.0 113.522 176.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 12.5 t -63.67 143.28 57.97 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 122.261 1.029 . . . . 0.0 110.375 178.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -84.6 -6.48 59.37 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.761 1.224 . . . . 0.0 113.51 -176.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 88.0 t -83.96 120.91 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 173.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.66 -44.38 69.59 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.043 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 72.3 m80 -62.28 -42.3 99.23 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 50.2 t -64.91 -55.95 16.2 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.78 1.232 . . . . 0.0 111.311 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.61 -32.75 70.69 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.371 0.668 . . . . 0.0 112.482 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 74.2 m -73.63 -47.0 43.43 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.543 0.737 . . . . 0.0 111.549 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 69.6 m -62.27 -36.61 82.59 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.584 1.154 . . . . 0.0 112.1 178.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -61.65 -31.77 71.89 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.318 -0.864 . . . . 0.0 113.009 175.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -69.65 -28.53 65.97 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.146 0.884 . . . . 0.0 111.27 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.8 mm -70.83 -50.38 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 123.888 0.875 . . . . 0.0 109.645 174.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 12.9 mm -61.34 -42.22 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 124.949 1.299 . . . . 0.0 111.425 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 50.2 m -60.41 -20.81 61.03 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.431 0.901 . . . . 0.0 113.431 179.048 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.3 t60 -64.78 -55.9 16.89 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.474 1.034 . . . . 0.0 110.728 176.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 50.1 m95 -62.54 -24.72 67.66 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -74.08 -30.74 62.52 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.539 0.736 . . . . 0.0 112.461 176.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -100.05 -38.12 8.69 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.9 t -78.53 135.23 37.26 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.426 1.49 . . . . 0.0 112.373 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 79.7 p -129.97 2.17 4.81 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.518 1.527 . . . . 0.0 114.175 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -82.23 152.17 26.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.236 1.414 . . . . 0.0 113.499 -178.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 15.0 t60 -86.62 -37.92 17.59 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.862 0.865 . . . . 0.0 109.934 171.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 21.4 t0 -94.3 78.48 3.94 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.017 1.727 . . . . 0.0 111.336 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.8 t -132.67 135.44 26.11 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 126.819 2.047 . . . . 0.0 109.232 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -59.79 -24.24 75.1 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.798 2.332 . . . . 0.0 114.027 -178.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 8.1 t -92.22 -52.99 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-N 119.608 1.095 . . . . 0.0 111.855 176.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 15.2 m -68.97 -40.4 78.86 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -175.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.8 tt -55.92 -56.12 33.85 Favored Pre-proline 0 CA--C 1.545 0.785 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.571 -178.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -61.7 -30.15 84.7 Favored 'Trans proline' 0 C--N 1.355 0.873 0 CA-C-N 121.679 1.635 . . . . 0.0 113.287 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 91.2 mt -69.73 -45.7 67.58 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.873 1.215 . . . . 0.0 111.494 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -63.26 -35.85 81.72 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.917 0.887 . . . . 0.0 110.749 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 22.9 t30 -71.41 -40.12 70.68 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.004 1.322 . . . . 0.0 112.197 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -73.16 -27.95 61.95 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.804 1.242 . . . . 0.0 113.251 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 44.1 t -57.53 141.37 48.04 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.735 1.214 . . . . 0.0 113.192 -179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -85.23 -11.56 54.62 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.09 1.356 . . . . 0.0 112.166 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -81.74 63.81 6.17 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.874 1.669 . . . . 0.0 111.852 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 . . . . . 0 N--CA 1.48 1.033 0 C-N-CA 125.588 1.555 . . . . 0.0 112.339 -178.447 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.422 0 CA-C-O 121.854 0.697 . . . . 0.0 114.817 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.4 m -66.83 159.54 27.94 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.081 1.352 . . . . 0.0 113.086 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 27.0 m80 -57.06 -23.7 48.56 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 114.628 1.344 . . . . 0.0 114.628 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 26.5 mmt -77.52 -20.36 54.34 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.138 0.975 . . . . 0.0 112.603 176.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -99.04 -38.16 9.07 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.498 1.519 . . . . 0.0 111.282 177.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -126.21 76.57 72.42 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 125.713 1.605 . . . . 0.0 110.901 178.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -72.25 159.99 48.26 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.633 2.888 . . . . 0.0 112.977 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -143.98 141.83 30.38 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.571 1.548 . . . . 0.0 111.993 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 46.5 m -83.25 63.9 7.46 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.012 1.325 . . . . 0.0 112.245 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -139.26 139.03 21.69 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 124.908 1.283 . . . . 0.0 112.309 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.06 -20.8 16.4 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.024 2.483 . . . . 0.0 112.537 177.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 7.2 m -56.25 -19.59 14.68 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 127.096 2.158 . . . . 0.0 114.997 -178.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 7.8 p -77.1 -18.91 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 125.005 1.322 . . . . 0.0 112.925 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -76.44 124.97 88.09 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 124.194 0.998 . . . . 0.0 111.63 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -55.01 -48.91 18.6 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 122.977 2.451 . . . . 0.0 115.568 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -76.28 137.9 19.48 Favored 'Trans proline' 0 C--N 1.353 0.811 0 CA-C-N 121.997 1.749 . . . . 0.0 111.63 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 16.0 tp -75.66 143.18 42.35 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.377 0.671 . . . . 0.0 111.259 177.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 42.1 t -65.33 139.66 58.61 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.239 0.542 . . . . 0.0 111.127 176.055 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 28.1 mp0 -61.51 -23.42 65.91 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.555 1.142 . . . . 0.0 112.296 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -83.24 -15.49 50.14 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 99.4 m -60.9 -60.01 4.47 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.198 0.908 . . . . 0.0 111.791 -178.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -60.11 -29.3 68.52 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 177.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 69.8 m -70.55 -29.94 66.54 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.781 0.832 . . . . 0.0 112.911 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.9 t70 -90.22 -30.37 17.6 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.615 1.166 . . . . 0.0 113.156 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.5 tt -45.66 -59.96 2.46 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.88 2.072 . . . . 0.0 113.252 -177.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.4 p-90 -67.99 -8.5 37.94 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -174.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -111.99 -58.07 2.18 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 44.1 mt -120.15 19.95 12.13 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 116.061 1.874 . . . . 0.0 116.061 -171.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.1 tt -51.98 136.44 37.48 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.871 1.668 . . . . 0.0 114.999 -178.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -81.16 149.18 17.19 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 124.38 3.386 . . . . 0.0 113.085 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.61 -10.26 34.16 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 115.991 1.849 . . . . 0.0 115.991 -179.341 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 44.6 p-10 -92.69 -0.15 57.33 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -71.06 146.2 49.45 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 119.337 0.971 . . . . 0.0 111.985 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 28.4 m -113.34 6.95 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 -176.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 55.1 tp -79.32 58.22 2.53 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.107 1.363 . . . . 0.0 111.36 178.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 11.2 t -114.97 101.9 54.68 Favored Pre-proline 0 CA--C 1.54 0.571 0 C-N-CA 124.801 1.24 . . . . 0.0 111.734 -178.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -60.06 125.35 17.37 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 123.39 2.727 . . . . 0.0 110.88 178.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 85.6 mt -80.71 141.61 52.01 Favored Pre-proline 0 CA--C 1.545 0.754 0 CA-C-O 118.661 -0.685 . . . . 0.0 112.64 -177.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -53.9 -27.74 45.63 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.939 3.092 . . . . 0.0 115.043 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 56.0 p -66.0 -17.94 65.02 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.417 1.487 . . . . 0.0 114.029 177.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -133.77 16.35 3.93 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.593 1.957 . . . . 0.0 112.927 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -74.7 164.02 27.04 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.758 1.223 . . . . 0.0 113.858 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -105.8 28.75 7.23 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.212 2.205 . . . . 0.0 112.67 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -58.84 -22.14 58.26 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.048 1.339 . . . . 0.0 113.873 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -70.88 -21.22 62.42 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.072 1.349 . . . . 0.0 113.164 175.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 35.6 tp -105.59 -4.23 21.38 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.808 2.043 . . . . 0.0 112.623 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 47.9 mmm -62.19 153.24 30.95 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 -177.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 94.7 mt -125.21 155.96 39.23 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 127.336 2.254 . . . . 0.0 112.337 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 33.5 p -75.95 160.01 79.5 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 170.431 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -61.81 -17.43 55.11 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 121.83 1.687 . . . . 0.0 114.139 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 28.8 t70 -77.08 -25.76 52.67 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.216 1.006 . . . . 0.0 112.877 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -77.89 -14.11 59.66 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.859 0.864 . . . . 0.0 112.703 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 77.7 mt -58.41 -37.46 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.892 1.277 . . . . 0.0 110.615 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -68.14 -9.96 50.52 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.068 1.747 . . . . 0.0 113.113 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -86.71 -27.05 23.94 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.666 1.186 . . . . 0.0 112.561 178.271 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -98.48 -40.36 8.3 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.981 0.912 . . . . 0.0 112.349 174.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -90.37 109.62 20.73 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 104.128 -2.545 . . . . 0.0 104.128 169.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 2.7 m -74.47 123.9 25.58 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -170.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -120.07 174.37 6.52 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.829 2.052 . . . . 0.0 110.417 175.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -61.79 129.26 91.44 Favored Pre-proline 0 CA--C 1.552 1.023 0 O-C-N 120.999 -1.063 . . . . 0.0 112.015 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -78.7 -19.97 10.9 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.237 2.625 . . . . 0.0 115.296 -176.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 65.36 -165.0 36.51 Favored Glycine 0 CA--C 1.543 1.841 0 CA-C-N 118.519 0.6 . . . . 0.0 112.9 -175.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -66.2 -25.16 50.51 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.514 2.809 . . . . 0.0 115.004 -178.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 32.3 t70 -95.51 -29.71 14.23 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -174.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -84.7 15.56 41.22 Favored Glycine 0 CA--C 1.537 1.455 0 C-N-CA 124.621 1.105 . . . . 0.0 115.811 -178.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 78.6 p -65.41 3.67 0.65 Allowed 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 -177.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 95.5 m -58.52 -31.64 68.1 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 126.573 1.949 . . . . 0.0 113.793 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -143.66 -170.79 3.38 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.78 1.632 . . . . 0.0 111.043 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 47.4 t30 -79.75 71.8 6.42 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 172.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . 103.74 -166.92 15.98 Favored Glycine 0 CA--C 1.541 1.677 0 C-N-CA 126.715 2.103 . . . . 0.0 108.477 -169.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 80.0 p -87.59 -4.17 58.96 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 120.492 -1.593 . . . . 0.0 113.842 178.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -66.16 121.27 14.8 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.561 1.144 . . . . 0.0 112.183 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 24.8 p -66.64 -19.63 65.81 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.011 1.324 . . . . 0.0 113.093 177.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -168.4 158.19 30.78 Favored Glycine 0 CA--C 1.539 1.585 0 C-N-CA 127.987 2.708 . . . . 0.0 109.566 177.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -56.5 148.37 63.55 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.134 2.556 . . . . 0.0 114.349 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 12.1 t -61.34 -18.85 60.62 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.662 0.785 . . . . 0.0 113.034 178.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -70.36 -4.9 24.51 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.815 1.246 . . . . 0.0 113.971 176.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 13.0 t70 -77.54 137.52 63.38 Favored Pre-proline 0 CA--C 1.552 1.048 0 O-C-N 120.823 -1.173 . . . . 0.0 111.419 178.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -53.3 -33.54 66.14 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.35 2.7 . . . . 0.0 114.973 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -70.82 -16.87 62.76 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.877 0.871 . . . . 0.0 113.157 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -90.1 -43.58 10.38 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.857 1.263 . . . . 0.0 112.116 176.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -54.35 -43.86 71.65 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 120.039 1.29 . . . . 0.0 112.106 178.228 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -60.7 -31.2 70.48 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 96.4 mt -71.41 -41.16 69.92 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.2 0.909 . . . . 0.0 111.705 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.9 mt -64.22 -51.75 64.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -55.94 -54.64 42.26 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.636 1.174 . . . . 0.0 111.258 177.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -35.6 80.79 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -177.281 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -66.35 -46.25 77.43 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.765 1.166 . . . . 0.0 109.773 176.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 10.3 tp -59.94 -42.03 93.11 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.118 0.567 . . . . 0.0 111.017 176.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 84.3 t -60.93 -31.01 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.661 1.119 . . . . 0.0 111.285 175.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.6 tp -74.79 -28.18 60.62 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.228 1.376 . . . . 0.0 112.816 174.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 8.6 mp -61.31 -28.13 68.98 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 120.288 1.404 . . . . 0.0 108.934 171.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.9 mt -74.55 -58.7 3.12 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.079 -0.962 . . . . 0.0 108.926 174.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 25.2 t60 -47.6 -55.37 9.43 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.062 0.846 . . . . 0.0 110.438 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -51.0 -36.08 37.35 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.355 1.062 . . . . 0.0 113.74 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -83.62 -37.8 22.41 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 178.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -70.06 -37.32 75.48 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 119.848 1.204 . . . . 0.0 110.578 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 36.5 t -65.95 -43.04 89.12 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.813 2.045 . . . . 0.0 110.899 176.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -48.8 -36.77 17.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.631 1.172 . . . . 0.0 113.135 175.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -62.93 -26.24 68.72 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.123 0.969 . . . . 0.0 113.564 178.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.5 -34.54 75.68 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.715 1.143 . . . . 0.0 112.571 -179.424 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -82.55 -46.78 12.92 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.959 0.903 . . . . 0.0 110.647 177.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 16.2 tp60 -61.04 -34.05 74.26 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -80.93 -9.88 59.78 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -119.89 -45.12 2.49 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -176.017 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 77.16 -3.79 56.84 Favored Glycine 0 CA--C 1.542 1.754 0 N-CA-C 117.402 1.721 . . . . 0.0 117.402 178.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -117.61 -37.6 3.44 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.996 1.898 . . . . 0.0 113.211 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 33.7 m -71.24 165.26 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 124.186 0.994 . . . . 0.0 112.468 177.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 30.9 mmt180 -104.38 172.66 6.67 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.307 1.443 . . . . 0.0 112.814 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -73.63 168.65 18.9 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.93 1.292 . . . . 0.0 113.445 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 1.3 t -57.71 144.78 36.77 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.75 2.02 . . . . 0.0 113.445 -178.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 75.3 p -81.73 -11.97 58.81 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.719 1.208 . . . . 0.0 113.488 178.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 3.5 tt -73.74 114.75 35.29 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 126.073 1.749 . . . . 0.0 108.671 178.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -54.07 -41.79 72.5 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.047 2.498 . . . . 0.0 115.007 -175.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 54.2 m80 -69.43 -31.28 69.52 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 24.6 t -68.96 -53.13 22.45 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.532 1.133 . . . . 0.0 108.605 175.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 20.6 ttt85 -55.12 -32.45 62.06 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.517 1.527 . . . . 0.0 111.644 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.2 m -73.36 -59.06 2.89 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.17 1.388 . . . . 0.0 111.336 174.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.7 mmt -62.28 -36.25 81.5 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -65.15 -29.29 70.11 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 120.588 1.54 . . . . 0.0 112.711 178.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -74.9 -38.52 61.82 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.35 0.66 . . . . 0.0 110.447 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 84.1 t -63.17 -44.28 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.729 0.695 . . . . 0.0 110.011 175.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -47.65 84.06 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.189 0.996 . . . . 0.0 110.784 177.105 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -63.81 -22.96 67.17 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 176.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 71.5 t60 -83.94 -49.78 8.66 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.998 0.817 . . . . 0.0 109.632 174.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 34.8 ttp -57.57 -29.4 64.4 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.418 1.887 . . . . 0.0 113.559 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 20.2 p -69.85 -29.1 66.26 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 121.087 -1.008 . . . . 0.0 112.528 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -95.79 -26.34 15.7 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.894 1.678 . . . . 0.0 112.992 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 18.0 t -60.63 150.26 32.46 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.598 1.559 . . . . 0.0 112.873 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -121.25 -13.18 8.53 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.888 1.675 . . . . 0.0 113.638 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -95.57 -27.64 15.24 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.254 1.022 . . . . 0.0 112.421 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.55 -113.07 2.77 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 124.534 1.064 . . . . 0.0 113.132 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -63.46 -15.58 58.16 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.149 -1.206 . . . . 0.0 113.644 178.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -97.92 -1.71 42.28 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.242 1.417 . . . . 0.0 113.128 175.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 18.5 t -60.33 144.02 51.6 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 122.278 1.037 . . . . 0.0 110.839 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 58.1 mm-40 -78.88 -7.75 58.22 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.562 1.145 . . . . 0.0 113.0 -176.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 93.8 t -90.23 116.57 31.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 173.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.34 -38.6 68.97 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -65.93 -44.74 84.23 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.212 0.605 . . . . 0.0 112.247 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 40.4 t -59.94 -55.9 28.32 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.992 1.317 . . . . 0.0 110.728 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.95 -22.59 64.58 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.7 m -83.4 -51.56 7.29 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.882 0.873 . . . . 0.0 111.368 176.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 57.7 m -58.51 -35.98 73.1 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.269 -0.895 . . . . 0.0 112.354 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 37.3 tpt85 -63.7 -24.76 67.91 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.48 -0.762 . . . . 0.0 112.982 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -72.62 -30.4 64.31 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.015 0.825 . . . . 0.0 111.152 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.0 mm -70.51 -44.73 76.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 175.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 26.7 mm -60.22 -37.91 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.725 1.21 . . . . 0.0 110.645 176.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 67.4 m -61.64 -25.23 67.24 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.047 0.939 . . . . 0.0 113.324 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.2 t60 -62.84 -56.73 14.8 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.87 1.214 . . . . 0.0 110.838 179.301 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 51.8 m95 -62.85 -21.47 65.98 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 64.0 mttm -82.19 -26.77 33.07 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.331 1.052 . . . . 0.0 112.799 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -100.12 -43.64 6.26 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.955 1.302 . . . . 0.0 113.341 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 9.4 t -84.0 133.53 34.67 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.579 1.952 . . . . 0.0 110.958 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 69.4 p -129.97 -4.69 4.52 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.644 1.35 . . . . 0.0 114.644 -177.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 77.1 mtp85 -66.19 153.39 42.56 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.815 1.646 . . . . 0.0 113.64 -178.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -86.97 -26.45 23.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.444 0.698 . . . . 0.0 111.349 171.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 21.3 t0 -108.06 78.7 1.2 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.865 2.066 . . . . 0.0 111.433 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.0 t -136.48 136.01 21.49 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 127.289 2.236 . . . . 0.0 108.334 178.431 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -59.01 -24.28 72.62 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.763 2.309 . . . . 0.0 114.068 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.9 t -92.15 -52.01 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.694 1.134 . . . . 0.0 111.288 175.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 10.8 m -68.6 -42.1 78.63 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.974 1.472 . . . . 0.0 114.974 -175.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.2 tt -52.27 -57.48 15.18 Favored Pre-proline 0 CA--C 1.547 0.844 0 CA-C-O 117.802 -1.094 . . . . 0.0 113.316 -177.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -60.46 -31.65 92.79 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.78 1.654 . . . . 0.0 113.54 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.6 mt -73.25 -44.58 59.14 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.659 0.784 . . . . 0.0 112.255 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -58.94 -37.86 77.69 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.842 0.857 . . . . 0.0 110.305 174.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 38.5 t30 -73.37 -36.57 66.11 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.94 1.696 . . . . 0.0 113.385 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -84.87 -20.32 30.99 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -178.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 42.4 t -58.22 149.94 22.86 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -73.36 -11.8 60.61 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 177.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -108.39 20.39 18.67 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.774 1.63 . . . . 0.0 113.262 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 58.1 ttt-85 . . . . . 0 N--CA 1.48 1.028 0 C-N-CA 127.278 2.231 . . . . 0.0 112.429 179.882 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.497 0 N-CA-C 114.779 0.672 . . . . 0.0 114.779 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.3 t -149.35 153.45 37.45 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.942 1.697 . . . . 0.0 111.548 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 27.4 t60 -61.08 -23.36 65.42 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.768 0.827 . . . . 0.0 112.074 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 64.9 mtt -72.8 -21.76 60.93 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.301 1.04 . . . . 0.0 112.352 175.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -98.89 -36.91 9.62 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.404 1.482 . . . . 0.0 111.48 177.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -136.98 91.59 14.88 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.984 1.713 . . . . 0.0 109.808 178.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -77.29 58.31 6.2 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 124.553 3.502 . . . . 0.0 112.884 -177.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.08 169.74 16.9 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.897 1.279 . . . . 0.0 113.409 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 8.6 t -146.83 165.19 30.46 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.344 1.458 . . . . 0.0 111.371 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -138.8 144.22 40.81 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 125.681 1.593 . . . . 0.0 111.734 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -71.65 -27.09 18.86 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.073 2.515 . . . . 0.0 112.79 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 76.2 p -153.98 141.67 19.96 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.193 2.197 . . . . 0.0 110.011 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 9.1 p -142.75 6.42 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 C-N-CA 124.728 1.211 . . . . 0.0 113.578 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -126.55 81.89 67.51 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 125.819 1.648 . . . . 0.0 110.066 178.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.48 -25.94 20.71 Favored 'Trans proline' 0 CA--C 1.55 1.295 0 C-N-CA 123.18 2.586 . . . . 0.0 118.745 -176.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -74.09 150.8 43.51 Favored 'Trans proline' 0 C--N 1.356 0.949 0 CA-C-N 124.587 2.674 . . . . 0.0 113.238 -177.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 14.0 tp -79.11 138.53 37.97 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.059 0.944 . . . . 0.0 110.711 177.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 40.5 t -70.38 134.23 47.66 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.812 -0.555 . . . . 0.0 109.617 175.114 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 6.2 pm0 -60.63 -24.76 65.78 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -68.48 -15.69 63.63 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.584 0.754 . . . . 0.0 113.034 177.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 91.2 m -59.9 -60.13 4.32 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.764 0.826 . . . . 0.0 110.028 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.35 -29.37 68.85 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.157 0.983 . . . . 0.0 112.956 174.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 18.2 m -69.26 -33.92 73.98 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -90.18 -28.07 19.15 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.062 0.945 . . . . 0.0 112.985 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -44.76 -60.13 2.18 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 126.761 2.024 . . . . 0.0 113.932 -176.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -68.03 -10.24 52.16 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -171.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.67 -56.59 2.36 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -176.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 53.2 mt -119.99 11.4 11.74 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 -171.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.0 139.1 34.0 Favored Pre-proline 0 CA--C 1.552 1.03 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -177.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -72.95 164.69 34.87 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 124.663 3.575 . . . . 0.0 114.34 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -69.16 -11.78 61.1 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 178.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -122.78 118.91 29.11 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.19 1.396 . . . . 0.0 111.036 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 5.1 p30 -150.77 170.75 18.48 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 125.855 1.662 . . . . 0.0 110.907 177.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 33.4 m -111.81 11.09 8.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 N-CA-C 115.345 1.609 . . . . 0.0 115.345 -176.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 34.4 tp -110.23 -18.52 13.27 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 -176.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 47.1 m -42.31 105.41 0.41 Allowed Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 125.853 1.661 . . . . 0.0 114.795 -178.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -86.09 145.17 8.54 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 123.418 2.745 . . . . 0.0 111.567 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 83.2 mt -86.87 151.67 52.58 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 123.709 0.804 . . . . 0.0 112.314 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -55.2 -31.5 76.28 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.303 2.669 . . . . 0.0 113.95 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 15.8 m -67.13 -15.15 63.53 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.583 1.153 . . . . 0.0 113.152 176.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -108.05 0.33 21.69 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.557 2.343 . . . . 0.0 111.94 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -69.54 157.13 37.75 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -97.49 25.96 5.31 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 129.506 3.122 . . . . 0.0 112.917 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 38.5 t70 -66.19 -15.09 62.86 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.62 1.568 . . . . 0.0 114.555 -177.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 37.4 t70 -67.0 -14.55 63.01 Favored 'General case' 0 CA--C 1.551 1.003 0 O-C-N 120.764 -1.21 . . . . 0.0 112.566 175.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 27.8 tp -119.3 16.5 13.1 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.48 2.312 . . . . 0.0 112.195 -179.114 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.85 137.85 56.9 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -174.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -125.03 139.37 53.87 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 128.088 2.555 . . . . 0.0 111.994 -179.032 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 73.8 p -64.79 146.29 98.62 Favored Pre-proline 0 N--CA 1.473 0.725 0 C-N-CA 124.109 0.963 . . . . 0.0 113.237 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -60.79 -30.26 89.86 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.816 2.344 . . . . 0.0 114.393 -177.122 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.27 -22.57 66.31 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.526 -0.734 . . . . 0.0 112.623 176.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 13.6 t70 -90.06 -9.85 46.95 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 84.7 mt -55.92 -37.81 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-N 119.638 1.108 . . . . 0.0 111.035 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -64.07 -9.73 18.02 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.133 1.373 . . . . 0.0 113.961 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.4 tp60 -77.43 -37.87 50.8 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.079 -1.013 . . . . 0.0 111.323 174.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -88.18 -49.98 6.66 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.486 0.714 . . . . 0.0 111.979 178.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -92.81 109.76 21.19 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 103.316 -2.846 . . . . 0.0 103.316 169.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -72.77 112.55 8.91 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -171.077 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -78.14 147.31 34.64 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.264 1.026 . . . . 0.0 109.481 175.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -61.08 119.69 47.62 Favored Pre-proline 0 CA--C 1.551 0.989 0 O-C-N 121.144 -0.972 . . . . 0.0 112.196 -177.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -81.71 -6.18 12.46 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.508 2.805 . . . . 0.0 114.373 -178.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 67.07 -137.58 33.74 Favored Glycine 0 CA--C 1.542 1.758 0 O-C-N 121.307 -0.871 . . . . 0.0 111.714 -177.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -71.61 -19.29 28.24 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.251 2.634 . . . . 0.0 113.462 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 26.9 t0 -88.75 48.1 1.59 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.536 1.534 . . . . 0.0 112.121 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -66.27 4.17 2.86 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.967 1.746 . . . . 0.0 117.18 -177.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 33.3 m -54.78 -29.48 54.34 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.464 1.632 . . . . 0.0 113.979 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 82.1 m -60.62 -25.03 65.98 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.788 1.235 . . . . 0.0 113.482 178.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -58.82 -28.5 66.08 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.168 0.895 . . . . 0.0 112.648 177.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -65.52 -28.16 68.98 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 121.344 -0.848 . . . . 0.0 112.139 176.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -92.21 -37.82 5.85 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 125.035 1.302 . . . . 0.0 113.954 178.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 73.7 p -79.81 -17.32 53.62 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -178.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -60.53 -6.34 1.58 Allowed 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.815 1.783 . . . . 0.0 115.815 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 41.0 p -67.25 -22.25 65.68 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.564 1.146 . . . . 0.0 112.846 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 136.15 84.29 0.17 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 125.398 1.475 . . . . 0.0 112.647 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.4 -43.05 49.45 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.785 2.99 . . . . 0.0 113.177 -178.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 69.1 p -121.17 -4.9 9.48 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.599 1.56 . . . . 0.0 113.317 177.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -87.16 -21.57 25.86 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -178.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 9.7 t70 -85.99 128.95 56.05 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 123.735 0.814 . . . . 0.0 111.78 -179.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -54.06 -33.58 74.13 Favored 'Trans proline' 0 C--N 1.351 0.672 0 C-N-CA 123.377 2.718 . . . . 0.0 114.592 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -68.39 -21.62 64.68 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.099 0.959 . . . . 0.0 112.662 178.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -90.04 -43.99 10.15 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.083 1.353 . . . . 0.0 110.465 173.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -53.64 -44.3 69.47 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.092 0.957 . . . . 0.0 112.16 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -63.5 -30.98 72.02 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 177.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 75.9 mt -70.14 -40.93 74.5 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.618 0.767 . . . . 0.0 110.031 175.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.5 mt -60.65 -50.78 79.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.19 -53.18 57.04 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.413 1.085 . . . . 0.0 111.516 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -35.45 79.56 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -69.41 -46.77 66.05 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.951 0.796 . . . . 0.0 110.865 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.7 tt -58.81 -43.1 90.51 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.034 0.934 . . . . 0.0 110.379 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 60.2 t -61.56 -31.81 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.979 0.809 . . . . 0.0 111.515 175.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 33.6 tp -67.02 -37.55 84.34 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.606 -1.309 . . . . 0.0 111.976 174.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.93 -25.57 63.58 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 119.326 0.966 . . . . 0.0 110.955 176.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 7.0 mt -74.07 -55.12 6.49 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.734 0.814 . . . . 0.0 109.737 176.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 14.2 t60 -56.96 -50.48 72.51 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 119.192 -0.432 . . . . 0.0 110.898 178.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -60.01 -22.53 62.71 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -178.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -90.14 -31.06 17.25 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.975 -1.078 . . . . 0.0 112.927 173.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 58.1 mttm -80.09 -40.01 28.45 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.104 1.362 . . . . 0.0 112.6 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.5 t -63.06 -45.79 90.53 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.527 1.931 . . . . 0.0 111.44 177.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -61.19 -37.11 81.76 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.292 -0.88 . . . . 0.0 111.783 175.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.79 -43.55 79.47 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.425 1.09 . . . . 0.0 110.8 176.549 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -60.0 -42.43 94.24 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.897 1.679 . . . . 0.0 111.249 176.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -66.07 -47.74 73.27 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.777 0.831 . . . . 0.0 110.795 176.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -61.6 -37.49 84.11 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.856 1.262 . . . . 0.0 112.694 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -65.56 -33.09 75.1 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.464 1.105 . . . . 0.0 113.123 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -88.8 -50.3 6.31 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.119 0.967 . . . . 0.0 112.092 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 71.95 -2.03 28.29 Favored Glycine 0 CA--C 1.54 1.633 0 N-CA-C 117.011 1.564 . . . . 0.0 117.011 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -120.21 4.81 10.8 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 119.562 1.681 . . . . 0.0 113.932 -178.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 32.9 m -128.62 161.91 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 125.753 1.621 . . . . 0.0 112.417 179.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 41.1 ptt180 -93.8 170.1 9.81 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.62 1.568 . . . . 0.0 112.072 177.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -70.58 174.84 5.37 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.502 1.121 . . . . 0.0 113.048 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 22.4 p -68.83 174.88 3.98 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.362 1.865 . . . . 0.0 114.583 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 22.2 m -84.75 -1.35 56.17 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 115.113 1.523 . . . . 0.0 115.113 -177.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 62.2 tp -84.89 113.33 49.12 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 125.093 1.357 . . . . 0.0 110.836 -178.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -63.64 -31.73 69.76 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.325 2.017 . . . . 0.0 114.102 -177.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 35.9 m80 -70.56 -23.36 62.59 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 40.4 t -62.32 -46.74 87.35 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.27 1.028 . . . . 0.0 109.91 176.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -54.92 -35.22 63.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.36 1.464 . . . . 0.0 112.146 175.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 49.3 m -72.07 -60.18 2.36 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.614 0.765 . . . . 0.0 110.807 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 15.6 mmt -60.34 -34.03 73.25 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -64.88 -33.58 76.35 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 120.566 1.53 . . . . 0.0 112.675 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -72.14 -37.91 69.34 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.131 0.572 . . . . 0.0 110.197 174.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 66.9 t -62.45 -46.61 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 122.948 0.499 . . . . 0.0 110.696 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.0 -43.7 98.5 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.975 0.91 . . . . 0.0 111.799 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -64.86 -32.89 74.81 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 176.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 61.0 t60 -75.04 -52.07 11.99 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.728 0.811 . . . . 0.0 110.204 175.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 40.6 ttp -56.73 -31.16 64.26 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.524 1.93 . . . . 0.0 114.304 -177.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.7 t -77.98 -9.94 59.35 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 120.059 1.3 . . . . 0.0 112.99 176.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -118.93 -14.0 9.43 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.749 1.619 . . . . 0.0 113.916 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 43.5 t -56.61 144.65 31.16 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.684 1.594 . . . . 0.0 113.045 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -96.71 -13.84 22.45 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.003 1.721 . . . . 0.0 113.588 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -118.7 -30.68 5.05 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.268 1.027 . . . . 0.0 113.558 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.21 -107.58 0.6 Allowed Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.717 1.151 . . . . 0.0 113.436 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -61.62 -20.59 63.52 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 121.053 -1.263 . . . . 0.0 112.945 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -100.51 1.52 41.11 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.062 1.745 . . . . 0.0 113.561 176.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.5 t -63.54 139.86 58.81 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.262 1.025 . . . . 0.0 110.013 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -81.44 0.14 38.98 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -175.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 16.6 t -90.49 125.3 43.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.732 1.213 . . . . 0.0 109.159 176.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.38 -28.1 51.83 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -175.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -90.06 -18.63 25.57 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.686 1.735 . . . . 0.0 115.686 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 52.7 t -83.17 -59.86 2.33 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.126 1.37 . . . . 0.0 111.076 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.02 -29.53 65.38 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 4.7 p -73.57 -54.92 7.06 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 124.958 1.303 . . . . 0.0 111.822 176.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 53.0 m -59.4 -34.68 72.74 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.47 0.708 . . . . 0.0 111.692 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 45.1 tpt85 -62.86 -30.02 71.2 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.229 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -67.78 -34.7 77.31 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.307 0.958 . . . . 0.0 110.963 175.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 10.2 mt -67.82 -45.64 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 124.15 0.98 . . . . 0.0 109.731 176.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 15.0 mm -60.76 -36.74 73.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.918 0.887 . . . . 0.0 111.229 176.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.14 -21.17 66.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 177.055 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.0 t60 -64.11 -59.97 3.8 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.422 1.01 . . . . 0.0 110.726 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 62.4 m95 -60.62 -26.95 67.39 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 63.4 mttm -71.5 -34.76 70.41 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.831 0.852 . . . . 0.0 112.787 178.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.14 -32.31 10.97 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 178.361 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 9.6 t -78.21 133.78 37.69 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.444 1.498 . . . . 0.0 111.996 -178.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 71.5 p -130.09 -1.04 4.64 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.335 1.454 . . . . 0.0 114.492 -178.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -80.14 150.26 30.27 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.738 1.215 . . . . 0.0 112.685 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.1 p-80 -84.37 -36.13 22.69 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.329 0.652 . . . . 0.0 111.569 175.216 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.8 t0 -94.19 70.05 3.8 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.069 1.748 . . . . 0.0 111.854 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 47.7 t -122.99 134.2 24.94 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 126.329 1.852 . . . . 0.0 109.524 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -58.33 -25.64 73.68 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.927 2.418 . . . . 0.0 114.36 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 39.3 t -92.12 -52.55 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 119.209 0.913 . . . . 0.0 111.65 176.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 7.8 m -69.73 -36.97 76.31 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -175.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -57.36 -57.12 27.26 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 117.625 -1.178 . . . . 0.0 112.337 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -59.94 -30.9 92.82 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.778 1.652 . . . . 0.0 113.197 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 94.5 mt -70.28 -47.02 63.1 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.183 0.901 . . . . 0.0 111.869 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -63.64 -37.97 89.36 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.725 0.693 . . . . 0.0 110.635 176.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 34.3 t30 -65.47 -36.55 84.23 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.638 1.175 . . . . 0.0 112.267 176.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -79.32 -29.57 42.4 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.304 1.041 . . . . 0.0 113.325 178.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 28.3 t -67.84 134.37 50.78 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -177.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 34.9 t70 -100.74 1.32 40.25 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.853 1.261 . . . . 0.0 111.657 175.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -76.77 -7.16 54.87 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.649 1.58 . . . . 0.0 113.813 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 . . . . . 0 N--CA 1.477 0.924 0 C-N-CA 126.509 1.924 . . . . 0.0 111.998 178.452 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.375 0 CA-C-O 121.273 0.374 . . . . 0.0 113.994 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.7 p -81.29 155.29 26.12 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.891 1.276 . . . . 0.0 113.067 179.357 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 65.5 m80 -138.65 161.95 35.86 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.818 1.647 . . . . 0.0 111.865 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 76.9 mtm -133.25 157.02 46.48 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.537 1.535 . . . . 0.0 111.669 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -91.49 -23.32 20.01 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.894 1.278 . . . . 0.0 113.53 178.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -60.36 -46.21 97.56 Favored Pre-proline 0 CA--C 1.552 1.028 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -76.76 2.46 7.45 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 122.797 2.331 . . . . 0.0 114.379 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -86.38 12.66 9.64 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.008 1.323 . . . . 0.0 113.867 -178.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 64.9 p -66.45 158.95 28.16 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.441 1.496 . . . . 0.0 113.934 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -105.13 151.52 39.55 Favored Pre-proline 0 N--CA 1.469 0.508 0 C-N-CA 125.56 1.544 . . . . 0.0 112.997 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -63.47 121.18 8.87 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 122.83 2.354 . . . . 0.0 109.235 177.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 50.2 m -19.92 103.87 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 129.876 3.271 . . . . 0.0 114.865 -175.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 11.8 p -141.58 149.66 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 126.856 2.063 . . . . 0.0 110.78 -177.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -99.36 113.82 65.11 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.373 1.069 . . . . 0.0 111.421 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.42 -45.93 31.14 Favored 'Trans proline' 0 CA--C 1.549 1.251 0 C-N-CA 122.955 2.437 . . . . 0.0 115.185 178.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -85.83 162.58 10.52 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.217 2.611 . . . . 0.0 112.151 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 8.7 tt -98.48 132.3 44.03 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.174 0.99 . . . . 0.0 111.196 177.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 32.7 t -93.64 146.31 23.92 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.606 1.162 . . . . 0.0 110.967 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 9.4 pm0 -55.55 -27.98 52.21 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 -178.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -66.33 -19.3 65.77 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 6.2 m -63.57 -58.29 7.43 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.064 0.946 . . . . 0.0 110.832 -179.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -60.24 -31.14 69.92 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.527 0.731 . . . . 0.0 112.49 176.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 49.0 m -69.86 -29.32 66.52 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.863 0.756 . . . . 0.0 112.871 177.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.0 t70 -90.17 -29.76 18.05 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.776 1.231 . . . . 0.0 113.23 176.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.1 tt -45.49 -60.0 2.41 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.943 2.097 . . . . 0.0 113.42 -177.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.0 p-90 -69.6 -10.49 58.41 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -173.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -109.6 -53.77 2.63 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 115.748 1.759 . . . . 0.0 115.748 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 59.6 mt -119.9 11.61 11.86 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 116.263 1.949 . . . . 0.0 116.263 -172.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 7.0 tt -57.37 127.07 76.46 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 124.249 1.019 . . . . 0.0 111.279 178.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -76.55 171.05 18.76 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 124.056 3.171 . . . . 0.0 112.963 -178.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -69.24 11.21 0.24 Allowed 'General case' 0 CA--C 1.551 1.005 0 N-CA-C 116.784 2.142 . . . . 0.0 116.784 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 48.5 t30 -145.54 129.84 17.69 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.967 1.707 . . . . 0.0 110.019 177.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -150.36 159.65 44.3 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.365 1.066 . . . . 0.0 112.371 179.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 94.5 t -73.27 -35.92 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 124.887 1.275 . . . . 0.0 111.957 178.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 38.8 tp -83.96 109.57 17.73 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.494 0.718 . . . . 0.0 109.451 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 74.8 m -115.06 99.99 53.04 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 125.285 1.434 . . . . 0.0 110.634 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -62.16 150.7 85.77 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 123.74 2.96 . . . . 0.0 113.346 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 88.0 mt -134.83 115.22 12.18 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.96 1.304 . . . . 0.0 111.191 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -53.46 -31.8 59.84 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.928 3.086 . . . . 0.0 115.072 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 16.7 m -61.26 -17.16 52.09 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.074 1.35 . . . . 0.0 114.511 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -133.67 17.17 3.93 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.902 1.681 . . . . 0.0 112.913 179.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -79.83 157.2 27.08 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.598 1.159 . . . . 0.0 113.961 -178.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.24 20.85 3.05 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 127.064 2.145 . . . . 0.0 113.822 178.262 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -64.32 -18.6 64.77 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 -176.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 35.7 t70 -63.78 -18.05 63.69 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.937 0.895 . . . . 0.0 113.265 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 98.5 mt -99.64 5.31 45.87 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.102 1.761 . . . . 0.0 113.764 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 71.6 mmm -62.39 151.49 36.81 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.09 168.0 14.0 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.874 2.07 . . . . 0.0 110.866 178.38 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 59.4 m -75.49 145.6 79.51 Favored Pre-proline 0 CA--C 1.546 0.825 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 169.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -57.02 -18.66 29.35 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.755 2.303 . . . . 0.0 115.527 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -77.16 -24.29 51.52 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.531 1.133 . . . . 0.0 112.723 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 18.5 t70 -81.84 -9.91 59.47 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.028 0.931 . . . . 0.0 113.221 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 67.7 mt -55.88 -35.24 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.277 1.431 . . . . 0.0 110.283 175.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -67.06 -9.87 43.87 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.784 1.634 . . . . 0.0 113.643 178.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -82.28 -27.04 32.59 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.034 0.934 . . . . 0.0 111.7 176.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.3 p-90 -98.6 -42.27 7.34 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 118.106 -0.95 . . . . 0.0 112.316 176.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -96.91 109.89 22.52 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 169.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.32 151.01 46.6 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.322 1.049 . . . . 0.0 113.489 -175.154 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -101.22 153.47 19.59 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.115 1.366 . . . . 0.0 109.645 173.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 9.3 t0 -65.58 123.01 83.39 Favored Pre-proline 0 CA--C 1.554 1.112 0 O-C-N 121.238 -0.914 . . . . 0.0 111.693 -178.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -84.79 -4.03 9.85 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.98 3.12 . . . . 0.0 114.788 -176.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 89.3 -147.13 19.38 Favored Glycine 0 CA--C 1.544 1.855 0 C-N-CA 125.108 1.337 . . . . 0.0 113.045 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.84 -1.42 11.37 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 124.523 3.482 . . . . 0.0 115.173 -177.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 32.4 t70 -132.53 149.83 52.26 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.803 1.641 . . . . 0.0 111.387 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 77.98 -3.26 61.83 Favored Glycine 0 CA--C 1.538 1.503 0 C-N-CA 124.468 1.032 . . . . 0.0 115.503 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 53.5 p -81.42 20.82 0.83 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.524 1.93 . . . . 0.0 113.888 178.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 60.4 m -59.47 -19.55 48.63 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 127.164 2.186 . . . . 0.0 114.898 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -132.37 151.19 51.97 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.99 1.716 . . . . 0.0 110.047 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 45.1 p-10 -59.36 -38.67 81.02 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 120.887 -1.133 . . . . 0.0 112.262 178.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -61.52 -42.06 99.69 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.866 1.222 . . . . 0.0 113.156 177.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 82.8 p -80.15 -29.87 38.87 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 118.467 1.134 . . . . 0.0 112.478 177.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -71.22 -43.73 66.77 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.229 1.412 . . . . 0.0 114.182 -179.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 5.4 t -152.11 -3.33 0.26 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 115.929 1.826 . . . . 0.0 115.929 -177.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 58.81 57.59 19.07 Favored Glycine 0 CA--C 1.543 1.829 0 CA-C-N 119.57 1.077 . . . . 0.0 114.606 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -69.63 143.55 51.83 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 123.359 2.706 . . . . 0.0 112.76 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 74.0 p -95.93 7.64 45.81 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 126.046 1.739 . . . . 0.0 113.896 -179.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -73.23 -21.35 60.66 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.073 1.349 . . . . 0.0 114.414 -178.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 9.5 t70 -85.22 126.6 66.91 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 123.862 0.865 . . . . 0.0 111.432 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -64.36 -30.89 63.0 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.867 2.378 . . . . 0.0 113.927 -178.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -67.84 -23.63 65.18 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.045 0.938 . . . . 0.0 111.905 177.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -90.01 -49.72 6.43 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.095 1.358 . . . . 0.0 109.988 174.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -50.24 -43.76 53.1 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.77 1.628 . . . . 0.0 113.018 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -61.7 -32.61 72.83 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 177.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 83.2 mt -71.72 -39.34 70.18 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.345 1.058 . . . . 0.0 110.985 177.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 3.0 mt -62.79 -52.45 59.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.343 0.657 . . . . 0.0 109.583 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -56.18 -58.26 8.71 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.634 1.174 . . . . 0.0 111.218 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -35.78 81.72 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -177.447 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -65.62 -43.07 90.7 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.802 1.183 . . . . 0.0 110.332 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 8.0 tp -62.06 -39.89 93.92 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.25 0.62 . . . . 0.0 110.627 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 63.3 t -60.86 -34.3 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.131 0.878 . . . . 0.0 110.802 174.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 3.4 tp -71.48 -27.77 63.48 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 120.286 1.403 . . . . 0.0 112.853 175.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.9 mp -63.51 -29.2 70.51 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 120.523 1.51 . . . . 0.0 109.63 173.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.1 mt -75.55 -51.39 13.02 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.99 0.916 . . . . 0.0 108.739 174.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 30.6 t60 -53.31 -55.9 20.94 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 123.652 0.781 . . . . 0.0 110.827 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.97 -41.97 65.07 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.09 0.956 . . . . 0.0 113.338 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -72.34 -42.65 65.12 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.537 -0.727 . . . . 0.0 112.399 178.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 56.1 mttm -71.01 -36.47 72.43 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.638 1.175 . . . . 0.0 112.229 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 12.0 t -67.69 -41.44 83.61 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.44 1.896 . . . . 0.0 109.834 175.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -58.76 -43.55 90.35 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.357 1.063 . . . . 0.0 110.347 172.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 20.1 mmt180 -67.45 -36.13 80.59 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.356 -0.84 . . . . 0.0 113.02 175.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.35 -35.64 70.18 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.603 1.161 . . . . 0.0 110.914 174.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -77.81 -45.9 23.12 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 122.96 0.504 . . . . 0.0 110.944 175.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 16.4 tp60 -58.36 -33.05 69.13 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.782 0.833 . . . . 0.0 112.907 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -73.01 -10.02 59.35 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.625 1.17 . . . . 0.0 113.898 177.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -118.03 -48.4 2.55 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.561 1.544 . . . . 0.0 113.062 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 76.65 -1.55 61.61 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 117.387 1.715 . . . . 0.0 117.387 177.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -120.22 -32.02 4.25 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 120.046 1.923 . . . . 0.0 114.431 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 28.5 m -71.05 155.47 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -81.79 160.49 23.55 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.094 1.358 . . . . 0.0 111.562 176.053 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -74.4 175.04 8.07 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -177.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 2.2 t -56.94 155.18 8.37 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 127.256 2.223 . . . . 0.0 114.372 -178.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 11.1 t -76.26 -22.4 55.17 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.837 1.255 . . . . 0.0 112.794 178.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 38.4 mt -77.87 131.08 71.17 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 123.843 0.857 . . . . 0.0 113.005 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.09 -33.25 19.57 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 122.396 2.064 . . . . 0.0 110.551 175.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 41.2 m80 -66.57 -33.11 74.94 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.893 1.277 . . . . 0.0 113.032 178.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 40.7 t -67.55 -51.92 44.95 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.012 1.325 . . . . 0.0 109.678 177.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -57.15 -38.77 74.03 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.7 1.2 . . . . 0.0 111.123 174.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.9 m -65.98 -57.06 8.66 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.465 1.106 . . . . 0.0 111.596 177.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 15.0 mmt -63.41 -37.07 85.86 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 118.235 -0.888 . . . . 0.0 113.147 -177.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -65.34 -32.69 74.46 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 121.143 1.792 . . . . 0.0 112.084 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -69.92 -38.93 76.38 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.911 -0.493 . . . . 0.0 110.777 173.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 89.0 t -64.66 -42.73 95.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 118.791 0.723 . . . . 0.0 110.436 175.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.47 -45.98 84.21 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.344 1.057 . . . . 0.0 110.374 176.525 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -66.07 -21.54 66.37 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 177.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 60.3 t60 -86.43 -49.56 7.53 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.64 0.776 . . . . 0.0 109.697 174.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -58.31 -27.44 64.1 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.254 1.822 . . . . 0.0 113.532 -177.511 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 19.4 p -72.34 -26.54 61.96 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.519 1.128 . . . . 0.0 112.618 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 80.3 t60 -102.36 -21.83 14.22 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.06 1.744 . . . . 0.0 113.523 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 25.0 t -57.71 143.06 43.13 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.281 1.432 . . . . 0.0 113.144 -177.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -107.88 -15.7 14.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.999 1.72 . . . . 0.0 113.418 -178.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -103.23 -32.82 9.42 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.561 1.144 . . . . 0.0 112.281 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.56 -105.87 0.26 Allowed Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.979 1.276 . . . . 0.0 113.869 177.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -59.15 -22.13 60.45 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.31 -1.112 . . . . 0.0 112.943 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -102.59 1.78 35.24 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.398 1.879 . . . . 0.0 113.828 177.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 19.5 t -62.32 141.49 58.26 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.216 1.006 . . . . 0.0 110.575 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -81.74 -5.46 58.16 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.324 1.05 . . . . 0.0 113.333 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 97.8 t -86.86 115.57 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 172.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.09 -39.59 69.47 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -176.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.34 -40.89 96.78 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.659 0.784 . . . . 0.0 112.552 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.2 t -65.25 -57.16 9.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.469 1.508 . . . . 0.0 110.818 178.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -61.1 -27.65 68.52 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 68.5 m -76.85 -45.27 29.03 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.381 -0.825 . . . . 0.0 111.198 175.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 64.0 m -62.84 -35.98 81.71 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.239 1.016 . . . . 0.0 111.554 176.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 3.3 mmm-85 -61.81 -30.39 70.79 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -68.37 -29.56 68.3 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.363 0.983 . . . . 0.0 111.243 176.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 1.8 mm -73.28 -47.01 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 176.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 24.6 mm -61.15 -37.99 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.947 1.299 . . . . 0.0 111.571 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 49.1 m -62.78 -21.28 65.75 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.961 0.904 . . . . 0.0 113.222 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.6 t60 -66.24 -60.47 2.76 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.334 0.97 . . . . 0.0 110.448 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 67.2 m95 -59.6 -28.99 67.66 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 89.7 mttt -67.79 -36.09 79.83 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.652 0.781 . . . . 0.0 113.03 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.18 -31.82 11.2 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.1 t -79.22 135.19 36.71 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.198 1.399 . . . . 0.0 112.165 -177.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.7 p -130.1 -2.27 4.56 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.248 1.419 . . . . 0.0 114.644 -177.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -81.75 149.83 28.23 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.736 1.214 . . . . 0.0 112.876 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -84.56 -30.99 24.61 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.549 0.739 . . . . 0.0 111.493 174.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.3 t0 -97.33 69.93 2.28 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.228 1.811 . . . . 0.0 111.346 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.9 t -126.14 135.02 26.54 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 126.296 1.839 . . . . 0.0 109.723 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -57.76 -25.64 69.53 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 123.049 2.499 . . . . 0.0 114.606 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 14.7 t -92.23 -50.89 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 119.48 1.036 . . . . 0.0 111.795 176.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 6.9 m -70.44 -40.28 73.87 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -174.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.4 tt -54.43 -55.94 32.07 Favored Pre-proline 0 CA--C 1.547 0.862 0 CA-C-O 117.825 -1.083 . . . . 0.0 112.854 -178.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -60.92 -30.27 89.66 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.761 1.641 . . . . 0.0 113.454 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.88 -44.17 66.87 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.41 1.004 . . . . 0.0 111.645 177.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -64.97 -31.12 72.2 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.7 0.8 . . . . 0.0 111.35 175.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 32.4 t30 -75.98 -37.13 58.87 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.057 1.343 . . . . 0.0 112.074 176.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -74.45 -42.27 59.37 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.565 1.146 . . . . 0.0 113.53 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 10.6 t -85.59 157.6 20.33 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 122.093 0.949 . . . . 0.0 113.368 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 30.6 t70 -134.81 14.62 3.64 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.685 1.994 . . . . 0.0 111.099 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 22.0 pttm -74.02 -13.24 60.83 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 116.114 1.894 . . . . 0.0 116.114 -175.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 . . . . . 0 N--CA 1.476 0.85 0 C-N-CA 126.45 1.9 . . . . 0.0 110.857 177.769 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.611 0 N-CA-C 115.116 0.807 . . . . 0.0 115.116 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.3 t -149.43 149.06 30.2 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.585 1.554 . . . . 0.0 111.73 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -61.4 -24.22 66.36 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.839 0.856 . . . . 0.0 112.208 176.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 14.7 tpt -63.28 -22.54 66.94 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.567 1.147 . . . . 0.0 112.435 176.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -90.82 -3.43 57.39 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.221 1.408 . . . . 0.0 113.236 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -75.74 133.47 73.31 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 124.452 1.101 . . . . 0.0 111.79 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.05 103.15 1.33 Allowed 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.138 2.559 . . . . 0.0 112.084 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 46.2 mm-40 -130.76 4.1 4.54 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.7 1.6 . . . . 0.0 113.331 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 31.5 m -80.71 162.65 24.04 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.272 1.429 . . . . 0.0 112.779 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -137.34 148.69 63.02 Favored Pre-proline 0 CA--C 1.546 0.791 0 C-N-CA 125.521 1.528 . . . . 0.0 111.264 178.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -70.36 -17.05 35.11 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.131 2.554 . . . . 0.0 113.54 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 16.3 m -78.94 -0.2 30.01 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.699 1.6 . . . . 0.0 114.784 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 10.4 p -138.03 148.28 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 124.96 1.304 . . . . 0.0 112.144 -179.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -152.14 158.51 33.68 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 125.717 1.607 . . . . 0.0 111.696 178.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -102.71 77.99 0.03 OUTLIER 'Trans proline' 0 CA--C 1.557 1.636 0 C-N-CA 125.289 3.993 . . . . 0.0 112.327 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -70.29 156.08 62.75 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.764 2.309 . . . . 0.0 113.453 -179.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 42.2 tp -68.83 138.4 54.73 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.788 1.235 . . . . 0.0 110.463 176.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 17.4 t -93.87 150.92 19.96 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.448 0.699 . . . . 0.0 112.041 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -62.26 -25.86 68.07 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -87.87 -10.74 49.82 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 85.9 m -60.49 -58.42 8.56 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.287 0.949 . . . . 0.0 110.684 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -60.01 -27.09 66.59 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.6 0.76 . . . . 0.0 112.71 176.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 45.5 m -74.79 -30.62 61.5 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.931 0.892 . . . . 0.0 113.06 178.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.2 t70 -90.12 -29.38 18.34 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.581 1.152 . . . . 0.0 112.878 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -43.31 -60.15 1.81 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 127.515 2.326 . . . . 0.0 113.933 -177.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 51.7 p-90 -68.59 -9.79 51.87 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 -172.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -111.96 -56.83 2.34 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 -177.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 63.9 mt -120.02 14.26 12.3 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -170.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.8 tt -53.76 137.35 54.13 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 125.795 1.638 . . . . 0.0 113.842 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -78.26 165.68 25.38 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 124.197 3.265 . . . . 0.0 114.019 -178.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -65.58 -21.66 66.61 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.876 1.436 . . . . 0.0 114.876 -179.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -87.73 12.71 12.12 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -71.02 143.16 50.85 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 119.51 1.05 . . . . 0.0 112.458 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -130.67 17.09 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 124.9 1.28 . . . . 0.0 113.612 -177.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 8.0 tt -81.8 -15.45 54.12 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 120.405 -1.434 . . . . 0.0 113.741 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 5.9 t -57.58 129.21 80.65 Favored Pre-proline 0 CA--C 1.543 0.679 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -175.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.71 142.5 28.93 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 122.958 2.439 . . . . 0.0 110.066 174.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 88.4 mt -68.86 157.69 88.17 Favored Pre-proline 0 CA--C 1.547 0.836 0 O-C-N 121.636 -0.665 . . . . 0.0 111.792 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -55.29 -28.13 60.86 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 123.066 2.511 . . . . 0.0 114.174 178.439 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 44.0 p -77.63 -21.43 52.26 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.646 1.578 . . . . 0.0 113.191 175.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -95.4 -26.32 15.91 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.757 2.023 . . . . 0.0 111.961 178.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -59.84 139.29 57.44 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.178 1.391 . . . . 0.0 112.283 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 66.7 mtm -82.51 49.11 1.39 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.514 1.525 . . . . 0.0 113.75 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 38.7 t70 -73.13 -20.59 60.89 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.293 1.037 . . . . 0.0 112.678 178.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 37.4 t70 -68.59 -14.52 63.07 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 121.078 -1.013 . . . . 0.0 112.455 176.184 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 25.3 tp -119.26 16.67 13.14 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 127.477 2.311 . . . . 0.0 111.626 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.1 141.58 57.4 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -175.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.3 tt -125.16 142.39 51.52 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 128.657 2.783 . . . . 0.0 111.158 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 40.7 t -66.44 142.69 97.85 Favored Pre-proline 0 N--CA 1.477 0.878 0 C-N-CA 124.088 0.955 . . . . 0.0 112.372 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.66 -21.4 47.01 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.76 2.306 . . . . 0.0 115.445 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.7 t70 -75.78 -24.81 56.02 Favored 'General case' 0 CA--C 1.549 0.921 0 O-C-N 121.395 -0.815 . . . . 0.0 112.164 176.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -83.79 -9.72 58.59 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.371 1.869 . . . . 0.0 112.569 177.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 85.2 mt -56.02 -31.15 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.429 1.013 . . . . 0.0 109.678 174.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -67.85 -9.87 48.28 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.011 1.324 . . . . 0.0 113.703 176.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -80.78 -25.14 38.1 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.089 1.356 . . . . 0.0 111.803 177.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 4.5 p-90 -106.95 -28.23 10.19 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.6 1.16 . . . . 0.0 113.455 177.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -114.85 109.79 18.69 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 104.792 -2.299 . . . . 0.0 104.792 169.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.84 140.08 33.12 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -169.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -113.63 179.97 3.81 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.162 2.185 . . . . 0.0 111.0 175.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.32 126.23 90.01 Favored Pre-proline 0 CA--C 1.556 1.192 0 O-C-N 120.641 -1.287 . . . . 0.0 110.602 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -74.81 -19.59 18.2 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.286 2.657 . . . . 0.0 115.298 -176.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 62.11 -160.42 30.99 Favored Glycine 0 CA--C 1.545 1.928 0 CA-C-N 119.24 0.927 . . . . 0.0 113.226 -177.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -78.27 -11.64 16.0 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 123.735 2.957 . . . . 0.0 114.703 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -109.87 -13.63 14.42 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -177.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -73.88 35.83 0.89 Allowed Glycine 0 N--CA 1.475 1.256 0 C-N-CA 125.506 1.527 . . . . 0.0 116.505 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 61.5 m -69.27 109.29 4.04 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.599 1.2 . . . . 0.0 108.686 176.292 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 28.4 p -72.57 158.66 35.26 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.66 1.355 . . . . 0.0 114.66 -175.333 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 24.9 p90 -151.87 160.49 43.52 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.629 1.972 . . . . 0.0 110.801 -176.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -56.13 -28.07 56.5 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 -177.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -68.51 -20.17 73.47 Favored Glycine 0 CA--C 1.54 1.598 0 C-N-CA 124.618 1.104 . . . . 0.0 114.499 177.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 11.1 t -110.55 -39.53 4.88 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.925 1.29 . . . . 0.0 110.948 175.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -87.53 51.63 2.28 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.452 1.501 . . . . 0.0 111.124 175.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 37.4 p -64.4 -24.42 67.63 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.843 1.257 . . . . 0.0 112.403 178.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -172.02 148.12 10.59 Favored Glycine 0 CA--C 1.539 1.588 0 C-N-CA 127.746 2.593 . . . . 0.0 109.78 176.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -60.79 165.71 11.38 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 123.275 2.65 . . . . 0.0 113.624 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 48.3 p -56.81 -24.14 48.74 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -85.23 -2.68 58.31 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 125.452 1.501 . . . . 0.0 114.316 177.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 14.1 t70 -73.55 141.45 79.77 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 124.726 1.21 . . . . 0.0 113.276 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -50.84 -34.78 46.48 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.81 3.006 . . . . 0.0 115.152 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.68 -25.07 66.38 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.1 0.96 . . . . 0.0 112.994 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 54.0 mttp -90.11 -38.92 13.2 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.891 1.276 . . . . 0.0 110.958 173.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -54.56 -46.05 73.59 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.22 0.918 . . . . 0.0 111.876 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -62.3 -30.16 70.95 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 177.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.49 -38.82 71.15 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.658 0.783 . . . . 0.0 110.649 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.6 mt -64.32 -53.14 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -53.17 -51.98 60.28 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.399 1.08 . . . . 0.0 111.461 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.53 -34.51 78.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -179.109 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -71.0 -49.62 43.19 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.815 0.734 . . . . 0.0 110.136 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.5 tt -58.0 -44.8 87.43 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.116 1.366 . . . . 0.0 111.178 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 88.5 t -59.57 -32.94 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 119.457 1.026 . . . . 0.0 111.662 176.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 4.4 tp -74.41 -24.45 59.1 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.847 1.203 . . . . 0.0 113.086 175.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.2 mp -62.77 -31.14 72.05 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 120.546 1.521 . . . . 0.0 109.08 171.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 5.6 mt -70.02 -53.19 18.73 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.123 0.969 . . . . 0.0 109.476 175.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.4 t60 -54.82 -56.04 23.68 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.09 0.556 . . . . 0.0 110.717 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.28 -27.23 54.63 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -86.78 -26.38 24.15 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.467 1.03 . . . . 0.0 113.392 176.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 43.9 mttm -89.94 -36.3 15.08 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.186 1.794 . . . . 0.0 112.683 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.3 t -61.68 -47.96 82.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.957 2.103 . . . . 0.0 111.273 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -56.37 -23.58 38.69 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 177.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -69.59 -28.65 66.13 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.45 1.1 . . . . 0.0 112.503 176.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -36.72 84.79 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.972 0.805 . . . . 0.0 112.291 -178.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -85.42 -37.57 19.66 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.253 1.021 . . . . 0.0 111.24 177.022 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 15.6 tp60 -64.35 -33.41 75.78 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.298 -0.876 . . . . 0.0 112.076 178.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -88.54 -16.2 33.22 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.878 1.271 . . . . 0.0 114.263 178.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 62.6 t-20 -147.04 113.5 5.96 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.296 1.038 . . . . 0.0 112.458 -177.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . -74.45 -7.72 79.12 Favored Glycine 0 CA--C 1.538 1.52 0 N-CA-C 115.844 1.098 . . . . 0.0 115.844 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -89.54 -0.6 57.62 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 119.176 1.488 . . . . 0.0 113.365 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 24.7 m -131.33 166.44 28.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 126.519 1.928 . . . . 0.0 111.561 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -129.13 153.48 47.64 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.328 1.451 . . . . 0.0 112.24 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -78.14 172.19 13.91 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.798 1.239 . . . . 0.0 112.569 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 10.4 m -52.65 147.16 8.99 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 -178.244 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 69.1 p -97.55 -7.72 30.67 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.803 2.041 . . . . 0.0 111.428 170.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 30.7 tp -57.73 113.87 7.25 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 128.276 2.63 . . . . 0.0 109.664 177.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -52.21 -40.4 69.5 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.233 2.622 . . . . 0.0 115.245 -176.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 55.4 m80 -70.33 -34.02 72.18 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.7 t -69.18 -50.72 45.03 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.763 1.225 . . . . 0.0 108.967 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 19.0 tpp85 -55.9 -36.15 67.34 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.412 1.485 . . . . 0.0 111.733 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 8.2 m -69.46 -57.59 5.05 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.145 1.378 . . . . 0.0 111.171 176.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.6 mmt -64.33 -35.48 80.99 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -177.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -63.94 -32.35 73.86 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 120.889 1.677 . . . . 0.0 112.359 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -72.32 -42.39 65.47 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.372 0.669 . . . . 0.0 110.46 174.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 76.8 t -60.51 -47.78 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 123.221 0.608 . . . . 0.0 110.797 176.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.18 -45.16 94.08 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.557 1.143 . . . . 0.0 112.377 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 24.4 m-80 -63.31 -33.59 75.85 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 177.292 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 66.9 t60 -75.24 -49.42 19.38 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.221 0.609 . . . . 0.0 110.827 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.7 ttp -57.37 -31.21 65.55 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.93 1.692 . . . . 0.0 114.286 -176.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 13.1 t -77.85 -14.41 59.57 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.974 1.261 . . . . 0.0 112.535 176.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 84.3 t60 -99.86 -29.39 12.62 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.771 1.628 . . . . 0.0 111.774 175.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 19.0 t -60.78 152.38 27.14 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.548 1.939 . . . . 0.0 112.513 179.081 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -127.44 -10.46 5.72 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.381 1.472 . . . . 0.0 114.024 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -92.28 -25.23 18.69 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.071 0.948 . . . . 0.0 112.593 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 55.15 -115.64 5.91 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.259 0.933 . . . . 0.0 112.582 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 62.7 tttp -60.63 -21.28 62.57 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.356 -1.085 . . . . 0.0 112.998 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.07 -1.66 57.75 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.753 1.221 . . . . 0.0 113.628 177.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.9 t -64.65 141.49 58.75 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.056 0.932 . . . . 0.0 109.83 177.439 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -80.48 -5.21 56.28 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 90.4 t -89.51 113.69 26.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.64 -40.82 66.14 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -176.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -67.62 -30.46 70.04 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.63 1.172 . . . . 0.0 113.609 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.5 t -74.18 -55.53 5.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.068 1.347 . . . . 0.0 109.257 177.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.34 -25.81 66.1 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 85.1 p -81.72 -49.26 10.66 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.34 0.973 . . . . 0.0 111.852 175.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 50.1 m -60.07 -34.49 73.51 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.462 0.705 . . . . 0.0 112.234 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 48.0 tpt85 -61.1 -29.92 70.04 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.464 -0.772 . . . . 0.0 113.028 177.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -69.95 -33.31 71.94 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.712 0.805 . . . . 0.0 110.974 176.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 16.8 mt -69.03 -43.88 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 124.638 1.175 . . . . 0.0 109.373 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 16.9 mm -62.85 -38.12 81.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 123.993 0.917 . . . . 0.0 110.793 174.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 5.6 t -62.44 -27.38 69.06 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.131 0.972 . . . . 0.0 112.65 177.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.9 t60 -60.81 -55.95 26.99 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.292 0.951 . . . . 0.0 111.011 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 43.7 m95 -61.96 -28.72 69.75 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 92.3 mttt -73.3 -28.0 61.85 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.143 0.977 . . . . 0.0 112.794 178.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -100.09 -38.58 8.49 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.5 t -76.7 134.6 39.18 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.787 1.635 . . . . 0.0 112.835 -176.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.5 p -130.07 -0.51 4.67 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.535 1.534 . . . . 0.0 114.361 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -82.85 153.52 25.12 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.019 1.327 . . . . 0.0 113.255 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 16.2 t60 -86.45 -40.38 15.38 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.831 0.853 . . . . 0.0 111.13 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.3 t0 -91.48 69.91 5.89 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.604 1.561 . . . . 0.0 111.852 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.4 t -121.32 132.59 24.18 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 126.297 1.839 . . . . 0.0 109.22 178.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -59.9 -24.41 76.07 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.596 2.197 . . . . 0.0 114.378 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.6 t -92.2 -50.87 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 119.525 1.057 . . . . 0.0 111.476 175.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 12.9 m -69.92 -38.64 76.3 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.9 tt -54.19 -56.37 26.94 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-O 117.752 -1.118 . . . . 0.0 113.006 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -61.41 -30.1 86.56 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 121.77 1.647 . . . . 0.0 113.327 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 93.5 mt -70.95 -46.22 62.79 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.341 0.973 . . . . 0.0 111.736 177.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -62.89 -31.75 72.86 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.636 0.774 . . . . 0.0 111.019 176.012 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 18.8 t30 -74.35 -39.84 62.53 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.332 1.453 . . . . 0.0 112.137 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -80.27 -19.45 46.74 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 30.8 t -57.69 137.81 56.09 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.617 1.167 . . . . 0.0 113.7 -178.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 37.9 t70 -82.29 -11.37 58.66 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.573 1.549 . . . . 0.0 113.173 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -69.29 -32.34 71.44 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -178.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 . . . . . 0 N--CA 1.477 0.879 0 C-N-CA 126.122 1.769 . . . . 0.0 111.807 -179.389 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.317 0 N-CA-C 114.54 0.576 . . . . 0.0 114.54 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.2 t -61.23 -18.14 56.82 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.66 1.184 . . . . 0.0 113.707 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 25.5 p-80 -79.92 -11.21 59.82 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.071 1.748 . . . . 0.0 113.898 177.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 20.8 mmt -74.12 153.76 39.43 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.239 1.016 . . . . 0.0 112.547 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -79.7 -15.03 58.31 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 178.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -93.97 136.29 23.89 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 125.454 1.501 . . . . 0.0 111.08 178.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -53.17 131.9 45.3 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.416 2.744 . . . . 0.0 113.571 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -86.15 54.37 3.12 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.017 1.327 . . . . 0.0 111.915 -179.039 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 33.8 m -66.74 162.05 22.22 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.855 1.662 . . . . 0.0 113.293 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -63.14 143.5 97.61 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 123.914 0.886 . . . . 0.0 112.581 179.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -73.74 -20.36 20.15 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 123.492 2.795 . . . . 0.0 114.014 -179.122 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 19.9 m -157.16 140.01 15.15 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.469 1.908 . . . . 0.0 110.299 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 28.6 m -138.27 154.82 28.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 126.317 1.847 . . . . 0.0 111.329 179.089 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -133.36 80.88 56.93 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 124.801 1.24 . . . . 0.0 110.784 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -56.11 -46.07 33.61 Favored 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 123.573 2.849 . . . . 0.0 116.533 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -75.77 155.53 39.43 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 122.151 1.901 . . . . 0.0 112.531 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.06 143.32 52.32 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.768 1.227 . . . . 0.0 112.003 177.206 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 18.3 m -72.48 127.76 33.54 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.732 1.213 . . . . 0.0 110.538 177.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -58.01 -22.42 49.63 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.708 1.744 . . . . 0.0 115.708 -176.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -62.6 -21.85 65.94 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.587 -0.696 . . . . 0.0 112.137 175.036 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 15.3 m -67.84 -60.15 2.74 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.228 1.011 . . . . 0.0 110.218 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -60.07 -30.47 69.24 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.497 0.719 . . . . 0.0 112.289 174.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 50.6 m -70.16 -32.73 70.84 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.7 t70 -90.18 -29.87 17.97 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.098 0.959 . . . . 0.0 112.857 176.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.3 tt -41.46 -58.31 1.93 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 127.484 2.314 . . . . 0.0 113.497 -178.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 48.4 p-90 -71.77 -9.9 58.98 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -173.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.06 -60.16 1.9 Allowed 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 116.504 2.039 . . . . 0.0 116.504 -179.049 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 48.2 mt -120.16 19.72 12.17 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -170.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.0 tt -51.86 140.35 29.95 Favored Pre-proline 0 CA--C 1.553 1.069 0 C-N-CA 126.045 1.738 . . . . 0.0 114.487 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -68.94 159.66 53.01 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 124.032 3.154 . . . . 0.0 113.547 -179.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -62.89 -9.77 10.92 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 -177.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 49.9 t30 -128.14 134.7 49.12 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.717 1.607 . . . . 0.0 110.114 178.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -149.46 165.56 31.76 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.196 0.998 . . . . 0.0 112.835 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 28.6 m -122.19 -17.38 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.712 1.605 . . . . 0.0 114.248 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 47.2 tp -74.55 -8.78 57.45 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.019 1.328 . . . . 0.0 113.407 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 12.7 m -48.32 107.47 0.76 Allowed Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 128.021 2.528 . . . . 0.0 114.578 -178.092 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.52 124.98 15.71 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 123.555 2.837 . . . . 0.0 111.505 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 25.9 tp -73.1 127.9 88.6 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 124.936 1.295 . . . . 0.0 112.571 -176.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -54.36 -34.92 82.58 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 123.591 2.861 . . . . 0.0 114.425 178.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 14.8 m -66.05 -13.23 59.62 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.819 1.248 . . . . 0.0 113.818 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -126.63 21.76 7.03 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.756 2.022 . . . . 0.0 111.581 179.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -66.74 159.83 27.06 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -178.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -111.61 30.37 7.02 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.599 2.36 . . . . 0.0 112.371 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 37.8 t70 -58.81 -22.53 58.7 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.641 1.176 . . . . 0.0 114.013 -178.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.28 -20.09 63.93 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.221 1.008 . . . . 0.0 112.797 175.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 94.6 mt -106.39 -0.77 23.94 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.804 1.642 . . . . 0.0 113.426 178.119 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 68.4 mmm -65.94 149.73 49.76 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.685 1.13 . . . . 0.0 113.502 -178.089 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.87 175.72 7.1 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.975 1.71 . . . . 0.0 111.436 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 74.5 p -78.72 151.16 76.68 Favored Pre-proline 0 CA--C 1.544 0.729 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 169.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.58 -12.23 27.2 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.188 2.592 . . . . 0.0 115.136 -179.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -95.55 -18.97 20.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.29 1.036 . . . . 0.0 112.974 177.248 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.68 -9.97 59.59 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.074 -1.016 . . . . 0.0 112.404 177.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 77.3 mt -54.81 -31.86 25.12 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 125.979 1.712 . . . . 0.0 110.8 175.202 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -66.09 -10.08 37.13 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.487 1.515 . . . . 0.0 113.544 177.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.1 tm0? -76.75 -33.85 58.09 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.001 -1.062 . . . . 0.0 111.488 177.282 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -98.69 -36.03 9.98 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 117.918 -1.039 . . . . 0.0 113.124 178.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -100.38 109.77 21.96 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 105.074 -2.195 . . . . 0.0 105.074 169.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.74 138.08 33.01 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -172.27 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -120.03 169.25 10.37 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.05 1.74 . . . . 0.0 110.792 176.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 13.9 t70 -63.58 130.38 94.31 Favored Pre-proline 0 CA--C 1.555 1.149 0 O-C-N 120.989 -1.069 . . . . 0.0 111.543 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -77.44 -5.54 15.66 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.707 2.938 . . . . 0.0 115.373 -176.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 87.69 -150.07 22.16 Favored Glycine 0 CA--C 1.542 1.746 0 C-N-CA 124.801 1.191 . . . . 0.0 113.458 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -75.89 -0.09 9.85 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 124.454 3.436 . . . . 0.0 115.149 -177.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 26.4 t70 -132.36 152.77 51.29 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.552 1.541 . . . . 0.0 112.016 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -76.11 54.04 3.07 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 125.543 1.544 . . . . 0.0 114.255 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 51.0 m -61.32 -28.26 69.08 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.664 1.185 . . . . 0.0 113.082 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 81.3 m -123.46 148.27 46.35 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.816 2.047 . . . . 0.0 110.436 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 7.2 p90 -153.92 174.06 15.12 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.633 1.573 . . . . 0.0 111.447 -177.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 50.9 p-10 -53.32 -28.76 30.11 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.953 1.464 . . . . 0.0 114.953 -178.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -73.43 -24.11 75.74 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 124.956 1.265 . . . . 0.0 114.276 177.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 40.7 p -104.03 -31.55 9.64 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.107 1.363 . . . . 0.0 112.285 177.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -121.77 88.54 2.95 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 127.137 2.175 . . . . 0.0 109.705 178.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 23.6 p -69.16 -69.49 0.33 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.392 1.477 . . . . 0.0 114.482 -176.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 175.84 92.38 0.08 OUTLIER Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.585 1.088 . . . . 0.0 112.429 -178.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.96 -24.97 50.93 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 124.108 3.205 . . . . 0.0 115.91 -176.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 36.3 p -80.89 -13.1 59.23 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.298 1.439 . . . . 0.0 114.481 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -137.26 -24.49 1.08 Allowed 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 -177.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.09 116.93 41.03 Favored Pre-proline 0 CA--C 1.551 1.01 0 CA-C-N 119.55 1.068 . . . . 0.0 111.12 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -62.02 -38.55 56.55 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 122.894 2.396 . . . . 0.0 114.094 -177.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -66.77 -45.4 78.62 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.66 -0.65 . . . . 0.0 110.602 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 81.7 mttt -56.59 -49.55 74.56 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.062 0.846 . . . . 0.0 110.425 175.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -57.16 -45.6 83.49 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.543 0.737 . . . . 0.0 111.889 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -60.02 -41.8 92.97 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 118.842 0.746 . . . . 0.0 111.725 175.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.17 -40.05 90.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.746 0.819 . . . . 0.0 112.152 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.5 mt -64.0 -52.03 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 119.504 1.047 . . . . 0.0 109.714 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -53.51 -56.95 12.67 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.217 1.007 . . . . 0.0 111.171 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.87 -36.56 84.75 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.097 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -69.53 -42.99 73.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.724 1.147 . . . . 0.0 110.656 178.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 8.2 tp -61.51 -40.09 93.36 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.545 0.738 . . . . 0.0 110.395 176.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 95.8 t -60.52 -32.43 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 119.204 0.911 . . . . 0.0 110.929 174.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.8 tp -72.72 -27.58 62.14 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 120.055 1.298 . . . . 0.0 113.306 174.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -61.88 -33.73 74.73 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 120.412 1.46 . . . . 0.0 108.815 173.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.3 mt -68.89 -51.12 43.5 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.174 0.99 . . . . 0.0 110.046 175.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 19.6 t60 -56.79 -55.85 29.09 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.392 177.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -50.8 -45.8 59.47 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -70.19 -35.3 73.84 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 43.9 mttm -77.73 -38.45 47.09 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.22 1.008 . . . . 0.0 111.745 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 49.6 t -60.8 -46.65 89.7 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.47 2.308 . . . . 0.0 109.587 175.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -54.14 -53.74 49.16 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.974 1.71 . . . . 0.0 111.062 173.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -66.11 -38.75 88.98 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 178.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.63 -40.1 82.4 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.241 1.416 . . . . 0.0 111.517 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -72.35 -46.86 53.65 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.068 0.394 . . . . 0.0 109.946 176.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 16.2 tp60 -59.16 -31.99 69.48 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.773 0.829 . . . . 0.0 112.945 179.084 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -71.01 -14.96 62.52 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.012 1.325 . . . . 0.0 113.913 177.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -116.9 -47.19 2.71 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.264 1.426 . . . . 0.0 113.4 -177.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 73.38 -1.01 45.33 Favored Glycine 0 CA--C 1.542 1.741 0 N-CA-C 117.103 1.601 . . . . 0.0 117.103 178.192 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -115.8 -42.85 3.05 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.675 1.738 . . . . 0.0 112.925 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 34.2 m -66.55 152.21 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.816 0.846 . . . . 0.0 112.427 178.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? -84.3 146.97 27.46 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.067 0.947 . . . . 0.0 110.981 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -78.87 171.39 15.25 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 123.999 0.92 . . . . 0.0 112.497 178.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 1.3 m -53.42 147.19 11.06 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.229 1.812 . . . . 0.0 114.66 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 47.6 m -86.48 -3.47 59.02 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.899 1.279 . . . . 0.0 111.734 173.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 30.1 tp -71.64 113.05 16.53 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 126.689 1.996 . . . . 0.0 110.385 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -62.98 -29.28 75.53 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 121.711 1.608 . . . . 0.0 111.851 179.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 36.3 m80 -69.24 -42.21 75.96 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 117.747 -1.12 . . . . 0.0 113.941 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . 0.322 0.8 OUTLIER -72.81 -35.15 67.28 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 120.326 1.421 . . . . 0.0 111.207 178.1 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -60.21 -40.85 91.6 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.752 1.221 . . . . 0.0 110.611 171.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.9 m -65.11 -55.37 19.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.688 1.195 . . . . 0.0 110.667 176.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.7 mmt -62.78 -39.2 93.46 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.604 0.965 . . . . 0.0 113.604 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -64.7 -29.61 70.6 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 120.794 1.634 . . . . 0.0 113.133 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -72.67 -39.42 67.11 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.01 0.524 . . . . 0.0 110.483 173.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 90.5 t -63.41 -45.83 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.194 0.598 . . . . 0.0 110.188 175.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.92 -42.86 90.69 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.983 1.313 . . . . 0.0 112.104 178.223 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -63.01 -32.79 74.23 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.224 0.609 . . . . 0.0 112.385 176.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 65.2 t60 -79.61 -49.31 12.36 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.642 0.777 . . . . 0.0 110.768 176.214 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 31.3 ttp -56.55 -34.04 66.7 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.717 1.607 . . . . 0.0 113.904 -176.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 10.2 t -73.21 -13.06 61.08 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 120.181 1.355 . . . . 0.0 113.085 176.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 58.9 m80 -107.1 -24.79 11.83 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.478 1.511 . . . . 0.0 112.595 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.4 t -61.59 150.06 37.33 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.538 1.535 . . . . 0.0 112.343 178.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -128.89 -8.86 4.93 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.87 1.668 . . . . 0.0 113.641 -179.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.76 -28.22 21.85 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.242 0.928 . . . . 0.0 111.86 178.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.65 -109.66 1.0 Allowed Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.952 1.263 . . . . 0.0 112.761 178.226 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -60.23 -22.98 63.68 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.155 0.982 . . . . 0.0 113.247 177.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.87 -1.46 49.36 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.296 1.438 . . . . 0.0 113.846 178.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.9 t -61.0 141.97 56.95 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 122.289 1.042 . . . . 0.0 110.62 178.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.8 mm-40 -78.62 -10.54 59.78 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.721 1.208 . . . . 0.0 113.115 -176.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 64.6 t -90.65 114.85 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 124.874 1.27 . . . . 0.0 107.582 174.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.32 -37.0 66.84 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -64.93 -41.63 95.38 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.445 1.098 . . . . 0.0 112.204 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.5 t -67.04 -56.38 10.31 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.594 1.558 . . . . 0.0 109.994 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.57 -26.94 62.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.28 1.032 . . . . 0.0 113.255 178.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 70.8 m -82.33 -47.27 12.55 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.049 0.94 . . . . 0.0 112.124 175.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 60.2 m -62.17 -34.8 77.11 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 121.56 -0.713 . . . . 0.0 111.873 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -59.07 -31.53 68.97 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.338 1.055 . . . . 0.0 112.503 176.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -67.71 -34.14 76.29 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.873 0.869 . . . . 0.0 111.299 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.4 mt -72.23 -46.04 59.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 124.343 1.057 . . . . 0.0 110.035 177.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 19.2 mm -62.57 -39.69 85.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.142 0.977 . . . . 0.0 111.301 176.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 16.5 t -60.39 -26.16 66.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.085 0.954 . . . . 0.0 112.712 177.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.6 t60 -61.54 -57.28 12.73 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.092 0.86 . . . . 0.0 111.159 177.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 59.5 m95 -62.45 -22.56 66.31 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 178.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -79.66 -29.92 41.03 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.509 1.123 . . . . 0.0 112.614 178.057 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -99.96 -36.32 9.42 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 179.315 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.4 t -74.04 139.33 44.64 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.354 1.461 . . . . 0.0 111.289 -178.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 74.2 p -130.12 -2.84 4.52 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 -177.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -96.09 141.51 29.38 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.227 1.411 . . . . 0.0 112.647 -177.425 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -74.34 -34.4 63.41 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 121.728 -0.607 . . . . 0.0 111.819 176.33 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 36.7 t0 -90.89 79.34 5.93 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.718 1.607 . . . . 0.0 111.038 178.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.4 t -135.13 137.43 26.85 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 127.106 2.162 . . . . 0.0 109.124 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -56.72 -26.54 66.27 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.858 2.372 . . . . 0.0 114.604 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.8 t -92.24 -51.65 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-N 119.783 1.174 . . . . 0.0 111.604 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 6.1 m -69.63 -39.72 76.97 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 -174.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 1.6 tt -56.24 -55.91 37.0 Favored Pre-proline 0 CA--C 1.546 0.823 0 CA-C-O 117.578 -1.201 . . . . 0.0 112.903 -177.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.18 -32.49 94.56 Favored 'Trans proline' 0 C--N 1.354 0.848 0 CA-C-N 121.845 1.695 . . . . 0.0 113.169 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 98.4 mt -69.31 -46.19 67.72 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.001 0.819 . . . . 0.0 111.47 177.418 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 48.7 mttm -62.63 -41.89 99.28 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.026 0.93 . . . . 0.0 110.472 176.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.0 t30 -63.71 -39.19 93.7 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.274 1.429 . . . . 0.0 112.252 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -77.3 -21.33 53.66 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.325 1.05 . . . . 0.0 113.662 178.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 33.5 p -68.7 146.41 52.99 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -175.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -137.47 12.48 2.99 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 126.026 1.73 . . . . 0.0 113.065 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 57.2 tptt -71.49 -24.72 62.03 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.05 1.74 . . . . 0.0 113.635 -177.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 13.4 mmt85 . . . . . 0 N--CA 1.478 0.955 0 C-N-CA 125.688 1.595 . . . . 0.0 111.309 177.05 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.423 0 N-CA-C 114.132 0.413 . . . . 0.0 114.132 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.2 t -153.01 152.49 31.45 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.337 1.455 . . . . 0.0 111.243 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 22.0 p-80 -58.5 -19.72 39.64 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.282 1.033 . . . . 0.0 113.074 175.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 13.4 tpt -76.67 -18.93 58.27 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.274 1.43 . . . . 0.0 112.89 177.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -124.56 -22.75 4.55 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -74.16 144.27 81.57 Favored Pre-proline 0 CA--C 1.549 0.93 0 O-C-N 121.076 -1.015 . . . . 0.0 112.501 179.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -76.71 -15.44 17.08 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.684 2.923 . . . . 0.0 114.644 -178.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -78.21 92.48 4.47 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.284 1.033 . . . . 0.0 111.56 -178.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 15.0 t -153.04 152.3 31.2 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.825 1.65 . . . . 0.0 111.251 179.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 14.9 t70 -151.29 142.18 15.11 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 125.477 1.511 . . . . 0.0 110.883 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -55.89 -22.81 39.49 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.358 2.705 . . . . 0.0 116.752 -178.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 48.2 m -83.04 0.63 43.98 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -179.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 10.8 p -136.69 155.73 34.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 125.297 1.439 . . . . 0.0 111.48 179.112 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -134.82 150.28 72.93 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 124.707 1.203 . . . . 0.0 112.533 179.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -59.36 -43.03 43.59 Favored 'Trans proline' 0 CA--C 1.547 1.143 0 C-N-CA 123.472 2.781 . . . . 0.0 117.991 -178.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -79.51 152.17 22.98 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 122.297 1.998 . . . . 0.0 113.734 -177.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 6.9 tt -65.39 143.82 57.48 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.474 1.11 . . . . 0.0 110.944 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 40.9 t -118.58 160.61 21.48 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.314 1.845 . . . . 0.0 109.434 175.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -62.82 -24.67 67.87 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.875 -1.141 . . . . 0.0 111.011 174.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -79.33 -16.84 55.68 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.454 1.102 . . . . 0.0 113.058 176.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 58.2 m -59.23 -60.08 4.44 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 119.368 0.986 . . . . 0.0 110.876 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -60.17 -25.76 65.79 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 175.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 45.3 m -75.05 -31.89 61.4 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.378 -0.826 . . . . 0.0 112.642 177.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -90.06 -25.45 20.78 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.62 1.168 . . . . 0.0 112.902 175.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.9 tt -45.51 -60.01 2.41 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 127.451 2.3 . . . . 0.0 113.87 -178.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.2 p-90 -70.08 -8.36 48.76 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -173.515 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 10.2 ptmm? -112.15 -56.0 2.45 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 4.2 mp -120.12 16.88 12.44 Favored 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 117.055 2.243 . . . . 0.0 117.055 -176.425 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.4 137.22 50.8 Favored Pre-proline 0 N--CA 1.48 1.044 0 O-C-N 120.473 -1.392 . . . . 0.0 113.802 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -80.14 162.59 23.01 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 124.104 3.203 . . . . 0.0 113.717 -179.34 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -67.93 -11.14 58.16 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.007 1.323 . . . . 0.0 113.538 177.259 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.68 1.95 40.01 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 126.117 1.767 . . . . 0.0 113.683 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -68.81 145.11 54.03 Favored 'General case' 0 CA--C 1.551 0.992 0 O-C-N 120.573 -1.33 . . . . 0.0 112.861 -178.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 34.5 m -127.01 9.3 3.55 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 -177.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.19 -4.75 46.29 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.844 1.258 . . . . 0.0 113.399 -178.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 6.0 m -52.77 113.77 4.94 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 126.598 1.959 . . . . 0.0 114.618 -176.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -75.02 135.4 18.98 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.483 2.122 . . . . 0.0 109.515 176.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 85.5 mt -73.56 135.98 78.16 Favored Pre-proline 0 CA--C 1.545 0.757 0 CA-C-O 118.415 -0.802 . . . . 0.0 112.469 -177.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -54.44 -30.81 65.71 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.666 2.91 . . . . 0.0 114.639 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 46.9 p -69.73 -15.77 63.21 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.178 1.391 . . . . 0.0 113.932 177.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -127.52 15.1 7.1 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.677 1.991 . . . . 0.0 112.096 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.54 159.44 33.92 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -176.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.75 16.8 5.31 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 128.26 2.624 . . . . 0.0 114.119 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -66.92 -14.63 63.0 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.949 1.3 . . . . 0.0 114.482 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 37.2 t70 -69.58 -16.13 63.35 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 121.217 -0.927 . . . . 0.0 112.097 175.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 28.3 tp -110.88 16.16 21.43 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 127.569 2.348 . . . . 0.0 111.881 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.4 tpt -62.75 145.52 54.64 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -175.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.89 149.29 47.71 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 128.251 2.621 . . . . 0.0 109.682 177.279 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 24.2 m -71.51 134.41 84.4 Favored Pre-proline 0 N--CA 1.474 0.737 0 CA-C-O 118.327 -0.844 . . . . 0.0 110.966 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -55.39 -28.8 65.19 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.002 2.468 . . . . 0.0 116.085 -176.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -70.72 -15.25 62.68 Favored 'General case' 0 CA--C 1.55 0.954 0 O-C-N 120.912 -1.118 . . . . 0.0 113.196 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.1 t70 -89.76 -9.83 47.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.243 1.817 . . . . 0.0 113.13 178.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 72.7 mt -52.56 -34.35 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 125.045 1.338 . . . . 0.0 111.33 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -67.44 -9.73 44.64 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.562 1.145 . . . . 0.0 113.697 177.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -75.65 -20.2 58.64 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 120.928 -1.108 . . . . 0.0 111.109 175.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -86.19 -49.98 7.32 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.022 0.828 . . . . 0.0 109.876 178.269 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -115.4 109.92 18.58 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.556 1.942 . . . . 0.0 106.782 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 1.6 m -123.56 138.17 54.61 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -173.349 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -72.96 171.36 12.95 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.979 1.312 . . . . 0.0 112.286 176.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 11.1 t70 -60.18 122.91 70.1 Favored Pre-proline 0 CA--C 1.555 1.173 0 O-C-N 121.292 -0.88 . . . . 0.0 111.538 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -82.47 -3.58 11.42 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 123.938 3.092 . . . . 0.0 115.333 -176.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 92.78 -148.65 19.16 Favored Glycine 0 CA--C 1.543 1.826 0 C-N-CA 124.703 1.144 . . . . 0.0 112.85 -177.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -60.2 -21.95 68.35 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 124.485 3.456 . . . . 0.0 116.302 -177.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 24.7 t70 -140.05 137.46 34.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.035 1.334 . . . . 0.0 112.169 -177.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 170.68 55.21 0.04 OUTLIER Glycine 0 CA--C 1.534 1.239 0 C-N-CA 124.316 0.96 . . . . 0.0 112.921 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 20.0 m -67.56 -7.08 23.25 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.664 1.727 . . . . 0.0 115.664 -176.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 59.8 m -50.95 -31.97 19.44 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.026 1.73 . . . . 0.0 113.95 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -55.97 -31.8 63.32 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.825 0.85 . . . . 0.0 113.187 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 26.4 t30 -70.73 -26.23 63.29 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 121.26 -0.9 . . . . 0.0 112.406 177.066 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -86.44 -37.52 8.83 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 124.906 1.241 . . . . 0.0 112.807 176.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 71.5 p -78.13 -32.25 50.31 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.084 0.954 . . . . 0.0 112.814 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -93.67 76.14 4.33 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.032 1.333 . . . . 0.0 109.587 175.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 43.4 p -64.86 -16.38 63.1 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 125.848 1.659 . . . . 0.0 114.766 -177.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -177.33 -71.04 0.06 OUTLIER Glycine 0 CA--C 1.533 1.203 0 C-N-CA 127.611 2.529 . . . . 0.0 108.217 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -70.59 170.45 17.54 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.383 2.722 . . . . 0.0 110.528 172.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 9.5 m -56.32 -31.96 64.19 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.458 1.103 . . . . 0.0 112.714 179.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -144.67 129.9 18.67 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.139 1.776 . . . . 0.0 109.711 175.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 15.8 t70 -61.12 146.31 88.36 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 125.104 1.362 . . . . 0.0 112.147 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -51.69 -34.27 52.91 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.009 2.473 . . . . 0.0 114.715 178.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -66.61 -22.22 66.12 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.579 1.152 . . . . 0.0 112.494 177.049 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -89.73 -42.35 11.37 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.59 1.556 . . . . 0.0 110.215 174.58 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 77.9 mtm-85 -60.68 -39.27 87.82 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.868 0.867 . . . . 0.0 112.619 179.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -63.58 -27.87 69.54 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 86.3 mt -70.26 -37.71 74.96 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.176 0.59 . . . . 0.0 110.593 175.481 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.5 mt -62.1 -51.81 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 175.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -54.57 -54.01 46.98 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.966 0.906 . . . . 0.0 111.016 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -36.17 83.12 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.164 0.893 . . . . 0.0 113.352 -178.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -71.74 -44.15 64.59 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.888 0.767 . . . . 0.0 110.96 179.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 12.3 tp -63.76 -38.35 90.79 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.569 0.747 . . . . 0.0 110.784 177.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 87.8 t -61.87 -32.27 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 CA-C-N 119.735 1.152 . . . . 0.0 110.619 174.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 15.6 tp -69.53 -34.98 75.02 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 120.762 -1.211 . . . . 0.0 111.608 174.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.4 mp -59.14 -26.14 64.48 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 120.11 1.323 . . . . 0.0 110.271 174.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 4.0 mt -77.5 -53.25 7.84 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.289 -0.882 . . . . 0.0 109.933 176.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.6 t60 -54.93 -52.93 61.42 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.13 0.572 . . . . 0.0 110.226 177.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -58.19 -22.78 53.04 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.79 1.236 . . . . 0.0 113.968 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -90.07 -29.42 18.37 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.157 -0.964 . . . . 0.0 113.417 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 31.9 mttp -86.07 -34.67 20.62 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.682 1.193 . . . . 0.0 112.623 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 20.2 t -63.92 -44.83 91.72 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.277 1.831 . . . . 0.0 110.946 177.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -60.88 -33.47 73.14 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 120.797 -1.19 . . . . 0.0 111.819 174.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -69.26 -34.76 75.27 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.184 0.993 . . . . 0.0 111.067 174.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.53 -37.37 80.97 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.879 1.271 . . . . 0.0 110.871 174.433 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -75.49 -44.87 41.7 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 122.992 0.517 . . . . 0.0 110.506 175.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -55.68 -36.86 67.58 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.826 1.25 . . . . 0.0 112.417 178.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -70.54 -10.01 58.16 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.016 1.326 . . . . 0.0 114.352 178.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -119.02 -48.98 2.43 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.358 1.463 . . . . 0.0 112.94 -179.657 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 74.44 0.91 59.57 Favored Glycine 0 CA--C 1.541 1.694 0 N-CA-C 117.192 1.637 . . . . 0.0 117.192 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -122.08 -29.65 4.19 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 119.89 1.845 . . . . 0.0 114.617 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 33.4 m -78.17 160.68 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.642 1.177 . . . . 0.0 113.984 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -76.6 165.24 25.05 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.147 1.379 . . . . 0.0 111.705 177.012 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -75.96 177.53 6.96 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.047 0.939 . . . . 0.0 113.415 179.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 3.5 t -59.66 146.8 39.82 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.431 1.892 . . . . 0.0 113.785 -179.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 50.3 m -80.87 -11.46 59.58 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.732 1.213 . . . . 0.0 113.278 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 58.8 tp -83.6 115.18 58.22 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 125.932 1.693 . . . . 0.0 110.512 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -58.12 -35.47 98.71 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.533 2.155 . . . . 0.0 113.828 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 7.6 m170 -65.48 -37.46 86.91 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.589 0.755 . . . . 0.0 112.533 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 33.6 t -62.44 -49.07 76.91 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.024 1.329 . . . . 0.0 109.716 177.11 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -55.41 -36.99 67.06 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.933 1.293 . . . . 0.0 111.813 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.6 m -70.67 -56.52 6.26 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.887 0.875 . . . . 0.0 111.772 176.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 14.6 mmt -65.07 -32.71 74.56 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -65.51 -32.21 73.69 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 120.753 1.615 . . . . 0.0 112.303 178.047 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -72.47 -38.55 68.18 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.534 0.734 . . . . 0.0 110.449 174.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 77.0 t -62.22 -47.24 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.277 0.631 . . . . 0.0 110.327 175.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.57 -45.11 95.15 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.878 0.871 . . . . 0.0 111.708 178.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -67.83 -21.22 65.21 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.2 t60 -83.86 -49.39 9.07 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 118.803 0.729 . . . . 0.0 109.339 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.0 ttp -57.55 -27.92 63.07 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.189 1.796 . . . . 0.0 113.778 -177.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 17.2 p -70.75 -30.35 66.83 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 119.507 1.049 . . . . 0.0 112.244 174.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 84.1 t60 -92.39 -27.08 17.73 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.831 1.652 . . . . 0.0 112.835 178.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 14.2 t -63.13 153.02 35.63 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.853 1.661 . . . . 0.0 112.776 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -133.15 -7.24 3.02 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.555 1.542 . . . . 0.0 114.23 -179.207 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -90.55 -22.85 21.09 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.385 0.993 . . . . 0.0 113.012 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.3 -116.61 5.91 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.448 1.023 . . . . 0.0 112.354 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 58.1 tptt -56.4 -24.3 43.91 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.774 1.23 . . . . 0.0 113.211 176.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.48 -1.86 57.41 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.576 1.151 . . . . 0.0 114.043 178.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 20.0 t -62.66 141.88 58.33 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.112 0.958 . . . . 0.0 110.586 178.612 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.7 mm-40 -78.09 -9.4 59.13 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.592 1.157 . . . . 0.0 113.163 -176.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 99.3 t -91.87 114.56 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 173.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.85 -42.99 72.68 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -64.42 -37.88 89.09 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.866 0.866 . . . . 0.0 112.945 -178.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 29.7 t -65.86 -59.59 3.71 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.508 1.523 . . . . 0.0 110.378 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.13 -30.86 64.77 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.874 0.87 . . . . 0.0 112.58 178.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.3 m -75.52 -50.63 15.08 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.757 0.823 . . . . 0.0 112.486 176.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 63.6 m -60.04 -36.39 77.18 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.663 -0.648 . . . . 0.0 111.801 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 48.2 tpt85 -59.81 -29.54 68.31 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.849 0.86 . . . . 0.0 113.047 177.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -70.29 -30.06 66.97 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.72 0.808 . . . . 0.0 111.245 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 6.6 mt -73.45 -44.63 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.168 0.987 . . . . 0.0 109.221 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 24.0 mm -58.71 -39.18 75.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 123.86 0.864 . . . . 0.0 109.887 174.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 4.1 t -60.72 -28.56 68.76 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.037 0.935 . . . . 0.0 113.054 176.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.1 t60 -61.76 -55.25 32.15 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.404 1.002 . . . . 0.0 110.44 177.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 44.2 m95 -61.69 -30.65 70.88 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 178.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -70.29 -27.95 64.81 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.703 0.801 . . . . 0.0 112.703 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -100.05 -38.98 8.34 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 179.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.8 t -75.62 137.66 40.9 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.796 1.638 . . . . 0.0 112.862 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 68.2 p -129.97 4.11 4.89 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.692 1.597 . . . . 0.0 114.045 -178.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 69.8 mtm180 -82.1 158.5 23.69 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.126 1.37 . . . . 0.0 113.551 -178.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 23.9 t60 -95.88 -40.22 9.42 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.34 1.056 . . . . 0.0 109.84 170.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.6 t0 -92.79 69.99 4.73 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.7 1.6 . . . . 0.0 111.655 178.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 52.7 t -123.27 133.65 24.67 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 126.653 1.981 . . . . 0.0 108.412 177.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -59.01 -25.61 78.44 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.709 2.273 . . . . 0.0 114.425 -176.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 6.3 t -92.13 -50.29 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 119.519 1.054 . . . . 0.0 111.649 176.258 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.4 m -68.86 -41.32 78.58 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -175.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.9 tt -50.75 -57.18 14.31 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.472 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -61.3 -31.77 89.42 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.021 1.814 . . . . 0.0 113.591 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 89.7 mt -70.87 -46.44 62.63 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.76 0.824 . . . . 0.0 111.676 178.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -62.26 -36.74 82.97 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.155 0.982 . . . . 0.0 110.397 176.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 13.9 t30 -69.92 -38.32 76.19 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.29 1.436 . . . . 0.0 112.448 175.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -77.29 -25.65 51.57 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.777 1.028 . . . . 0.0 113.777 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 32.1 t -63.37 150.75 42.71 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.352 1.061 . . . . 0.0 113.302 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -91.68 -5.96 52.88 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.341 1.457 . . . . 0.0 113.246 178.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -80.91 85.13 6.26 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.056 1.343 . . . . 0.0 111.139 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 25.4 mmt85 . . . . . 0 N--CA 1.479 1.015 0 C-N-CA 126.297 1.839 . . . . 0.0 112.33 -178.613 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.436 0 CA-C-O 121.38 0.433 . . . . 0.0 113.786 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.9 p -65.08 139.53 58.73 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.902 1.281 . . . . 0.0 113.976 -177.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -84.26 162.32 20.17 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.422 1.489 . . . . 0.0 111.606 -179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 62.7 ttp -80.97 90.4 5.95 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.972 0.909 . . . . 0.0 111.643 -179.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.18 -15.08 36.96 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -135.31 142.35 41.21 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 125.059 1.344 . . . . 0.0 111.885 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -82.5 -7.99 11.59 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 123.846 3.031 . . . . 0.0 114.086 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -72.48 142.99 48.57 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.639 1.175 . . . . 0.0 113.266 -177.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 66.1 m -142.21 149.62 39.9 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.176 1.79 . . . . 0.0 111.133 178.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 14.4 t70 -100.91 127.25 32.66 Favored Pre-proline 0 CA--C 1.553 1.079 0 C-N-CA 124.432 1.093 . . . . 0.0 111.066 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -79.84 -13.31 13.08 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.525 2.817 . . . . 0.0 115.032 -177.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 19.9 m -90.12 6.89 40.59 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.425 1.49 . . . . 0.0 114.727 -177.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 8.1 p -137.53 146.13 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.869 1.268 . . . . 0.0 112.004 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -146.01 81.81 9.57 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 125.483 1.513 . . . . 0.0 110.668 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -102.1 83.88 0.03 OUTLIER 'Trans proline' 0 CA--C 1.555 1.526 0 C-N-CA 125.301 4.0 . . . . 0.0 114.092 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -75.93 162.74 34.34 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.192 2.595 . . . . 0.0 111.893 177.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 38.5 tp -79.57 144.26 34.04 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.834 0.854 . . . . 0.0 111.49 176.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 40.3 t -129.06 155.02 46.08 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.429 1.492 . . . . 0.0 110.872 177.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -58.77 -27.87 65.39 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.913 0.885 . . . . 0.0 111.097 174.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -83.07 -14.69 53.27 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 124.651 1.18 . . . . 0.0 113.71 178.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 61.4 m -58.68 -59.36 5.53 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.468 1.031 . . . . 0.0 111.433 -179.189 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -60.03 -21.94 62.0 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.504 0.928 . . . . 0.0 113.504 178.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 21.3 t -79.0 -33.65 44.77 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.32 1.048 . . . . 0.0 112.646 178.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 36.4 t70 -89.77 -26.5 20.57 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.838 0.855 . . . . 0.0 112.104 175.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.7 tt -45.82 -60.06 2.45 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 127.176 2.191 . . . . 0.0 113.367 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.2 p-90 -68.91 -8.96 49.07 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -172.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -111.89 -58.51 2.12 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 -178.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 58.0 mt -120.05 16.29 12.46 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -171.173 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.6 tt -54.76 136.49 64.56 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 124.915 1.286 . . . . 0.0 113.046 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -78.19 151.69 26.91 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 124.216 3.278 . . . . 0.0 114.297 -177.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -60.57 -16.02 33.62 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.38 1.472 . . . . 0.0 114.959 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 64.2 t30 -81.44 -1.29 45.21 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.848 1.259 . . . . 0.0 113.805 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -65.71 143.87 57.26 Favored 'General case' 0 CA--C 1.549 0.941 0 O-C-N 120.85 -1.156 . . . . 0.0 112.665 -179.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 7.6 p -134.57 21.07 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 125.087 1.355 . . . . 0.0 113.388 -178.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 7.8 tt -79.6 -12.81 59.82 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 120.633 -1.292 . . . . 0.0 113.791 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 6.0 t -62.4 126.06 87.2 Favored Pre-proline 0 N--CA 1.473 0.688 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -175.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.29 131.77 18.3 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 122.537 2.158 . . . . 0.0 109.962 175.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 81.0 mt -76.8 156.24 82.73 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 123.983 0.913 . . . . 0.0 111.654 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -52.25 -34.27 58.79 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.542 2.828 . . . . 0.0 114.961 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 18.3 m -70.13 -10.92 60.33 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.892 1.277 . . . . 0.0 114.276 178.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -131.71 16.95 4.78 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 127.139 2.175 . . . . 0.0 112.25 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -80.3 163.28 24.06 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.19 1.396 . . . . 0.0 114.229 -178.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -107.83 23.28 14.71 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.222 2.609 . . . . 0.0 113.605 -178.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -66.4 -14.55 62.3 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.04 1.336 . . . . 0.0 113.987 -178.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -64.11 -17.57 63.57 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 120.857 -1.152 . . . . 0.0 113.322 176.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 83.8 mt -108.2 13.46 25.79 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 126.976 2.11 . . . . 0.0 113.537 178.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.24 151.61 46.64 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -175.154 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 95.9 mt -125.19 170.28 11.4 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.778 2.831 . . . . 0.0 113.504 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.7 m -90.8 150.43 42.14 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 169.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -53.72 -25.1 32.75 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.069 2.512 . . . . 0.0 115.651 -178.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.8 t70 -69.87 -24.08 63.37 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.891 0.876 . . . . 0.0 112.889 178.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -76.17 -18.04 59.28 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.86 0.864 . . . . 0.0 112.361 178.282 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 93.3 mt -59.5 -34.02 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.59 0.756 . . . . 0.0 109.322 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -71.18 -9.87 58.8 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -84.15 -29.77 26.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.93 0.892 . . . . 0.0 111.521 176.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -96.58 -28.4 14.38 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 176.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -124.3 109.85 13.87 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 170.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 1.4 t -125.07 159.4 31.47 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 -177.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -97.83 177.11 5.56 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.151 1.78 . . . . 0.0 112.483 178.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 12.5 t70 -63.54 128.19 92.32 Favored Pre-proline 0 CA--C 1.555 1.169 0 O-C-N 120.973 -1.079 . . . . 0.0 110.786 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -78.38 -9.11 16.29 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.75 2.966 . . . . 0.0 115.029 -175.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 97.59 -155.68 20.55 Favored Glycine 0 CA--C 1.543 1.799 0 C-N-CA 125.418 1.485 . . . . 0.0 112.947 -177.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -62.31 -16.61 52.38 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 124.449 3.433 . . . . 0.0 115.704 -178.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 24.5 t0 -140.09 161.41 37.69 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.506 1.922 . . . . 0.0 111.218 -178.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 88.55 17.44 56.9 Favored Glycine 0 CA--C 1.536 1.377 0 N-CA-C 115.202 0.841 . . . . 0.0 115.202 179.158 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 53.3 p -72.99 -0.73 14.6 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.566 1.546 . . . . 0.0 114.8 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 79.7 m -75.8 58.63 1.14 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.818 2.047 . . . . 0.0 111.227 177.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -53.83 -36.24 62.31 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 -175.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -63.98 -19.54 65.23 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 119.53 1.059 . . . . 0.0 113.248 177.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -80.55 -10.0 85.77 Favored Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.82 1.2 . . . . 0.0 113.962 175.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 11.7 t -126.07 -23.57 3.89 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.443 1.497 . . . . 0.0 113.571 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -126.56 130.42 50.51 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.595 1.958 . . . . 0.0 112.567 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 1.7 m -76.26 -16.71 59.75 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.565 1.146 . . . . 0.0 112.588 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 94.0 109.61 2.1 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 126.357 1.932 . . . . 0.0 111.216 -178.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -63.44 -22.4 71.31 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 122.86 2.373 . . . . 0.0 114.134 -177.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 11.2 t -85.07 -18.09 35.4 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 121.218 -0.926 . . . . 0.0 112.529 176.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -100.67 -29.49 12.27 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.332 1.453 . . . . 0.0 114.074 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 12.8 t70 -104.83 110.78 64.91 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 125.309 1.444 . . . . 0.0 111.78 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -60.3 -33.95 94.07 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 123.424 2.75 . . . . 0.0 114.989 -178.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -73.36 -31.13 63.77 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 121.233 -0.917 . . . . 0.0 112.735 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 80.6 tttt -64.94 -30.92 71.94 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.499 0.72 . . . . 0.0 111.581 177.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 70.2 mtp180 -62.38 -41.49 98.68 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.779 0.832 . . . . 0.0 111.122 174.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -59.59 -33.04 70.96 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.065 0.946 . . . . 0.0 112.103 179.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 83.6 mt -65.67 -40.56 92.52 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.963 0.801 . . . . 0.0 112.018 178.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.1 mt -68.35 -51.19 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-N 118.342 0.519 . . . . 0.0 109.677 176.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -55.13 -54.41 43.58 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.576 1.15 . . . . 0.0 110.889 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -34.99 79.49 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.148 -0.97 . . . . 0.0 113.168 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -68.67 -48.99 62.54 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.092 0.86 . . . . 0.0 109.655 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 16.8 tp -59.82 -43.93 94.28 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.425 0.69 . . . . 0.0 111.413 177.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 61.0 t -61.43 -24.98 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 O-C-N 120.64 -1.288 . . . . 0.0 111.331 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 3.7 tp -79.81 -26.09 40.64 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.289 1.404 . . . . 0.0 112.408 172.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.5 mp -60.84 -45.27 95.15 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 120.596 1.544 . . . . 0.0 107.367 170.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.2 mp -61.41 -50.59 72.22 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.307 1.043 . . . . 0.0 111.102 175.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 31.0 t60 -55.61 -57.3 12.54 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.424 1.011 . . . . 0.0 110.285 177.351 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.59 -30.93 63.76 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.549 1.14 . . . . 0.0 114.032 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 43.1 t60 -75.48 -38.63 59.44 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.522 -0.736 . . . . 0.0 112.04 176.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 42.7 mttm -79.81 -33.62 40.26 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.521 1.128 . . . . 0.0 111.853 -179.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 13.6 t -63.26 -44.77 94.21 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 127.406 2.283 . . . . 0.0 111.677 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -64.74 -38.18 90.12 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 120.726 -1.234 . . . . 0.0 111.727 174.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -65.15 -41.48 94.7 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.671 1.189 . . . . 0.0 111.047 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -40.49 71.31 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.935 1.694 . . . . 0.0 111.678 176.502 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -76.3 -47.15 24.66 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.123 0.569 . . . . 0.0 111.801 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -59.12 -28.01 66.14 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.746 0.819 . . . . 0.0 112.922 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -66.39 -13.34 60.53 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.183 1.393 . . . . 0.0 114.657 177.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -137.92 -44.69 0.52 Allowed 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.109 1.151 . . . . 0.0 114.109 -177.176 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 84.44 -15.06 42.7 Favored Glycine 0 CA--C 1.54 1.654 0 C-N-CA 125.665 1.603 . . . . 0.0 116.351 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -114.13 -11.94 12.61 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 119.559 1.68 . . . . 0.0 114.107 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 30.7 m -68.56 156.65 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.315 1.046 . . . . 0.0 112.51 178.385 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.48 150.22 46.39 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.437 0.695 . . . . 0.0 112.252 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -97.43 169.06 10.0 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.106 1.362 . . . . 0.0 113.696 -179.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -72.21 161.08 31.36 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.658 1.583 . . . . 0.0 113.214 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 50.1 m -115.0 -3.63 12.62 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.343 1.457 . . . . 0.0 114.458 -179.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 36.7 mt -80.62 131.64 60.48 Favored Pre-proline 0 CA--C 1.545 0.779 0 CA-C-N 119.065 0.848 . . . . 0.0 112.988 -179.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.22 -33.06 19.49 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 122.763 2.309 . . . . 0.0 111.289 176.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 35.3 m80 -70.98 -32.32 69.13 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.493 1.117 . . . . 0.0 112.065 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 53.2 t -68.17 -51.03 50.35 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.813 1.245 . . . . 0.0 108.858 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 43.2 ttp-105 -54.42 -39.65 67.53 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.11 1.364 . . . . 0.0 111.283 173.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.2 m -65.43 -56.57 11.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.523 1.129 . . . . 0.0 111.394 176.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 19.9 mmt -66.45 -34.54 78.17 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -177.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -65.44 -32.25 73.77 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 120.88 1.673 . . . . 0.0 112.286 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -70.62 -39.71 73.56 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.034 0.534 . . . . 0.0 110.491 174.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 71.5 t -63.77 -46.9 93.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.261 0.625 . . . . 0.0 111.025 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.5 -43.38 93.37 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.647 0.779 . . . . 0.0 111.259 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -68.32 -18.09 64.42 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 176.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 66.6 t60 -88.03 -49.82 6.8 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.535 0.734 . . . . 0.0 109.432 173.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 27.2 ttp -57.15 -27.86 62.25 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.151 1.781 . . . . 0.0 113.616 -178.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 11.4 p -69.37 -26.52 64.7 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 121.114 -0.991 . . . . 0.0 112.641 175.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 68.8 m80 -104.32 -18.65 14.36 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.111 1.765 . . . . 0.0 113.947 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.0 t -62.84 150.77 40.84 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.282 1.433 . . . . 0.0 112.517 -179.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -121.52 -14.79 8.16 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.846 1.658 . . . . 0.0 113.743 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -97.29 -29.33 13.61 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.339 1.056 . . . . 0.0 112.598 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.92 -110.24 1.22 Allowed Glycine 0 CA--C 1.535 1.308 0 C-N-CA 124.484 1.04 . . . . 0.0 113.41 177.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -60.76 -20.27 60.98 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.095 -1.238 . . . . 0.0 113.3 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.49 -0.49 43.28 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.858 1.663 . . . . 0.0 113.588 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.7 t -63.7 142.46 58.39 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 122.106 0.955 . . . . 0.0 110.284 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -81.87 -3.2 53.52 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 86.2 t -89.75 115.81 30.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 173.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.42 -37.29 67.46 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -71.11 -27.36 63.53 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.125 0.97 . . . . 0.0 113.231 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 43.0 t -78.18 -56.86 4.13 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.6 1.56 . . . . 0.0 110.044 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.52 -27.69 66.41 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 179.104 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 16.2 p -77.18 -50.37 13.1 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.394 -0.816 . . . . 0.0 111.587 175.168 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 57.9 m -61.65 -36.37 80.59 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.524 -0.735 . . . . 0.0 112.55 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -61.1 -31.72 71.4 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 121.664 -0.647 . . . . 0.0 112.655 177.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -66.22 -29.94 70.29 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.018 0.826 . . . . 0.0 111.465 175.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.8 mt -76.29 -46.85 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 124.455 1.102 . . . . 0.0 109.807 176.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 33.3 mm -58.48 -36.91 61.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.157 0.983 . . . . 0.0 110.522 175.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 68.9 m -63.95 -21.38 66.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.358 1.063 . . . . 0.0 113.395 177.218 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.9 t60 -66.15 -57.45 7.62 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.88 1.218 . . . . 0.0 110.843 178.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 43.9 m95 -61.67 -21.25 64.27 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 177.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 92.8 mttt -79.38 -28.38 41.9 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.5 1.12 . . . . 0.0 112.713 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -100.13 -42.89 6.52 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.883 1.273 . . . . 0.0 113.697 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 12.7 t -81.39 133.2 35.38 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.463 1.905 . . . . 0.0 111.652 -178.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.9 p -130.04 -5.18 4.46 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -179.011 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 74.7 mtp85 -67.15 156.14 36.97 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.1 1.76 . . . . 0.0 114.18 -178.172 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -85.19 -34.05 22.15 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.846 0.858 . . . . 0.0 111.394 173.204 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 18.4 t0 -104.45 86.36 2.5 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.727 2.011 . . . . 0.0 111.278 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.0 t -136.5 137.0 22.89 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 126.572 1.949 . . . . 0.0 109.604 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -56.21 -29.11 74.33 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.386 2.724 . . . . 0.0 114.632 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 20.1 t -92.24 -54.86 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 CA-C-N 119.276 0.944 . . . . 0.0 111.934 175.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 9.7 m -66.39 -37.64 85.71 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -173.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.29 -57.98 17.48 Favored Pre-proline 0 CA--C 1.548 0.901 0 CA-C-N 120.046 1.294 . . . . 0.0 112.743 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.0 -29.03 87.18 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 121.806 1.671 . . . . 0.0 113.497 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 92.0 mt -70.44 -44.04 68.65 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.555 1.07 . . . . 0.0 111.482 177.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -62.32 -36.51 82.39 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 118.38 0.536 . . . . 0.0 110.766 175.2 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.0 t30 -69.21 -36.18 76.99 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 124.706 1.202 . . . . 0.0 112.349 176.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -79.07 -25.57 43.09 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.071 1.349 . . . . 0.0 114.203 178.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 45.9 t -57.53 144.07 38.4 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 125.44 1.496 . . . . 0.0 114.383 -177.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 37.3 t70 -82.48 -4.4 57.42 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.183 1.393 . . . . 0.0 112.388 176.166 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -80.22 47.46 0.91 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 126.353 1.861 . . . . 0.0 110.218 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 20.7 ptt-85 . . . . . 0 N--CA 1.476 0.875 0 C-N-CA 128.384 2.674 . . . . 0.0 113.226 -175.037 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.476 0 CA-C-O 121.309 0.394 . . . . 0.0 113.946 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.7 t -80.61 147.32 30.77 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.094 0.957 . . . . 0.0 112.165 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -139.16 150.45 45.63 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.795 1.638 . . . . 0.0 111.61 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 65.8 mtt -73.76 -25.39 60.14 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.76 0.824 . . . . 0.0 112.683 178.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -147.68 141.13 25.36 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.961 1.704 . . . . 0.0 110.081 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -154.64 -51.22 0.02 OUTLIER Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.046 1.338 . . . . 0.0 113.524 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -74.41 -29.24 9.53 Favored 'Trans proline' 0 C--N 1.356 0.93 0 CA-C-N 122.128 1.796 . . . . 0.0 115.222 -178.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -85.89 -14.22 45.51 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 -176.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 71.1 p -81.01 -11.05 59.62 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 7.3 t0 -77.57 119.83 78.99 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 125.235 1.414 . . . . 0.0 110.759 176.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.18 -25.03 58.17 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.517 2.145 . . . . 0.0 113.422 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 24.5 m -76.51 -0.72 24.1 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 2.2 p -76.0 -16.77 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 124.012 0.925 . . . . 0.0 113.454 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -70.15 118.04 59.99 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 124.565 1.146 . . . . 0.0 112.816 -178.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -62.72 -38.8 47.13 Favored 'Trans proline' 0 CA--C 1.551 1.334 0 C-N-CA 123.475 2.783 . . . . 0.0 118.853 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -76.03 170.71 19.53 Favored 'Trans proline' 0 C--N 1.356 0.947 0 C-N-CA 122.83 2.353 . . . . 0.0 115.206 -174.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 41.7 tp -68.92 143.4 54.47 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.015 1.326 . . . . 0.0 111.409 177.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 69.5 m -122.64 158.01 30.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.071 1.348 . . . . 0.0 111.899 178.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -56.88 -36.1 69.72 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.934 0.894 . . . . 0.0 112.177 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -70.13 -19.24 63.24 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.328 1.051 . . . . 0.0 113.731 178.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 22.8 m -65.81 -59.98 3.33 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.554 1.07 . . . . 0.0 111.031 -179.274 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.24 -30.66 69.56 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.754 0.706 . . . . 0.0 112.299 175.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 43.6 m -71.4 -31.37 67.19 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 31.7 t70 -90.11 -28.06 19.22 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.983 1.313 . . . . 0.0 113.391 176.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.5 tt -42.99 -59.99 1.8 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 127.335 2.254 . . . . 0.0 113.347 -177.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.3 p-90 -69.22 -9.43 52.99 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 -174.33 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -111.98 -59.88 1.93 Allowed 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -178.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 45.8 mt -120.25 20.25 12.02 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -171.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.7 tt -52.0 138.09 35.58 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 125.764 1.626 . . . . 0.0 114.425 -177.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -72.75 168.27 24.97 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 124.749 3.633 . . . . 0.0 115.023 -176.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 22.1 mp0 -61.44 -18.22 57.9 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.983 1.713 . . . . 0.0 115.093 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 50.0 t30 -138.07 129.56 27.87 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.711 1.204 . . . . 0.0 111.442 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -157.9 149.63 21.77 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.953 1.701 . . . . 0.0 110.264 177.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 46.8 t -98.17 -12.17 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 124.892 1.277 . . . . 0.0 114.168 -176.162 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.98 35.35 0.13 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 125.804 1.641 . . . . 0.0 114.037 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 50.6 m -97.95 107.5 40.93 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 125.471 1.509 . . . . 0.0 113.013 -176.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -74.77 121.97 7.01 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 122.711 2.274 . . . . 0.0 109.726 177.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 83.6 mt -83.24 147.2 52.92 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.022 0.929 . . . . 0.0 113.363 -176.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -52.54 -35.37 66.52 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 124.08 3.187 . . . . 0.0 115.253 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 42.5 m -65.88 -15.4 62.9 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -131.22 20.35 4.85 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.112 1.765 . . . . 0.0 111.699 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.67 155.19 40.25 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.968 1.47 . . . . 0.0 114.968 -176.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.43 15.14 12.84 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 128.588 2.755 . . . . 0.0 113.775 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 35.2 t70 -66.92 -13.79 62.13 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.106 1.362 . . . . 0.0 113.649 -179.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.4 t70 -65.21 -17.48 64.52 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 120.759 -1.213 . . . . 0.0 112.218 174.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 25.3 tp -116.03 19.82 14.79 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 127.392 2.277 . . . . 0.0 111.558 178.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.9 tpt -65.1 141.72 58.62 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 -175.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.5 tt -125.05 148.52 48.47 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.438 2.295 . . . . 0.0 111.75 -176.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 43.3 t -72.63 138.88 80.45 Favored Pre-proline 0 N--CA 1.474 0.755 0 C-N-CA 124.101 0.961 . . . . 0.0 111.383 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -57.15 -26.5 69.69 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 122.659 2.239 . . . . 0.0 114.71 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.6 t70 -69.3 -21.35 63.87 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 121.452 -0.78 . . . . 0.0 112.658 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 19.1 t70 -89.97 -9.89 47.07 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.809 1.644 . . . . 0.0 113.699 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 63.0 mt -51.63 -38.42 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 125.031 1.332 . . . . 0.0 111.244 177.329 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -67.16 -9.74 43.08 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.233 1.413 . . . . 0.0 113.611 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -78.32 -29.63 47.78 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.032 -1.042 . . . . 0.0 111.661 175.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.2 p-90 -96.25 -42.65 8.07 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 118.247 -0.882 . . . . 0.0 112.186 176.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -95.72 109.68 21.93 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 104.921 -2.251 . . . . 0.0 104.921 169.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.81 144.11 33.82 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -170.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -119.97 -179.9 4.06 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.157 2.183 . . . . 0.0 110.013 176.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -63.03 139.83 97.57 Favored Pre-proline 0 CA--C 1.553 1.088 0 O-C-N 120.804 -1.185 . . . . 0.0 112.233 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.32 -8.28 19.57 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.12 3.213 . . . . 0.0 114.932 -177.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 68.23 -173.14 32.88 Favored Glycine 0 CA--C 1.542 1.747 0 C-N-CA 124.529 1.062 . . . . 0.0 114.486 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.31 -20.65 20.91 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.509 2.806 . . . . 0.0 113.673 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -84.34 -28.35 27.11 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.138 0.975 . . . . 0.0 113.453 -179.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 69.8 9.21 62.12 Favored Glycine 0 CA--C 1.539 1.531 0 C-N-CA 124.447 1.022 . . . . 0.0 115.54 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 19.1 m -54.69 -32.77 59.94 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.21 1.404 . . . . 0.0 114.619 -176.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 74.0 m -58.93 -29.89 67.45 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.491 1.116 . . . . 0.0 113.689 -179.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -61.59 -23.08 65.77 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.33 0.968 . . . . 0.0 113.491 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -79.27 -32.16 43.61 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.54 -0.725 . . . . 0.0 111.237 175.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -82.31 -40.48 10.08 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.078 1.323 . . . . 0.0 114.043 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 46.5 p -64.52 -20.9 66.49 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 118.623 1.211 . . . . 0.0 113.527 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -74.0 -21.32 60.03 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.981 0.912 . . . . 0.0 112.695 176.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 73.2 m -84.02 122.11 28.32 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.669 1.187 . . . . 0.0 109.94 178.255 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 69.26 78.09 0.37 Allowed Glycine 0 CA--C 1.539 1.532 0 C-N-CA 124.319 0.962 . . . . 0.0 112.486 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -58.36 156.72 29.35 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.676 2.917 . . . . 0.0 113.782 -179.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 25.2 p -59.26 -18.61 38.79 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 179.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -84.13 -9.46 58.57 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.688 1.195 . . . . 0.0 113.42 176.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 14.0 t70 -80.79 133.65 54.89 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.267 1.027 . . . . 0.0 111.913 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -57.58 -39.22 90.05 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.815 2.343 . . . . 0.0 114.577 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -63.52 -36.55 84.15 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.058 -1.026 . . . . 0.0 112.034 -179.514 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 48.5 tptt -60.73 -25.87 66.77 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.6 1.16 . . . . 0.0 112.35 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.96 -41.29 11.83 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.666 1.587 . . . . 0.0 110.668 175.006 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.6 mtpt -59.4 -34.16 72.11 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.243 1.017 . . . . 0.0 112.257 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 54.7 mt -62.46 -37.82 87.41 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.332 0.969 . . . . 0.0 111.932 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.9 mt -67.82 -51.82 46.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.709 0.804 . . . . 0.0 109.552 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -54.75 -55.07 33.86 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.656 1.182 . . . . 0.0 111.032 178.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -34.84 78.85 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -177.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -69.35 -45.41 69.46 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.074 0.852 . . . . 0.0 110.518 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 7.2 tp -62.71 -39.36 93.81 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.365 0.666 . . . . 0.0 111.146 178.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 71.7 t -60.51 -31.99 50.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 119.656 1.116 . . . . 0.0 110.987 175.164 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 7.9 tp -72.62 -28.55 62.82 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 120.714 -1.241 . . . . 0.0 112.299 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.35 -28.54 70.07 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 120.403 1.456 . . . . 0.0 110.178 174.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 1.9 mt -74.15 -51.34 15.87 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.96 0.904 . . . . 0.0 108.772 175.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 20.4 t60 -55.3 -54.77 39.41 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.512 0.725 . . . . 0.0 111.167 177.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.43 -23.16 36.63 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -178.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -90.06 -38.02 13.87 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.274 -0.891 . . . . 0.0 112.318 174.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 52.1 mttm -78.34 -25.04 46.28 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.607 1.563 . . . . 0.0 113.467 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 50.8 t -77.9 -53.48 7.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.418 2.287 . . . . 0.0 111.9 178.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -54.01 -32.59 54.69 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 121.185 -0.947 . . . . 0.0 112.518 177.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -62.63 -33.48 75.1 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.649 1.979 . . . . 0.0 112.602 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.16 -37.88 84.51 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.285 0.948 . . . . 0.0 111.475 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -71.98 -46.88 55.7 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.32 1.048 . . . . 0.0 110.15 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -62.29 -41.4 98.47 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.406 1.082 . . . . 0.0 113.513 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -75.39 -31.78 60.57 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -179.448 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -87.25 -43.35 12.26 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.948 0.899 . . . . 0.0 113.267 -179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 79.6 -6.67 57.4 Favored Glycine 0 CA--C 1.54 1.638 0 N-CA-C 116.74 1.456 . . . . 0.0 116.74 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -120.12 -43.3 2.54 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.954 1.877 . . . . 0.0 113.338 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 17.3 m -78.08 147.65 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 118.94 0.791 . . . . 0.0 111.692 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -93.55 155.36 17.36 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.715 1.206 . . . . 0.0 112.768 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -82.02 -177.22 6.52 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.053 1.341 . . . . 0.0 112.01 176.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 6.2 m -52.1 146.01 9.53 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 116.164 1.913 . . . . 0.0 116.164 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 65.0 p -93.65 -6.11 47.11 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.345 1.858 . . . . 0.0 111.18 170.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 3.7 tt -61.3 119.08 42.94 Favored Pre-proline 0 CA--C 1.554 1.119 0 C-N-CA 128.284 2.634 . . . . 0.0 108.472 178.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -60.93 -41.12 47.26 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.973 2.449 . . . . 0.0 114.487 -173.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 70.5 m80 -69.12 -29.46 67.53 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.46 -0.775 . . . . 0.0 113.058 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 51.2 t -69.44 -52.61 25.18 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.023 1.329 . . . . 0.0 108.518 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -54.78 -34.81 63.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.378 1.471 . . . . 0.0 111.602 174.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 21.4 m -71.08 -59.02 3.01 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.779 1.231 . . . . 0.0 111.591 176.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.0 mmt -62.97 -33.68 75.9 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -64.99 -32.64 74.46 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 120.81 1.641 . . . . 0.0 112.482 177.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -72.79 -38.15 67.35 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.233 0.613 . . . . 0.0 110.452 174.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 96.0 t -63.47 -46.87 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.491 0.587 . . . . 0.0 110.456 176.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -46.47 85.93 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.04 0.836 . . . . 0.0 111.136 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -66.36 -19.52 65.83 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 177.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 65.3 t60 -86.61 -49.38 7.57 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.089 0.858 . . . . 0.0 109.49 173.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 34.9 ttp -57.01 -28.99 62.97 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.445 1.898 . . . . 0.0 113.59 -177.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 16.3 p -70.29 -27.93 64.79 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.954 0.902 . . . . 0.0 112.738 175.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 73.1 m80 -101.62 -18.24 15.98 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.762 1.625 . . . . 0.0 113.906 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 16.8 t -61.5 155.24 22.48 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.183 1.393 . . . . 0.0 112.562 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -126.7 -12.23 6.04 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.782 1.633 . . . . 0.0 113.702 -178.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -96.52 -27.67 14.75 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.351 1.06 . . . . 0.0 112.051 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.23 -114.41 4.19 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.777 1.18 . . . . 0.0 113.406 177.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -62.13 -16.38 52.2 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 121.325 -1.103 . . . . 0.0 113.444 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.24 -0.51 43.93 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.342 1.457 . . . . 0.0 113.382 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.6 t -60.32 142.61 54.51 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 122.403 1.097 . . . . 0.0 110.634 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.0 mm-40 -77.86 -9.44 59.06 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.696 1.198 . . . . 0.0 113.015 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 99.8 t -88.58 115.22 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.6 -41.76 66.97 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -65.76 -41.49 92.03 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.505 0.722 . . . . 0.0 112.884 -179.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 41.1 t -61.35 -56.4 20.82 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.718 1.207 . . . . 0.0 110.665 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.42 -30.97 69.96 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.293 0.637 . . . . 0.0 112.632 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 74.7 m -71.64 -51.05 25.15 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.981 0.912 . . . . 0.0 111.161 176.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 33.6 m -58.38 -36.61 73.77 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.952 0.901 . . . . 0.0 112.146 176.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.24 -30.46 71.12 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 118.092 -0.956 . . . . 0.0 113.179 175.623 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -69.11 -27.46 65.6 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.664 1.12 . . . . 0.0 110.828 176.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.3 mm -74.29 -48.41 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.772 0.829 . . . . 0.0 109.58 175.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 20.2 mm -59.14 -40.56 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.403 1.081 . . . . 0.0 110.714 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 49.9 m -62.14 -22.25 65.71 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.961 0.904 . . . . 0.0 113.068 177.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.3 t60 -66.52 -56.95 8.47 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.514 1.052 . . . . 0.0 109.966 176.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 42.9 m95 -61.47 -32.66 72.67 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.273 0.942 . . . . 0.0 112.966 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -65.45 -28.55 69.31 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.352 -0.843 . . . . 0.0 112.948 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -100.02 -50.02 4.13 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.776 1.23 . . . . 0.0 114.271 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 11.1 t -79.87 132.21 36.04 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.629 1.972 . . . . 0.0 112.525 -176.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 4.4 t -130.14 -2.36 4.54 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.2 1.4 . . . . 0.0 113.872 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 83.5 mtt-85 -69.51 145.74 52.43 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.94 1.296 . . . . 0.0 113.478 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 85.0 t60 -79.79 -34.72 39.41 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 169.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -86.5 69.95 10.42 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.764 1.625 . . . . 0.0 112.14 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.7 t -136.28 133.06 19.24 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 126.055 1.742 . . . . 0.0 109.743 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -58.83 -25.07 75.05 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 122.86 2.373 . . . . 0.0 114.149 -178.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 17.6 t -92.17 -51.66 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 119.28 0.945 . . . . 0.0 111.961 176.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.4 m -71.28 -35.66 71.42 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -174.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.37 -56.56 25.21 Favored Pre-proline 0 N--CA 1.474 0.749 0 CA-C-N 119.773 1.169 . . . . 0.0 113.204 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -60.52 -33.49 93.74 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.032 1.821 . . . . 0.0 113.089 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 94.9 mt -68.4 -45.56 72.34 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.973 0.806 . . . . 0.0 111.565 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 55.4 mttm -61.94 -45.01 95.57 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.911 0.884 . . . . 0.0 109.834 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 19.2 t30 -61.38 -40.9 96.04 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.938 1.295 . . . . 0.0 112.411 176.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -76.43 -19.36 58.16 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.468 1.107 . . . . 0.0 113.935 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 25.1 p -67.42 152.64 45.33 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -177.107 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -69.11 -27.14 65.32 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.178 0.991 . . . . 0.0 113.615 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -89.06 -18.77 26.62 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.543 1.137 . . . . 0.0 113.058 178.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 . . . . . 0 N--CA 1.476 0.873 0 C-N-CA 125.865 1.666 . . . . 0.0 110.44 179.497 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.494 0 N-CA-C 114.74 0.656 . . . . 0.0 114.74 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.9 p -74.89 -19.0 60.33 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.247 1.419 . . . . 0.0 113.925 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -138.15 159.11 42.88 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.836 2.055 . . . . 0.0 110.888 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 45.3 ttp -80.08 59.02 3.14 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.651 1.18 . . . . 0.0 111.457 178.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -91.46 -3.82 56.22 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.592 1.557 . . . . 0.0 114.071 -178.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -72.82 148.28 89.52 Favored Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 124.927 1.291 . . . . 0.0 112.65 178.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -69.21 150.13 71.18 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 123.172 2.581 . . . . 0.0 112.704 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -132.28 18.97 4.42 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.226 1.411 . . . . 0.0 113.728 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 41.3 p -78.44 -19.6 52.83 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.053 1.341 . . . . 0.0 114.317 -179.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 14.4 t70 -75.2 132.17 76.98 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 124.282 1.033 . . . . 0.0 110.936 178.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.73 -12.4 34.48 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 123.422 2.748 . . . . 0.0 115.376 -177.273 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 1.6 t -106.47 8.43 31.47 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.895 1.678 . . . . 0.0 113.531 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 6.4 p -67.01 141.12 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 O-C-N 120.754 -1.217 . . . . 0.0 112.405 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -153.44 148.37 19.76 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 124.672 1.189 . . . . 0.0 111.816 177.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -60.07 -44.31 30.38 Favored 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 123.054 2.502 . . . . 0.0 117.26 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -86.24 -179.9 3.34 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 123.503 2.802 . . . . 0.0 113.875 -176.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 7.4 tt -97.18 137.1 36.73 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.765 1.626 . . . . 0.0 110.52 176.154 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 51.1 m -82.64 141.66 32.33 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.399 1.08 . . . . 0.0 111.683 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 21.0 mm100 -56.13 -33.09 64.83 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -178.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -69.25 -18.12 63.84 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 178.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 87.1 m -61.17 -60.07 4.33 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.284 0.947 . . . . 0.0 110.698 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -60.21 -31.85 70.55 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 49.9 m -68.45 -34.52 76.11 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.76 0.709 . . . . 0.0 112.804 178.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.1 t70 -90.3 -24.32 20.92 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 174.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.6 tt -46.09 -60.08 2.49 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.233 1.813 . . . . 0.0 113.588 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 51.0 p-90 -65.11 -10.24 29.08 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -173.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 58.4 pttt -111.97 -53.46 2.7 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 6.2 mp -120.16 20.03 12.11 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 116.774 2.138 . . . . 0.0 116.774 -175.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.81 140.1 29.91 Favored Pre-proline 0 N--CA 1.483 1.217 0 O-C-N 120.223 -1.548 . . . . 0.0 114.885 -178.527 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -79.5 159.79 25.55 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 124.04 3.16 . . . . 0.0 113.541 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 12.7 mp0 -66.84 -25.59 66.5 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.899 1.28 . . . . 0.0 112.802 177.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 49.5 t30 -82.16 75.21 9.09 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.252 1.421 . . . . 0.0 112.154 -179.39 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 8.2 p30 -147.89 153.93 39.74 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.835 1.254 . . . . 0.0 111.645 177.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 34.2 m -136.18 18.98 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 C-N-CA 125.264 1.425 . . . . 0.0 113.733 -178.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 40.2 tp -82.0 -10.3 59.29 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -175.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 2.8 p -63.74 119.47 54.68 Favored Pre-proline 0 CA--C 1.547 0.844 0 O-C-N 120.671 -1.268 . . . . 0.0 113.372 -179.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -76.29 146.75 28.52 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.014 2.476 . . . . 0.0 111.03 177.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 10.3 mp -69.62 138.41 88.46 Favored Pre-proline 0 CA--C 1.547 0.832 0 CA-C-O 118.102 -0.951 . . . . 0.0 110.238 178.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -53.5 -29.95 51.79 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.235 2.623 . . . . 0.0 115.127 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 54.3 p -80.77 -12.31 59.47 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.636 1.575 . . . . 0.0 114.199 177.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -119.0 -16.83 9.15 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.054 1.741 . . . . 0.0 113.59 -178.565 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -64.08 157.88 24.2 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.614 1.566 . . . . 0.0 114.206 -177.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -73.28 23.99 0.07 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 128.415 2.686 . . . . 0.0 114.668 178.606 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 31.0 t70 -68.86 -20.36 64.27 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.816 1.246 . . . . 0.0 113.873 -178.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -63.96 -16.34 61.32 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 121.057 -1.027 . . . . 0.0 113.278 178.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 27.4 tp -110.16 7.87 23.53 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 126.853 2.061 . . . . 0.0 111.968 178.565 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 10.8 tpt -70.95 147.87 48.27 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 14.5 mt -118.81 160.9 21.06 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.852 1.661 . . . . 0.0 113.144 -178.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 43.3 t -71.71 145.0 89.13 Favored Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 169.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -58.19 -14.76 20.65 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 123.095 2.53 . . . . 0.0 116.357 -175.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -72.93 -22.99 60.64 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.32 -0.862 . . . . 0.0 112.886 177.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 14.9 t70 -84.8 -10.08 57.55 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.406 1.082 . . . . 0.0 113.006 178.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 91.7 mt -56.59 -34.94 43.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.569 1.148 . . . . 0.0 110.584 176.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -73.45 -9.89 59.16 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.819 1.248 . . . . 0.0 113.641 178.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -84.33 -24.61 29.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.067 0.947 . . . . 0.0 112.773 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -72.29 -48.71 40.3 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.476 1.034 . . . . 0.0 111.756 -179.646 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -87.14 109.96 19.8 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 176.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 1.5 m -54.25 134.1 44.77 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 -172.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -105.65 173.71 6.19 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.424 1.889 . . . . 0.0 112.428 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 13.1 t70 -64.93 131.98 95.35 Favored Pre-proline 0 CA--C 1.556 1.181 0 O-C-N 121.122 -0.986 . . . . 0.0 111.743 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -75.25 -11.7 21.04 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 123.725 2.95 . . . . 0.0 115.467 -177.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 69.68 -168.44 46.43 Favored Glycine 0 CA--C 1.543 1.807 0 C-N-CA 124.291 0.948 . . . . 0.0 113.643 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -73.73 -19.17 21.49 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.541 2.827 . . . . 0.0 113.708 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 19.4 t70 -87.77 -56.54 3.3 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.773 1.229 . . . . 0.0 112.829 -179.016 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 62.67 9.31 25.29 Favored Glycine 0 CA--C 1.533 1.216 0 N-CA-C 118.14 2.016 . . . . 0.0 118.14 177.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 70.8 m -70.45 117.51 12.08 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 120.4 2.1 . . . . 0.0 108.277 175.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 20.9 p -77.97 165.4 24.11 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.571 1.549 . . . . 0.0 113.997 -176.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -133.42 169.85 16.34 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.088 1.355 . . . . 0.0 114.061 -173.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 66.4 m-20 -63.97 144.03 57.4 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 121.486 -0.759 . . . . 0.0 109.333 174.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . 93.38 -12.31 69.92 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.556 1.074 . . . . 0.0 113.051 -175.184 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 11.1 t -130.08 -46.98 1.12 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.389 1.476 . . . . 0.0 110.867 174.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -74.17 -38.35 63.71 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.939 0.896 . . . . 0.0 111.886 175.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 41.4 p -85.16 -10.26 56.91 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.53 1.532 . . . . 0.0 113.465 179.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -154.54 81.21 0.18 Allowed Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.295 1.426 . . . . 0.0 112.302 179.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -63.04 171.68 5.88 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.152 3.234 . . . . 0.0 113.37 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 35.4 p -55.61 -23.46 27.65 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -86.13 -5.72 59.15 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.968 1.307 . . . . 0.0 113.707 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 16.2 t70 -74.1 138.6 75.74 Favored Pre-proline 0 CA--C 1.549 0.915 0 O-C-N 120.736 -1.227 . . . . 0.0 111.575 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.58 -41.16 80.58 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.802 2.335 . . . . 0.0 114.04 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -67.91 -41.91 81.93 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 121.231 -0.918 . . . . 0.0 111.883 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 20.7 tptm -58.68 -35.05 71.98 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.873 0.869 . . . . 0.0 111.501 177.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 78.4 mtm180 -76.76 -43.96 34.92 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.088 1.355 . . . . 0.0 111.311 175.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -56.72 -35.22 68.3 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.252 1.021 . . . . 0.0 112.111 175.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 57.3 mt -59.63 -37.94 80.01 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.202 0.91 . . . . 0.0 112.016 177.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -67.1 -54.59 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 118.703 0.683 . . . . 0.0 109.245 175.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -52.71 -51.75 59.1 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.462 1.105 . . . . 0.0 112.011 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -35.17 78.63 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.338 -0.851 . . . . 0.0 113.178 -179.087 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -71.41 -42.54 68.17 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.569 1.077 . . . . 0.0 109.693 178.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.5 tt -61.81 -44.44 96.86 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.706 1.602 . . . . 0.0 110.723 178.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 89.1 t -61.81 -26.64 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 O-C-N 120.589 -1.32 . . . . 0.0 110.904 174.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.78 -27.53 58.04 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 120.465 -1.397 . . . . 0.0 111.939 173.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.7 mp -61.14 -41.17 96.24 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.478 1.49 . . . . 0.0 107.878 169.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.84 -48.72 73.31 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.503 -0.76 . . . . 0.0 111.074 176.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 15.3 t60 -55.13 -52.47 63.18 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.033 0.833 . . . . 0.0 109.743 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -60.08 -24.34 64.52 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -178.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -88.26 -29.03 20.72 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.16 0.891 . . . . 0.0 112.467 175.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 59.7 mttm -85.37 -39.56 17.47 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.52 1.528 . . . . 0.0 113.084 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.8 t -60.62 -44.6 96.16 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.362 1.865 . . . . 0.0 110.755 176.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -65.45 -38.85 91.04 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 121.415 -0.803 . . . . 0.0 112.069 174.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -69.18 -35.97 76.84 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.665 1.186 . . . . 0.0 111.84 -179.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -56.52 -42.42 78.38 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.147 1.779 . . . . 0.0 111.704 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -74.65 -38.85 62.37 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.002 0.521 . . . . 0.0 111.352 177.326 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -64.79 -36.32 83.94 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.472 -0.768 . . . . 0.0 111.864 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -81.18 -25.61 36.65 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.493 1.517 . . . . 0.0 113.782 179.17 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -140.02 109.48 6.23 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.565 1.146 . . . . 0.0 112.544 -177.334 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . -69.8 -10.92 65.27 Favored Glycine 0 CA--C 1.539 1.576 0 N-CA-C 115.518 0.967 . . . . 0.0 115.518 178.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -82.81 -8.11 59.61 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 119.086 1.443 . . . . 0.0 113.286 179.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 35.8 m -131.46 163.16 37.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 125.934 1.694 . . . . 0.0 112.042 179.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 50.4 ptt85 -124.94 161.9 25.62 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 125.306 1.442 . . . . 0.0 113.208 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -68.16 157.73 34.73 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.04 0.936 . . . . 0.0 109.812 173.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 1.9 p -74.54 175.16 8.06 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -177.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 72.1 p -105.35 9.35 33.82 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.277 1.831 . . . . 0.0 114.394 -178.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 14.7 tp -66.76 130.54 94.01 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 124.557 1.143 . . . . 0.0 111.261 -179.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -64.79 -37.59 34.66 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.769 2.313 . . . . 0.0 113.549 -177.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 44.8 m80 -71.26 -32.89 69.26 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.463 -0.773 . . . . 0.0 112.286 177.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.0 t -65.12 -51.16 62.93 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.847 0.748 . . . . 0.0 109.174 174.273 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -53.6 -34.3 57.93 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.064 1.346 . . . . 0.0 111.972 174.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 52.7 m -73.6 -61.06 1.97 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.162 0.985 . . . . 0.0 111.679 176.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 21.9 mmm -64.28 -30.21 71.27 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 -175.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -65.31 -34.34 78.1 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 120.727 1.603 . . . . 0.0 112.084 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -70.8 -37.27 73.26 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.41 0.684 . . . . 0.0 110.353 175.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 90.3 t -64.6 -48.63 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.578 0.751 . . . . 0.0 110.379 176.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.13 -43.57 91.99 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.976 0.911 . . . . 0.0 111.703 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -68.66 -17.13 64.03 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 177.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 72.0 t60 -90.13 -50.84 5.77 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.727 1.211 . . . . 0.0 109.997 174.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 38.7 ttp -57.31 -26.46 60.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.581 1.953 . . . . 0.0 113.513 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 2.8 p -60.31 -35.45 75.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.803 1.241 . . . . 0.0 112.886 176.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -111.94 -10.2 13.98 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.86 1.264 . . . . 0.0 114.322 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 43.4 t -63.55 129.85 41.91 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.105 0.866 . . . . 0.0 111.434 178.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -101.05 -16.12 17.21 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.103 1.361 . . . . 0.0 114.072 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.31 -31.13 20.36 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.024 0.829 . . . . 0.0 111.758 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.36 -110.77 1.48 Allowed Glycine 0 CA--C 1.532 1.114 0 C-N-CA 124.494 1.045 . . . . 0.0 112.94 178.175 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.53 -20.39 60.13 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 121.384 -1.068 . . . . 0.0 113.187 177.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -96.54 -2.36 45.21 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.621 1.568 . . . . 0.0 113.567 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.7 t -62.5 142.38 57.96 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.145 0.974 . . . . 0.0 110.011 177.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -81.62 -5.28 57.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.254 1.022 . . . . 0.0 113.565 -176.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.0 t -89.22 115.44 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.91 -43.56 73.37 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -62.63 -38.19 89.27 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.509 0.724 . . . . 0.0 112.872 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.6 t -67.13 -57.74 6.21 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.488 1.515 . . . . 0.0 110.165 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -55.21 -36.39 65.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.033 0.933 . . . . 0.0 112.439 178.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 13.1 m -69.95 -51.56 31.7 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 124.045 0.938 . . . . 0.0 112.394 175.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 70.2 m -61.09 -37.35 82.43 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.19 -0.944 . . . . 0.0 112.066 -179.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.41 -33.78 68.23 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.141 0.976 . . . . 0.0 112.165 176.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -67.46 -31.02 70.89 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.934 0.893 . . . . 0.0 112.057 177.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.5 mt -77.46 -45.33 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-N 118.514 0.597 . . . . 0.0 110.01 176.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 28.5 mm -58.37 -38.58 70.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.832 0.853 . . . . 0.0 110.011 176.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 67.9 m -62.23 -24.98 67.56 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.17 0.988 . . . . 0.0 113.222 176.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.1 t60 -64.81 -55.88 16.91 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.836 1.198 . . . . 0.0 109.526 176.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 48.4 m95 -59.27 -33.48 71.1 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 178.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -68.41 -30.14 68.99 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 177.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -100.09 -34.86 9.89 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.5 t -75.86 131.58 39.79 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.41 1.484 . . . . 0.0 112.95 -175.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 67.7 p -130.07 0.6 4.72 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 126.022 1.729 . . . . 0.0 113.421 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 47.6 ttt85 -74.73 135.67 41.79 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.79 1.636 . . . . 0.0 111.22 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 43.2 p-80 -75.33 -36.6 61.01 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 121.897 -0.502 . . . . 0.0 112.166 178.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -101.74 69.98 1.23 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.546 1.538 . . . . 0.0 112.462 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 44.7 t -114.62 132.79 22.71 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 126.546 1.938 . . . . 0.0 108.427 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -59.12 -26.17 80.69 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.899 2.4 . . . . 0.0 115.03 -176.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 41.8 t -92.22 -49.59 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-N 119.232 0.923 . . . . 0.0 111.601 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 13.0 m -68.88 -43.99 74.16 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.297 1.221 . . . . 0.0 114.297 -176.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.1 tt -53.21 -56.57 22.77 Favored Pre-proline 0 CA--C 1.548 0.877 0 CA-C-O 117.891 -1.052 . . . . 0.0 113.105 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -60.95 -32.68 92.72 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 121.873 1.716 . . . . 0.0 113.188 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 92.6 mt -70.16 -44.06 69.57 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.215 0.916 . . . . 0.0 111.637 177.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -60.44 -37.71 81.81 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.496 1.119 . . . . 0.0 110.731 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 17.3 t30 -73.43 -41.32 63.41 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.653 1.581 . . . . 0.0 113.087 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -79.33 -31.12 43.04 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -177.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 40.2 t -66.66 143.58 56.89 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -177.199 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -87.26 -11.42 49.7 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.386 1.074 . . . . 0.0 112.173 175.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -85.57 36.99 0.67 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 126.076 1.75 . . . . 0.0 112.542 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 33.8 ptt-85 . . . . . 0 N--CA 1.475 0.821 0 C-N-CA 127.099 2.16 . . . . 0.0 114.256 -178.108 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.415 0 N-CA-C 114.816 0.686 . . . . 0.0 114.816 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.5 m -69.24 -15.8 63.45 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.272 1.429 . . . . 0.0 114.368 -179.085 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -145.52 150.29 36.17 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.281 1.832 . . . . 0.0 111.065 179.085 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 26.3 mmt -129.09 145.52 51.26 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.661 1.584 . . . . 0.0 111.197 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.73 -28.96 62.96 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.958 0.903 . . . . 0.0 113.183 -179.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -136.66 154.23 76.42 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 125.502 1.521 . . . . 0.0 111.831 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -60.56 152.29 69.43 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 123.531 2.82 . . . . 0.0 113.971 179.211 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -72.03 -28.5 63.4 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.964 0.905 . . . . 0.0 112.556 178.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 79.0 p -150.02 164.71 34.79 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.144 1.778 . . . . 0.0 111.731 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 21.6 t70 -139.74 123.0 10.51 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 124.851 1.261 . . . . 0.0 111.483 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -81.22 -26.07 3.6 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.04 2.493 . . . . 0.0 113.696 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 16.2 m -59.7 -19.74 51.76 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.963 1.705 . . . . 0.0 115.461 -176.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 9.8 p -72.62 -20.83 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.049 0.939 . . . . 0.0 112.544 177.42 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -91.28 133.02 32.34 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 124.59 1.156 . . . . 0.0 111.788 179.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -56.31 -47.89 22.03 Favored 'Trans proline' 0 CA--C 1.553 1.44 0 C-N-CA 122.954 2.436 . . . . 0.0 115.608 178.309 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -79.29 165.56 23.35 Favored 'Trans proline' 0 C--N 1.356 0.946 0 C-N-CA 122.859 2.373 . . . . 0.0 112.453 178.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 72.6 mt -63.19 139.56 58.78 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 121.652 -0.655 . . . . 0.0 111.325 175.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 56.2 p -68.04 -24.82 65.13 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 169.247 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 13.4 mp0 -81.1 -2.11 46.97 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 128.973 2.909 . . . . 0.0 114.081 175.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.21 -11.34 49.25 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 122.042 2.201 . . . . 0.0 111.338 174.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 9.6 t -48.06 -29.08 3.23 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.195 2.198 . . . . 0.0 111.388 170.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -50.73 -31.95 18.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.089 1.356 . . . . 0.0 112.998 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 26.9 m -72.58 -30.84 64.74 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.932 0.893 . . . . 0.0 113.153 178.029 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 30.8 t70 -90.28 -30.15 17.69 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.53 1.532 . . . . 0.0 113.277 174.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 1.8 tt -45.68 -60.03 2.43 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 128.276 2.63 . . . . 0.0 112.969 -175.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.4 p-90 -63.33 -13.85 43.4 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -174.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -112.07 -52.33 2.79 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 117.557 2.428 . . . . 0.0 117.557 -177.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 69.8 mt -120.03 20.46 12.11 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 116.319 1.97 . . . . 0.0 116.319 -169.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 12.9 tp -51.8 135.69 36.23 Favored Pre-proline 0 CA--C 1.549 0.931 0 N-CA-C 115.911 1.819 . . . . 0.0 115.911 -172.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -77.33 162.53 30.95 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 123.321 2.68 . . . . 0.0 110.515 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -77.89 -15.9 58.66 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 120.813 -1.18 . . . . 0.0 113.556 179.101 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 48.4 t30 -92.85 87.61 5.89 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.958 1.303 . . . . 0.0 111.581 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -151.4 151.24 31.43 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.193 1.397 . . . . 0.0 111.075 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 29.1 m -127.02 13.53 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -178.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 26.9 tp -75.69 -10.6 59.57 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.905 -1.122 . . . . 0.0 113.512 178.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 5.5 m -52.15 114.55 5.57 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 125.941 1.696 . . . . 0.0 113.358 -178.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.04 132.29 21.0 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 122.255 1.97 . . . . 0.0 110.243 178.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 21.3 tp -74.1 130.62 82.4 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 124.274 1.029 . . . . 0.0 111.154 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -51.71 -32.05 43.8 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 123.818 3.012 . . . . 0.0 116.295 -177.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 73.5 p -72.57 -14.3 61.59 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 178.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -128.78 13.9 6.39 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.345 1.858 . . . . 0.0 112.344 179.392 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -73.16 161.72 30.25 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.064 1.345 . . . . 0.0 114.221 -177.56 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.58 17.81 3.09 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.673 2.389 . . . . 0.0 113.59 178.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -66.79 -14.12 62.27 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.404 1.482 . . . . 0.0 114.752 -177.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 37.3 t70 -68.42 -16.16 63.81 Favored 'General case' 0 CA--C 1.55 0.954 0 O-C-N 121.127 -0.983 . . . . 0.0 112.447 176.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 21.7 tp -117.81 20.4 13.39 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 127.344 2.258 . . . . 0.0 111.641 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.8 tpt -70.25 143.97 51.97 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 116.369 1.988 . . . . 0.0 116.369 -174.265 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 71.2 mt -125.02 153.15 43.27 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 127.015 2.126 . . . . 0.0 113.63 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 37.0 p -81.61 161.91 59.91 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 123.454 0.702 . . . . 0.0 110.075 171.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -59.67 -21.35 62.5 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.468 2.112 . . . . 0.0 114.869 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -76.66 -22.04 54.58 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.727 0.811 . . . . 0.0 113.099 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -80.18 -19.4 47.19 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.751 0.82 . . . . 0.0 112.664 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 64.7 mt -55.03 -38.07 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.869 1.668 . . . . 0.0 111.57 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.82 -9.87 48.11 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -82.88 -26.75 31.26 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.943 0.897 . . . . 0.0 112.36 177.019 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.273 4.2 p-90 -102.8 -25.45 13.51 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.413 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -120.5 109.62 15.51 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 103.709 -2.7 . . . . 0.0 103.709 169.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 4.2 m -125.19 146.31 49.57 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.645 0.778 . . . . 0.0 112.872 -171.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -75.07 162.19 28.76 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.231 1.012 . . . . 0.0 111.939 177.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 11.9 t70 -64.73 125.7 89.39 Favored Pre-proline 0 CA--C 1.555 1.141 0 O-C-N 121.264 -0.897 . . . . 0.0 111.657 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -83.24 0.27 9.61 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 124.104 3.202 . . . . 0.0 115.332 -176.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 89.81 174.08 45.52 Favored Glycine 0 CA--C 1.541 1.675 0 C-N-CA 125.603 1.573 . . . . 0.0 113.474 -177.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -64.77 -23.06 63.22 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 123.773 2.982 . . . . 0.0 114.278 -178.033 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -91.17 -4.9 55.69 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.689 1.196 . . . . 0.0 113.138 177.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -84.11 92.59 1.71 Allowed Glycine 0 C--N 1.34 0.756 0 C-N-CA 124.939 1.257 . . . . 0.0 114.029 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 69.4 m -68.73 123.78 21.86 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 173.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 27.6 p -91.91 160.19 15.4 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.65 1.18 . . . . 0.0 113.479 -176.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -138.59 167.04 22.8 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.975 1.71 . . . . 0.0 111.325 -176.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 55.3 t30 -56.36 -30.82 63.15 Favored 'General case' 0 CA--C 1.551 0.986 0 O-C-N 121.001 -1.062 . . . . 0.0 112.468 177.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -81.77 -8.53 86.68 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.88 1.228 . . . . 0.0 115.488 177.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 78.5 p -124.99 -25.86 3.8 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 119.747 1.773 . . . . 0.0 114.757 -178.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -74.25 141.42 45.36 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.616 1.166 . . . . 0.0 111.538 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 72.5 p -100.2 -28.03 13.21 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -177.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -87.19 -71.98 1.29 Allowed Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.489 1.519 . . . . 0.0 113.515 -179.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -76.24 24.69 0.44 Allowed 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 124.936 3.757 . . . . 0.0 114.405 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 2.7 m -58.93 117.06 4.22 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.379 1.472 . . . . 0.0 111.33 -179.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -93.45 -21.34 19.55 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.71 1.204 . . . . 0.0 112.225 178.226 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 14.7 t70 -69.87 122.28 85.47 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 124.697 1.199 . . . . 0.0 111.351 178.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -75.05 -29.98 7.58 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.737 2.291 . . . . 0.0 113.728 -178.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -60.27 -40.89 91.98 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.229 -0.919 . . . . 0.0 111.779 179.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -56.46 -34.0 66.44 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 119.839 1.199 . . . . 0.0 112.43 177.204 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -76.28 -43.27 42.44 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.794 0.838 . . . . 0.0 111.285 175.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -61.86 -36.07 80.15 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.898 0.879 . . . . 0.0 111.892 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 64.3 mt -68.87 -38.45 79.73 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.659 1.184 . . . . 0.0 111.259 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 48.4 mt -61.76 -50.65 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 118.858 0.754 . . . . 0.0 109.257 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -56.01 -54.73 41.37 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.593 0.757 . . . . 0.0 111.039 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -35.21 80.3 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -177.06 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -68.36 -47.66 66.83 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.259 0.936 . . . . 0.0 109.892 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 10.7 tp -60.37 -39.29 86.7 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.479 0.711 . . . . 0.0 111.296 177.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 90.5 t -62.21 -31.12 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.791 1.178 . . . . 0.0 110.966 175.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.6 tp -73.61 -29.53 62.43 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.658 -1.276 . . . . 0.0 111.984 174.286 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.71 -29.8 69.57 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 120.219 1.372 . . . . 0.0 109.901 173.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.5 mt -74.19 -51.88 14.16 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.696 0.798 . . . . 0.0 109.302 175.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 24.4 t60 -55.07 -52.99 61.48 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.38 0.672 . . . . 0.0 111.597 178.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -59.12 -23.24 61.96 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -178.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -90.1 -32.88 16.49 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.171 0.896 . . . . 0.0 112.088 173.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 49.5 mttm -74.85 -38.24 62.04 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.842 1.257 . . . . 0.0 112.198 177.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 26.0 t -61.12 -50.0 74.98 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.22 2.208 . . . . 0.0 110.951 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -62.5 -37.34 85.64 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 121.33 -0.856 . . . . 0.0 112.216 175.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -65.23 -43.75 90.42 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.227 1.011 . . . . 0.0 111.229 175.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -59.72 -42.91 94.18 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.773 1.629 . . . . 0.0 111.308 177.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -65.17 -46.46 80.75 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 122.736 0.415 . . . . 0.0 110.877 177.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -63.79 -37.01 85.76 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.031 0.932 . . . . 0.0 112.735 178.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -66.3 -37.61 85.82 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.438 1.095 . . . . 0.0 113.401 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -89.61 -45.57 9.27 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.168 0.987 . . . . 0.0 113.079 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 76.53 -10.69 16.19 Favored Glycine 0 CA--C 1.541 1.691 0 N-CA-C 117.169 1.628 . . . . 0.0 117.169 178.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -108.79 -36.2 6.2 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.982 1.891 . . . . 0.0 113.205 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 34.0 m -74.76 163.66 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.478 1.111 . . . . 0.0 112.296 177.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -112.41 143.85 42.85 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.285 1.434 . . . . 0.0 111.097 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -73.09 174.92 7.24 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.024 1.33 . . . . 0.0 113.32 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 23.8 m -51.24 148.6 4.55 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.119 2.168 . . . . 0.0 116.463 -178.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 64.6 p -92.26 -5.4 52.46 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.245 1.818 . . . . 0.0 111.815 172.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 8.0 mt -58.53 120.99 49.64 Favored Pre-proline 0 CA--C 1.543 0.71 0 C-N-CA 126.056 1.742 . . . . 0.0 111.082 178.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 44.4 Cg_exo -57.74 -38.46 92.95 Favored 'Trans proline' 0 CA--C 1.536 0.58 0 C-N-CA 122.805 2.337 . . . . 0.0 112.002 177.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 59.5 m80 -73.05 -33.56 65.76 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.584 1.154 . . . . 0.0 113.623 179.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 45.3 t -67.4 -50.81 57.98 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.41 1.084 . . . . 0.0 108.389 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -55.82 -37.53 68.8 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.418 1.487 . . . . 0.0 111.433 173.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.3 m -67.96 -60.08 2.78 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.289 1.035 . . . . 0.0 111.241 176.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.8 mmt -62.17 -35.13 77.87 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -64.7 -32.52 74.23 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 120.922 1.692 . . . . 0.0 112.567 177.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.5 m-80 -72.87 -38.62 66.94 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.173 0.589 . . . . 0.0 110.592 174.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 58.1 t -63.76 -47.17 92.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-N 118.597 0.635 . . . . 0.0 110.558 176.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -44.94 86.22 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.54 0.736 . . . . 0.0 110.864 178.179 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -66.77 -17.66 64.98 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 176.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.7 t60 -90.04 -49.08 6.79 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.021 0.928 . . . . 0.0 109.951 173.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.1 ttp -56.47 -28.45 59.74 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.579 1.951 . . . . 0.0 113.258 -178.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 14.7 p -67.91 -29.4 68.47 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.383 1.073 . . . . 0.0 112.814 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -97.85 -28.9 13.64 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.645 1.578 . . . . 0.0 112.532 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.6 t -63.77 133.71 53.98 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.94 1.296 . . . . 0.0 112.966 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -109.25 -11.94 14.83 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.42 1.488 . . . . 0.0 113.833 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.53 -29.95 20.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.883 0.873 . . . . 0.0 111.409 178.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.41 -112.78 2.88 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.507 1.051 . . . . 0.0 112.963 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 59.5 tttm -60.86 -20.48 61.93 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.44 -1.035 . . . . 0.0 112.855 177.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -93.28 -2.64 54.79 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.955 1.302 . . . . 0.0 113.47 176.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 22.7 t -59.87 142.91 52.67 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 122.384 1.088 . . . . 0.0 110.277 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -78.81 -5.74 54.17 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.463 1.105 . . . . 0.0 113.488 -176.178 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 6.7 t -96.98 123.55 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.821 1.248 . . . . 0.0 108.715 175.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.28 -45.12 72.42 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -176.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -30.6 71.06 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 -178.357 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 54.0 t -72.27 -56.37 5.63 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.164 0.986 . . . . 0.0 109.738 178.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.73 -26.44 63.95 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 177.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 46.1 m -80.56 -45.31 17.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.819 0.847 . . . . 0.0 111.586 176.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 63.7 m -64.99 -34.55 78.71 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.316 1.046 . . . . 0.0 112.741 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.55 -30.86 70.92 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.332 -0.855 . . . . 0.0 111.879 176.461 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -68.41 -31.18 70.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.565 0.746 . . . . 0.0 111.764 177.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.3 mm -70.39 -45.6 74.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 30.1 mm -62.49 -39.35 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 124.887 1.275 . . . . 0.0 110.429 177.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 16.5 t -59.66 -29.95 68.41 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.413 1.085 . . . . 0.0 112.717 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.5 t60 -60.06 -51.76 68.24 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.146 0.884 . . . . 0.0 110.486 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 24.8 m95 -64.74 -24.52 67.59 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 14.2 mptt -75.91 -30.4 58.76 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.586 0.754 . . . . 0.0 112.509 176.007 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -100.04 -34.75 9.95 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -178.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.1 t -79.27 131.29 36.11 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.992 1.317 . . . . 0.0 112.924 -176.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.0 p -130.05 -3.88 4.51 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.815 1.646 . . . . 0.0 114.209 -178.765 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -82.44 141.76 32.47 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.551 1.54 . . . . 0.0 111.842 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 47.7 p-80 -77.45 -40.56 42.82 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.88 -0.513 . . . . 0.0 111.993 177.318 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.2 t70 -87.0 69.98 10.27 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.045 1.738 . . . . 0.0 111.518 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 41.9 t -121.34 133.55 24.24 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.305 1.842 . . . . 0.0 109.347 178.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -59.66 -24.0 73.71 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.608 2.205 . . . . 0.0 113.572 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 15.8 t -92.12 -54.97 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 119.268 0.94 . . . . 0.0 111.637 176.423 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 17.0 m -69.22 -35.29 76.03 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -174.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -57.08 -56.89 28.78 Favored Pre-proline 0 CA--C 1.548 0.889 0 CA-C-N 120.01 1.277 . . . . 0.0 112.629 -178.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -60.21 -32.8 94.89 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 121.84 1.693 . . . . 0.0 113.161 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.2 mt -68.7 -47.85 65.38 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 118.798 0.727 . . . . 0.0 111.929 178.183 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -59.65 -37.1 77.79 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.034 0.533 . . . . 0.0 111.772 176.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 14.0 t30 -70.46 -40.75 73.5 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.611 1.564 . . . . 0.0 112.33 177.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -79.97 -25.98 40.16 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 45.4 t -49.5 142.02 8.49 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.273 1.429 . . . . 0.0 113.969 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -74.73 -6.41 48.66 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.492 -0.755 . . . . 0.0 112.714 176.098 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -96.34 -2.25 46.14 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.61 1.564 . . . . 0.0 113.049 176.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 12.1 ptp180 . . . . . 0 N--CA 1.48 1.06 0 C-N-CA 127.184 2.194 . . . . 0.0 113.714 -178.998 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.51 0 N-CA-C 114.728 0.651 . . . . 0.0 114.728 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.0 m -73.87 -11.55 60.4 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.178 1.391 . . . . 0.0 114.202 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 28.7 p80 -144.64 169.2 18.44 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.458 1.903 . . . . 0.0 111.751 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 28.6 ptm -64.73 159.09 23.01 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.7 1.2 . . . . 0.0 113.771 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -138.23 156.97 47.18 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.839 1.656 . . . . 0.0 111.313 178.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -137.83 155.53 74.81 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 125.263 1.425 . . . . 0.0 111.799 179.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -58.72 150.04 73.16 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.537 2.824 . . . . 0.0 114.355 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -90.2 -3.97 57.52 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.62 1.168 . . . . 0.0 113.494 178.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 36.4 p -75.97 163.0 27.61 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.751 1.62 . . . . 0.0 112.811 178.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 12.1 t70 -126.74 124.83 24.23 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.922 1.289 . . . . 0.0 110.933 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -82.38 -14.12 9.51 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.971 3.114 . . . . 0.0 115.191 -177.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 18.9 m -79.52 -0.6 34.01 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.861 1.264 . . . . 0.0 113.818 -179.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 14.8 p -143.18 153.49 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 126.986 2.114 . . . . 0.0 109.661 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -128.8 87.32 55.06 Favored Pre-proline 0 N--CA 1.47 0.562 0 C-N-CA 123.845 0.858 . . . . 0.0 111.827 177.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -106.85 63.89 0.02 OUTLIER 'Trans proline' 0 CA--C 1.557 1.644 1 C-N-CA 126.068 4.512 . . . . 0.0 110.229 176.302 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -67.24 163.18 35.35 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.082 2.521 . . . . 0.0 114.723 -175.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.48 145.87 46.82 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.926 1.69 . . . . 0.0 111.515 175.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 52.6 m -66.61 125.69 26.58 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.037 0.935 . . . . 0.0 109.824 176.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -51.01 -33.25 24.19 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.617 1.71 . . . . 0.0 115.617 -173.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -74.1 -9.67 58.85 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 28.9 m -62.4 -57.35 11.59 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.161 -0.962 . . . . 0.0 111.132 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -60.13 -24.92 65.07 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.786 0.835 . . . . 0.0 112.737 176.514 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 11.2 m -70.19 -35.99 74.33 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.119 0.872 . . . . 0.0 113.104 179.169 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.8 t70 -90.18 -27.91 19.24 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.69 0.796 . . . . 0.0 112.818 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.8 tt -43.09 -58.4 2.47 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 126.919 2.088 . . . . 0.0 113.685 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 52.9 p-90 -70.18 -10.42 58.79 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -173.265 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 9.3 ptmm? -112.19 -59.91 1.93 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.251 1.945 . . . . 0.0 116.251 -175.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 59.1 mt -119.45 17.31 12.96 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 116.165 1.913 . . . . 0.0 116.165 -171.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.1 tt -54.82 138.36 63.39 Favored Pre-proline 0 CA--C 1.554 1.113 0 C-N-CA 126.154 1.781 . . . . 0.0 113.536 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.94 166.26 28.38 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 124.501 3.467 . . . . 0.0 114.186 -178.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.68 -27.13 25.98 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.598 2.073 . . . . 0.0 116.598 -177.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -116.58 137.38 52.22 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.78 1.232 . . . . 0.0 111.626 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -150.43 166.09 31.17 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.321 1.048 . . . . 0.0 112.502 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 27.4 m -116.65 -10.53 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 125.894 1.678 . . . . 0.0 114.919 -178.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 44.7 tp -87.32 -5.57 58.85 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.354 1.462 . . . . 0.0 113.236 -179.454 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 14.3 m -50.41 108.2 0.97 Allowed Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 127.482 2.313 . . . . 0.0 114.606 -177.431 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -64.4 119.73 6.84 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.4 2.733 . . . . 0.0 111.409 178.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 26.6 tp -74.48 127.58 87.25 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 124.745 1.218 . . . . 0.0 111.772 -178.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -52.1 -36.0 64.2 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 123.632 2.888 . . . . 0.0 114.641 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 12.9 m -65.63 -14.8 61.93 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.958 1.303 . . . . 0.0 114.149 178.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -129.47 13.7 6.02 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.58 1.952 . . . . 0.0 112.181 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -73.66 159.42 33.06 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 -175.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.45 9.54 20.5 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 128.533 2.733 . . . . 0.0 113.852 179.119 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -57.75 -15.37 7.82 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 -176.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -63.63 -20.79 65.97 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.234 1.014 . . . . 0.0 112.496 174.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 22.7 tp -113.81 19.15 16.89 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 127.631 2.373 . . . . 0.0 111.701 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 7.8 tpt -64.35 146.22 54.78 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 18.2 tp -125.02 151.5 45.5 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.032 2.133 . . . . 0.0 113.047 -174.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 62.0 m -82.87 145.18 49.42 Favored Pre-proline 0 N--CA 1.476 0.84 0 C-N-CA 123.501 0.72 . . . . 0.0 110.493 174.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.47 -30.58 74.39 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.839 2.359 . . . . 0.0 115.734 -177.508 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.47 -22.31 66.14 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 178.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -87.98 -10.06 51.58 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.568 1.147 . . . . 0.0 113.673 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 96.6 mt -58.43 -34.49 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 CA-C-N 119.29 0.95 . . . . 0.0 109.776 175.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -66.85 -9.9 42.5 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.432 1.893 . . . . 0.0 114.058 177.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -87.51 -26.84 22.98 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.821 0.848 . . . . 0.0 112.361 178.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -98.31 -33.91 10.89 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.787 0.835 . . . . 0.0 112.336 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -109.85 109.82 20.59 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 169.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 1.7 m -125.05 145.17 50.04 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 -169.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -115.23 161.52 18.34 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.686 1.994 . . . . 0.0 111.2 175.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 26.5 t0 -64.87 118.22 46.56 Favored Pre-proline 0 CA--C 1.552 1.028 0 O-C-N 121.478 -0.764 . . . . 0.0 111.58 -179.005 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -81.05 -17.33 9.42 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 123.17 2.58 . . . . 0.0 114.352 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 127.06 -152.15 18.55 Favored Glycine 0 CA--C 1.543 1.806 0 C-N-CA 125.748 1.642 . . . . 0.0 112.696 -177.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -59.65 -24.92 77.3 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 123.947 3.098 . . . . 0.0 114.054 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -82.94 9.8 9.26 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 127.213 2.205 . . . . 0.0 114.297 -179.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -72.02 50.47 1.23 Allowed Glycine 0 CA--C 1.535 1.299 0 C-N-CA 126.41 1.957 . . . . 0.0 116.212 -178.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 22.6 p -65.6 -50.63 64.36 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.66 1.23 . . . . 0.0 111.272 177.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 99.2 m -68.57 -30.22 68.94 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.96 0.904 . . . . 0.0 111.543 175.265 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 54.7 t80 -58.11 -26.83 63.11 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -178.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -64.14 -53.64 46.38 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.334 -0.854 . . . . 0.0 110.092 174.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -62.47 -39.59 98.01 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 123.933 0.778 . . . . 0.0 113.501 178.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 48.1 p -74.78 -0.71 19.18 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -113.71 -37.44 4.56 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.481 1.512 . . . . 0.0 112.386 175.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 68.7 p -79.58 -26.8 41.21 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -165.05 52.64 0.28 Allowed Glycine 0 CA--C 1.536 1.39 0 N-CA-C 116.793 1.477 . . . . 0.0 116.793 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.23 -27.15 48.74 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.954 2.436 . . . . 0.0 112.919 177.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 6.6 t -72.55 -10.5 59.86 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.061 1.345 . . . . 0.0 114.176 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -73.43 -16.29 61.32 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 12.2 t70 -93.49 118.45 67.56 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 124.383 1.073 . . . . 0.0 111.547 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -73.08 -31.94 9.13 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.833 2.355 . . . . 0.0 113.506 -178.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -64.86 -40.08 94.57 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.269 -0.894 . . . . 0.0 110.979 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 92.8 mttt -58.21 -46.97 84.89 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 118.582 0.628 . . . . 0.0 110.54 174.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -57.96 -46.63 84.83 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.68 0.792 . . . . 0.0 111.534 176.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -60.47 -40.13 90.11 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.548 0.739 . . . . 0.0 111.393 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 71.6 mt -66.15 -40.61 90.69 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 117.916 -1.04 . . . . 0.0 111.961 177.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -62.45 -52.93 53.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 CA-C-N 120.038 1.29 . . . . 0.0 109.267 175.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -54.02 -54.01 45.03 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.014 0.925 . . . . 0.0 111.148 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -65.06 -36.17 83.48 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.379 -0.826 . . . . 0.0 112.58 -179.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -68.04 -45.45 73.9 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.039 0.836 . . . . 0.0 110.599 177.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.6 tt -62.6 -41.29 98.88 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.185 0.994 . . . . 0.0 110.516 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 99.5 t -60.17 -32.16 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 CA-C-N 119.269 0.94 . . . . 0.0 111.031 174.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.8 tp -69.98 -31.21 68.79 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.812 -1.18 . . . . 0.0 112.313 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.41 -28.36 69.2 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 120.325 1.42 . . . . 0.0 110.062 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 5.2 mt -72.89 -50.45 23.69 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.365 1.066 . . . . 0.0 109.579 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.0 t60 -57.25 -55.95 28.07 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 122.768 0.427 . . . . 0.0 110.313 176.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.01 -25.24 43.57 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.879 1.272 . . . . 0.0 114.429 -178.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -90.11 -31.35 17.15 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 175.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 41.6 mttm -83.91 -36.16 23.54 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.598 1.159 . . . . 0.0 112.122 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.3 t -61.27 -53.75 52.79 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.092 2.157 . . . . 0.0 110.948 177.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -55.75 -29.92 60.38 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.042 -1.036 . . . . 0.0 113.121 176.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 8.2 mpt_? -80.47 -24.68 39.32 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.748 1.619 . . . . 0.0 113.216 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -30.0 71.16 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 119.839 1.199 . . . . 0.0 112.9 179.092 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -73.25 -23.96 60.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.368 0.667 . . . . 0.0 111.873 175.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -77.31 -35.07 55.24 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.053 -1.029 . . . . 0.0 109.912 174.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -75.12 -33.8 61.61 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.205 1.002 . . . . 0.0 112.625 176.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -135.82 111.79 9.55 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.518 1.527 . . . . 0.0 111.656 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . -76.03 -6.24 82.15 Favored Glycine 0 CA--C 1.539 1.532 0 N-CA-C 115.591 0.997 . . . . 0.0 115.591 179.258 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -85.89 -9.73 56.47 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.207 1.503 . . . . 0.0 114.216 -178.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 33.4 m -106.31 162.89 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 124.92 1.288 . . . . 0.0 113.062 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -110.13 171.36 7.5 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.185 1.794 . . . . 0.0 111.424 178.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -69.71 162.57 27.48 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.565 1.146 . . . . 0.0 113.414 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.66 147.7 50.9 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.93 1.692 . . . . 0.0 113.932 -178.174 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 50.4 m -94.49 -7.47 41.2 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.1 1.36 . . . . 0.0 113.382 178.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 49.8 tp -78.24 114.23 40.65 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 126.378 1.871 . . . . 0.0 110.619 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -56.69 -35.83 97.85 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.962 2.441 . . . . 0.0 114.344 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 57.8 m80 -69.55 -34.21 73.86 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 178.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 33.2 t -66.92 -50.17 63.25 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.313 1.045 . . . . 0.0 108.748 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -54.69 -34.39 62.24 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.341 1.456 . . . . 0.0 111.91 174.44 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 26.2 m -72.82 -58.44 3.34 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.672 1.189 . . . . 0.0 111.607 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -37.58 82.46 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.549 -0.719 . . . . 0.0 112.603 -178.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -62.7 -34.44 77.14 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.424 1.466 . . . . 0.0 113.071 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -71.04 -39.69 72.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.061 0.544 . . . . 0.0 110.421 175.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 94.5 t -64.38 -46.57 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.361 0.664 . . . . 0.0 110.831 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.92 -42.29 93.62 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.124 0.969 . . . . 0.0 111.84 178.568 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -66.59 -30.64 70.98 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 55.8 t60 -77.78 -48.67 16.02 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.988 0.813 . . . . 0.0 110.213 175.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 35.7 ttp -56.42 -31.86 64.32 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.303 1.841 . . . . 0.0 114.199 -177.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.7 t -77.48 -10.13 59.3 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 119.805 1.184 . . . . 0.0 112.999 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 50.8 m80 -114.28 -18.99 11.46 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.797 1.639 . . . . 0.0 113.175 177.264 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 34.8 t -57.57 145.62 33.04 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.493 1.517 . . . . 0.0 112.879 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -109.41 -14.86 14.35 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.821 1.648 . . . . 0.0 113.648 -179.207 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -104.55 -30.16 10.19 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.465 1.106 . . . . 0.0 112.666 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.99 -110.66 1.59 Allowed Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.61 1.1 . . . . 0.0 113.822 177.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.32 -15.77 60.92 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 120.93 -1.335 . . . . 0.0 113.372 177.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -99.52 -0.21 41.07 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.937 1.695 . . . . 0.0 113.011 174.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 15.4 t -63.71 142.03 58.55 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.326 1.05 . . . . 0.0 110.033 178.128 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -81.58 -5.25 57.84 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.287 1.035 . . . . 0.0 113.489 -176.043 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.8 t -87.22 114.49 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 172.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.78 -39.41 65.4 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -176.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -67.78 -41.05 83.83 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.344 0.658 . . . . 0.0 112.585 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.9 t -62.12 -54.82 35.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.981 1.312 . . . . 0.0 110.198 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.6 -22.96 64.31 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.044 0.938 . . . . 0.0 113.078 177.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.4 m -82.01 -52.06 7.42 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.051 0.941 . . . . 0.0 111.939 176.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 41.7 m -61.05 -34.18 74.47 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 119.17 0.895 . . . . 0.0 112.056 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -60.04 -31.31 69.85 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.285 -0.885 . . . . 0.0 112.759 175.008 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -69.11 -30.7 69.04 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.707 1.14 . . . . 0.0 111.229 176.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 15.0 mt -74.27 -48.42 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.502 1.121 . . . . 0.0 109.929 176.026 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 25.8 mm -61.86 -37.47 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.939 0.895 . . . . 0.0 111.046 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 73.1 m -61.74 -24.83 67.06 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.395 -0.815 . . . . 0.0 112.869 176.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 10.0 t60 -64.91 -54.85 24.21 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.411 1.005 . . . . 0.0 109.963 176.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 46.3 m95 -62.05 -28.83 69.87 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 177.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -71.03 -29.93 65.99 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.784 0.834 . . . . 0.0 112.709 177.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -100.19 -40.85 7.36 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.2 t -77.76 135.45 38.0 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.472 1.509 . . . . 0.0 112.381 -177.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 3.8 t -130.11 2.76 4.77 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.542 1.537 . . . . 0.0 114.008 -179.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -78.25 153.49 31.82 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.207 1.403 . . . . 0.0 114.207 -177.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 80.6 t60 -86.89 -39.26 15.97 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.086 0.955 . . . . 0.0 109.859 170.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.7 t70 -93.71 78.59 4.25 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.654 1.582 . . . . 0.0 111.682 178.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.2 t -137.79 135.06 18.52 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 126.882 2.073 . . . . 0.0 108.887 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -58.56 -26.95 80.85 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 122.809 2.339 . . . . 0.0 114.799 -177.125 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 4.9 t -92.11 -50.68 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 119.653 1.115 . . . . 0.0 111.869 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.7 m -69.92 -39.21 76.29 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -175.13 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.5 tt -53.34 -57.7 15.73 Favored Pre-proline 0 N--CA 1.474 0.746 0 CA-C-O 117.588 -1.196 . . . . 0.0 112.781 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.62 -32.7 93.64 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-N 121.569 1.596 . . . . 0.0 113.424 -179.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.27 -46.8 63.62 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.636 1.107 . . . . 0.0 112.011 178.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -64.49 -30.52 71.55 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.346 1.059 . . . . 0.0 111.416 177.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 37.8 t30 -78.07 -41.58 34.97 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.797 1.639 . . . . 0.0 112.39 176.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -72.8 -29.55 63.35 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.761 1.224 . . . . 0.0 114.192 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 46.7 t -62.75 140.07 58.72 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 35.6 t70 -65.93 -16.63 64.04 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.688 1.195 . . . . 0.0 112.218 176.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -78.56 -6.07 54.51 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.314 1.446 . . . . 0.0 113.469 177.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 73.7 ttt-85 . . . . . 0 N--CA 1.479 0.994 0 C-N-CA 125.239 1.415 . . . . 0.0 111.758 179.711 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.438 0 N-CA-C 114.024 0.37 . . . . 0.0 114.024 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 p -73.69 -24.68 59.98 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.612 1.165 . . . . 0.0 114.049 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -148.58 149.33 31.37 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.152 1.781 . . . . 0.0 111.212 178.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 64.1 mtt -140.59 147.29 39.18 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.726 1.61 . . . . 0.0 110.573 178.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -148.07 147.04 29.12 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.962 1.305 . . . . 0.0 111.226 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -143.54 135.27 12.93 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.203 1.401 . . . . 0.0 110.585 179.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -74.37 6.41 3.13 Favored 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 124.159 3.239 . . . . 0.0 115.367 -178.017 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 35.5 tp60 -70.89 -22.89 62.22 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.789 1.236 . . . . 0.0 113.611 -179.34 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 78.5 p -75.82 159.72 30.71 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.527 1.131 . . . . 0.0 113.269 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 16.1 t70 -141.28 129.15 12.08 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 124.926 1.29 . . . . 0.0 111.373 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -85.17 -17.38 4.62 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.529 2.82 . . . . 0.0 114.903 -178.377 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 26.1 m -81.59 -27.47 34.25 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -176.032 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 12.2 p -73.42 139.41 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.956 0.902 . . . . 0.0 111.816 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -133.89 86.49 37.97 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.936 1.295 . . . . 0.0 111.098 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -57.57 -42.54 59.69 Favored 'Trans proline' 0 CA--C 1.55 1.294 0 C-N-CA 123.716 2.944 . . . . 0.0 117.267 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -75.46 166.96 27.61 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 122.653 2.235 . . . . 0.0 114.163 -177.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 15.7 tp -70.09 143.66 52.35 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.476 1.11 . . . . 0.0 111.55 177.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 54.7 m -69.15 127.98 35.01 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 174.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -58.5 -24.76 61.28 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -175.18 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -75.44 -10.87 59.83 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 177.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 76.8 m -58.77 -60.04 4.46 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.931 0.892 . . . . 0.0 111.848 -177.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -60.21 -24.82 65.12 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 9.1 t -75.63 -31.05 59.7 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.897 0.879 . . . . 0.0 112.359 178.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.9 t70 -90.02 -28.07 19.32 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.001 0.92 . . . . 0.0 112.319 175.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.9 tt -46.49 -59.02 3.24 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 126.993 2.117 . . . . 0.0 112.847 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.6 p-90 -69.69 -9.24 53.6 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.021 1.489 . . . . 0.0 115.021 -173.172 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -112.0 -56.25 2.41 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -177.243 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 50.1 mt -120.14 15.86 12.36 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -172.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.2 tt -52.84 137.4 45.03 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 126.07 1.748 . . . . 0.0 114.891 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -71.15 171.99 14.86 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 124.487 3.458 . . . . 0.0 113.344 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -65.68 -4.22 5.98 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 116.693 2.109 . . . . 0.0 116.693 -177.032 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 53.5 t30 -141.64 146.75 36.54 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.68 1.192 . . . . 0.0 111.616 178.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -150.29 154.68 38.29 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.768 1.227 . . . . 0.0 111.792 177.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 18.1 t -90.27 -26.44 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 124.383 1.073 . . . . 0.0 112.664 -179.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 61.2 tp -89.24 0.82 56.47 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.272 1.429 . . . . 0.0 114.325 -177.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 49.7 m -48.69 109.29 1.14 Allowed Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 125.461 1.505 . . . . 0.0 113.474 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -63.0 123.07 11.59 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 123.48 2.787 . . . . 0.0 112.185 -178.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 87.4 mt -81.57 128.92 67.81 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 124.379 1.072 . . . . 0.0 112.184 -177.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -53.14 -32.75 60.96 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.844 3.029 . . . . 0.0 115.113 179.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 8.2 t -69.24 -18.37 63.87 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.59 1.156 . . . . 0.0 113.56 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -131.37 26.79 4.79 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.14 1.776 . . . . 0.0 111.681 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -77.42 160.64 28.58 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 -176.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.89 18.69 8.63 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 128.287 2.635 . . . . 0.0 113.225 179.034 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -66.87 -16.37 64.26 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.234 1.414 . . . . 0.0 114.712 -177.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.3 -16.14 64.1 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 121.161 -0.962 . . . . 0.0 112.626 177.18 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 23.9 tp -116.75 19.23 14.59 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 127.145 2.178 . . . . 0.0 111.756 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 8.0 tpt -71.73 151.77 43.32 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 115.923 1.823 . . . . 0.0 115.923 -175.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 91.3 mt -125.03 162.98 23.36 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.061 2.144 . . . . 0.0 113.709 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 31.2 t -83.67 144.83 46.21 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 169.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -56.86 -20.32 35.49 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.248 1.965 . . . . 0.0 114.718 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -69.04 -25.08 64.3 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.863 0.865 . . . . 0.0 112.76 177.439 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.3 t70 -83.76 -12.76 55.3 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 80.3 mt -56.18 -36.39 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 124.571 1.148 . . . . 0.0 110.465 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -66.01 -10.0 35.68 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.014 1.326 . . . . 0.0 113.863 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 20.8 tp60 -84.64 -29.6 25.59 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.104 -0.998 . . . . 0.0 112.596 177.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 3.2 p-90 -96.17 -35.06 11.44 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.735 0.814 . . . . 0.0 111.907 176.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 13.9 m-30 -110.78 109.57 19.85 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 104.749 -2.315 . . . . 0.0 104.749 169.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 3.7 m -125.06 140.82 52.56 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -172.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -103.67 163.17 12.49 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.687 1.595 . . . . 0.0 111.638 176.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 22.8 t0 -61.16 114.99 12.17 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.074 0.95 . . . . 0.0 112.553 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -87.41 -2.54 7.69 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.775 2.983 . . . . 0.0 113.85 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 79.82 -176.29 54.73 Favored Glycine 0 CA--C 1.544 1.866 0 C-N-CA 124.619 1.104 . . . . 0.0 113.183 -176.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.85 -21.45 57.66 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.535 2.823 . . . . 0.0 114.131 -178.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 36.0 t70 -78.0 -19.55 54.24 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.259 1.024 . . . . 0.0 113.149 178.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -80.77 68.09 3.45 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 125.08 1.324 . . . . 0.0 113.161 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 78.9 p -63.69 -1.02 1.14 Allowed 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 116.466 2.025 . . . . 0.0 116.466 -178.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 60.8 m -67.92 13.81 0.07 Allowed 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 127.584 2.354 . . . . 0.0 115.053 178.614 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -49.57 -32.98 13.79 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.161 1.785 . . . . 0.0 114.907 -177.392 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 25.7 m120 -61.48 -25.95 67.58 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.201 -0.937 . . . . 0.0 112.934 178.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -97.01 -23.94 13.98 Favored Glycine 0 CA--C 1.538 1.481 0 C-N-CA 124.967 1.27 . . . . 0.0 114.315 177.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 69.3 p -96.43 -19.94 18.8 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -178.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -66.9 159.44 28.34 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.467 1.107 . . . . 0.0 113.572 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 14.5 t -65.58 146.43 54.84 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.02 0.928 . . . . 0.0 112.268 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 139.79 -79.33 0.29 Allowed Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.214 1.387 . . . . 0.0 110.679 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -62.87 -23.06 74.26 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 123.0 2.467 . . . . 0.0 111.753 176.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 28.4 p -60.32 -21.55 62.15 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.466 1.907 . . . . 0.0 113.679 176.108 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -87.55 -4.69 58.97 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.974 1.31 . . . . 0.0 113.618 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 12.4 t70 -70.13 138.42 87.18 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 124.177 0.991 . . . . 0.0 111.49 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -57.89 -31.02 91.52 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.653 2.235 . . . . 0.0 113.661 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -64.33 -37.19 86.63 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.459 1.027 . . . . 0.0 111.468 176.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -65.36 -41.45 93.84 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.431 -0.793 . . . . 0.0 110.945 175.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -63.3 -42.35 99.04 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.652 0.66 . . . . 0.0 110.474 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -62.07 -33.4 74.33 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.213 1.005 . . . . 0.0 112.497 176.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 71.5 mt -64.27 -41.31 96.99 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 120.1 1.318 . . . . 0.0 111.451 175.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.8 mt -64.7 -51.47 66.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.054 0.541 . . . . 0.0 109.736 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -55.35 -55.16 34.69 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.396 1.078 . . . . 0.0 111.299 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -34.42 77.79 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -177.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -68.91 -44.84 72.34 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.103 0.865 . . . . 0.0 110.52 176.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 7.6 tp -62.65 -39.69 94.69 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.609 0.641 . . . . 0.0 110.896 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 58.0 t -60.29 -32.21 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 CA-C-N 119.449 1.022 . . . . 0.0 110.95 175.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 9.3 tp -71.37 -31.71 67.64 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 120.793 -1.192 . . . . 0.0 112.138 175.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.61 -28.91 69.7 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 120.211 1.369 . . . . 0.0 109.938 174.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.9 mt -72.55 -52.9 13.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.707 0.803 . . . . 0.0 109.584 175.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.0 t60 -55.02 -54.39 43.67 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 122.902 0.481 . . . . 0.0 110.531 177.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -57.22 -25.3 58.86 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -178.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -90.01 -31.42 17.21 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.467 1.031 . . . . 0.0 113.323 175.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 76.9 mttt -80.54 -39.59 27.5 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.4 1.48 . . . . 0.0 112.231 179.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 51.9 t -62.76 -51.25 67.86 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 127.635 2.374 . . . . 0.0 112.048 178.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -55.32 -27.7 48.75 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -80.39 -15.85 55.85 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.36 -37.01 80.05 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 119.978 1.263 . . . . 0.0 112.516 179.194 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -64.13 -40.88 97.11 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.945 0.898 . . . . 0.0 110.388 177.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -70.12 -39.39 75.49 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.054 0.942 . . . . 0.0 111.865 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -68.07 -41.2 82.29 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.027 0.931 . . . . 0.0 112.963 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -83.55 -42.22 17.05 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.216 1.006 . . . . 0.0 112.985 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 77.07 1.87 75.71 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 116.694 1.438 . . . . 0.0 116.694 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -128.71 -45.11 1.32 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.803 1.801 . . . . 0.0 113.809 -178.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 17.7 m -78.15 148.77 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 CA-C-N 119.12 0.873 . . . . 0.0 113.124 -179.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -76.1 164.77 25.79 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.542 1.137 . . . . 0.0 113.51 178.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -79.76 175.6 10.48 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 124.833 1.253 . . . . 0.0 111.601 174.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -51.3 149.53 3.97 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.967 1.707 . . . . 0.0 115.481 -178.358 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 76.4 p -100.01 -8.27 24.07 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.251 1.821 . . . . 0.0 112.526 175.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 36.1 tp -69.58 115.41 32.63 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 127.086 2.154 . . . . 0.0 109.578 178.393 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -59.47 -34.28 97.17 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.737 2.291 . . . . 0.0 114.039 -176.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 45.0 m80 -68.78 -37.06 79.04 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 121.395 -0.816 . . . . 0.0 112.392 177.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 36.0 t -66.09 -50.15 65.07 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.74 1.216 . . . . 0.0 108.948 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -54.99 -34.66 63.6 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.264 1.426 . . . . 0.0 111.824 174.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.8 m -71.83 -59.56 2.69 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.526 1.13 . . . . 0.0 111.446 176.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.46 -37.79 79.1 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.771 -0.633 . . . . 0.0 112.522 -178.435 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -63.83 -34.34 77.71 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 120.505 1.502 . . . . 0.0 113.1 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -71.17 -37.66 72.19 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.011 0.524 . . . . 0.0 110.519 175.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 91.6 t -65.67 -47.04 87.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 122.934 0.493 . . . . 0.0 110.623 176.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.78 -43.38 85.51 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.784 0.833 . . . . 0.0 111.156 178.12 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 33.7 m-80 -68.22 -17.64 64.36 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 176.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 62.7 t60 -90.11 -47.81 7.58 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.815 0.846 . . . . 0.0 109.497 173.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -57.28 -28.44 63.01 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.339 1.856 . . . . 0.0 113.293 -178.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 7.5 p -66.88 -27.05 67.2 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.488 1.115 . . . . 0.0 112.542 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 68.8 m80 -102.51 -22.2 14.07 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.059 1.744 . . . . 0.0 113.443 178.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 19.4 t -64.18 142.86 58.26 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.442 1.497 . . . . 0.0 112.692 -179.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -117.72 -12.77 10.22 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.651 1.58 . . . . 0.0 113.814 -179.121 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -91.44 -27.59 18.2 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.976 0.91 . . . . 0.0 112.058 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 55.69 -114.16 4.58 Favored Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.219 0.914 . . . . 0.0 112.605 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 82.2 tttt -62.18 -20.49 64.2 Favored 'General case' 0 N--CA 1.479 0.994 0 O-C-N 121.316 -1.109 . . . . 0.0 112.803 177.453 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.5 -1.96 57.36 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.917 1.287 . . . . 0.0 113.466 176.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 17.5 t -63.64 141.96 58.57 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 122.058 0.932 . . . . 0.0 109.599 177.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -80.54 -3.9 51.91 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -175.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 96.5 t -91.67 115.01 29.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 172.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.89 -39.51 68.81 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -176.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -65.84 -38.89 90.09 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.675 0.79 . . . . 0.0 112.517 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 40.7 t -66.69 -55.06 16.88 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.382 1.473 . . . . 0.0 110.163 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.72 -26.12 63.61 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.005 0.922 . . . . 0.0 113.393 177.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.4 m -81.93 -46.49 13.97 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 124.214 1.006 . . . . 0.0 111.535 175.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 66.8 m -61.98 -36.05 80.31 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.375 1.07 . . . . 0.0 112.284 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -61.16 -31.98 71.71 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.747 0.819 . . . . 0.0 112.16 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -68.91 -29.68 68.0 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.4 0.68 . . . . 0.0 111.714 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.1 mm -71.17 -46.74 64.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 18.9 mm -60.99 -38.45 79.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 124.96 1.304 . . . . 0.0 110.974 177.319 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 70.5 m -62.15 -21.91 65.44 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.283 1.033 . . . . 0.0 113.271 177.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.2 t60 -65.28 -60.21 3.23 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.474 1.034 . . . . 0.0 110.683 178.033 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 52.6 m95 -60.15 -24.13 64.46 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 177.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 61.8 mtpt -74.53 -35.95 63.15 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.95 0.9 . . . . 0.0 112.748 178.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.03 -32.72 10.81 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 8.9 t -82.29 132.92 35.22 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.522 1.529 . . . . 0.0 110.979 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.2 p -129.98 0.47 4.76 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.352 1.461 . . . . 0.0 114.427 -177.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -80.09 151.95 29.58 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.831 1.252 . . . . 0.0 113.093 -178.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 40.6 p-80 -86.41 -29.22 23.04 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.694 0.798 . . . . 0.0 111.444 173.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.8 t0 -100.27 70.05 1.5 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.46 1.904 . . . . 0.0 111.511 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 41.7 t -127.88 135.18 27.1 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 126.615 1.966 . . . . 0.0 109.22 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -58.56 -25.08 72.98 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 122.814 2.343 . . . . 0.0 114.204 -178.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.2 t -92.19 -52.49 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 119.682 1.128 . . . . 0.0 111.732 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 10.4 m -68.76 -40.25 79.85 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -175.217 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -53.42 -57.95 14.83 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-O 117.414 -1.279 . . . . 0.0 112.866 -178.087 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -59.93 -34.11 95.4 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 121.918 1.745 . . . . 0.0 113.565 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.5 mt -70.24 -47.13 62.74 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.977 0.808 . . . . 0.0 111.924 178.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -64.6 -34.75 79.0 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.982 0.913 . . . . 0.0 110.886 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.8 t30 -70.12 -43.15 71.6 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.254 1.421 . . . . 0.0 111.77 176.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -69.29 -32.27 71.31 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.939 0.896 . . . . 0.0 112.46 178.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 23.2 t -67.76 112.35 4.79 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.439 1.096 . . . . 0.0 112.458 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 36.1 t70 -73.58 -8.29 55.36 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.83 0.852 . . . . 0.0 112.4 177.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -77.72 -7.17 56.14 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 126.674 1.99 . . . . 0.0 112.889 179.27 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 9.7 ptm85 . . . . . 0 N--CA 1.477 0.884 0 C-N-CA 126.582 1.953 . . . . 0.0 114.021 -179.923 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.37 0 N-CA-C 114.622 0.609 . . . . 0.0 114.622 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.0 p -57.06 -28.92 63.0 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.486 1.514 . . . . 0.0 114.03 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 29.9 p80 -97.69 2.33 49.58 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.405 1.882 . . . . 0.0 113.687 177.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 89.3 mtp -114.99 -34.72 4.98 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.684 1.594 . . . . 0.0 112.769 -178.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -72.35 143.88 48.47 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.565 1.146 . . . . 0.0 111.963 179.042 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -143.81 135.7 13.03 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 124.915 1.286 . . . . 0.0 111.067 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -71.32 164.19 36.56 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.401 2.734 . . . . 0.0 113.146 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -125.01 153.43 42.83 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.335 1.454 . . . . 0.0 112.074 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 34.0 m -71.18 159.51 34.52 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.104 1.361 . . . . 0.0 113.317 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 15.6 t70 -132.71 129.54 21.32 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.468 1.507 . . . . 0.0 111.279 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -84.51 -14.19 6.84 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.599 2.866 . . . . 0.0 115.324 -177.769 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 11.7 t -78.5 -38.38 40.91 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.113 0.965 . . . . 0.0 113.072 -178.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 7.6 p -75.93 146.49 9.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 124.33 1.052 . . . . 0.0 111.734 178.31 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -134.28 147.09 62.25 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.061 1.344 . . . . 0.0 110.887 179.298 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -55.42 -48.5 20.22 Favored 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 123.121 2.547 . . . . 0.0 116.478 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -72.88 150.91 50.19 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.263 1.975 . . . . 0.0 112.608 -179.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 4.9 tt -64.19 139.83 58.81 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.78 1.232 . . . . 0.0 111.796 177.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 47.1 t -77.28 148.57 35.66 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.229 1.012 . . . . 0.0 112.042 178.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -59.24 -26.92 65.31 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.47 0.708 . . . . 0.0 112.477 177.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -88.4 -7.99 55.73 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 90.5 m -62.27 -54.52 39.46 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.569 1.077 . . . . 0.0 110.832 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -60.08 -27.49 67.04 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.619 0.767 . . . . 0.0 112.967 176.084 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 24.2 m -68.01 -34.72 77.05 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.611 0.764 . . . . 0.0 112.663 178.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.31 -28.73 18.56 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 174.245 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 2.6 tt -43.24 -60.06 1.83 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.4 1.88 . . . . 0.0 113.318 -177.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 50.1 p-90 -63.0 -12.49 26.25 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -173.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 16.1 pttp -111.94 -50.25 2.93 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -177.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 66.2 mt -120.08 20.44 12.09 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 117.203 2.297 . . . . 0.0 117.203 -169.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 12.4 tp -51.74 138.96 31.61 Favored Pre-proline 0 CA--C 1.551 1.019 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -173.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -76.57 155.06 35.66 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.394 2.729 . . . . 0.0 111.468 176.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -68.42 -14.99 63.39 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.691 1.737 . . . . 0.0 115.691 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 1.1 t30 -81.13 66.85 6.83 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.83 1.252 . . . . 0.0 110.856 178.236 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -131.83 132.95 44.15 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.061 1.344 . . . . 0.0 112.883 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 35.7 m -138.81 9.76 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 125.895 1.678 . . . . 0.0 114.042 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 7.9 tt -77.42 -11.02 59.8 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -177.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 1.8 p -54.84 124.92 53.51 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 124.459 1.103 . . . . 0.0 112.366 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -67.28 146.81 76.88 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.987 2.458 . . . . 0.0 111.748 179.364 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 30.2 tp -66.32 127.25 93.17 Favored Pre-proline 0 CA--C 1.546 0.823 0 CA-C-O 117.923 -1.037 . . . . 0.0 110.714 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -51.62 -35.05 55.48 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.603 2.868 . . . . 0.0 114.784 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 15.0 m -65.23 -16.2 63.28 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.846 1.258 . . . . 0.0 113.959 178.041 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -129.58 14.7 5.99 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.645 1.978 . . . . 0.0 112.375 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.03 162.35 29.58 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 122.666 1.222 . . . . 0.0 113.9 -178.052 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.84 17.05 1.61 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.324 2.249 . . . . 0.0 113.721 178.793 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -64.24 -11.15 28.6 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.504 1.522 . . . . 0.0 114.836 -178.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.2 t70 -65.0 -19.2 65.88 Favored 'General case' 0 CA--C 1.548 0.896 0 O-C-N 121.075 -1.015 . . . . 0.0 112.081 174.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 93.0 mt -108.64 13.47 25.16 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.716 2.006 . . . . 0.0 112.904 178.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.39 149.51 44.25 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.844 -1.16 . . . . 0.0 113.356 -177.578 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.14 179.66 4.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.31 1.844 . . . . 0.0 114.242 -175.785 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 6.1 p -79.92 160.13 69.55 Favored Pre-proline 0 CA--C 1.545 0.769 0 O-C-N 121.464 -0.773 . . . . 0.0 109.452 169.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.37 -15.16 47.1 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 121.725 1.617 . . . . 0.0 113.009 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -85.61 -28.86 24.53 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.346 1.058 . . . . 0.0 111.452 176.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -67.71 -21.0 65.33 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.674 0.79 . . . . 0.0 112.243 177.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 97.2 mt -57.43 -35.84 50.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.993 0.917 . . . . 0.0 109.678 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -72.86 -10.0 59.31 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 179.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -78.24 -30.46 48.73 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.052 -1.03 . . . . 0.0 111.336 175.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 7.4 p-90 -99.54 -20.06 16.58 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 177.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -129.69 109.82 11.29 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 169.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 6.0 t -125.21 175.47 7.39 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.407 1.083 . . . . 0.0 113.62 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -116.44 -179.95 3.82 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.993 2.517 . . . . 0.0 109.969 176.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 9.8 t70 -59.22 120.93 52.01 Favored Pre-proline 0 CA--C 1.556 1.201 0 O-C-N 120.601 -1.312 . . . . 0.0 110.536 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -81.2 -13.4 11.25 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.448 2.765 . . . . 0.0 115.709 -175.122 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 62.51 -162.24 29.66 Favored Glycine 0 CA--C 1.544 1.895 0 CA-C-N 118.983 0.811 . . . . 0.0 113.14 -176.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -76.05 -19.44 15.72 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 123.337 2.691 . . . . 0.0 113.836 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -88.68 -33.75 17.45 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 -177.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -85.75 27.91 5.16 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 124.968 1.271 . . . . 0.0 114.916 -179.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 65.1 p -50.28 -29.82 10.51 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 -176.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 76.6 m -54.9 -26.06 33.32 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.14 1.376 . . . . 0.0 113.711 177.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -60.62 -25.99 66.68 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.357 -0.84 . . . . 0.0 113.13 178.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 26.3 p30 -66.02 -15.57 63.15 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 119.507 1.049 . . . . 0.0 113.448 177.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -94.45 0.68 65.92 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.873 1.702 . . . . 0.0 114.438 177.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 6.2 t -139.78 -37.92 0.48 Allowed 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 118.855 1.328 . . . . 0.0 114.091 -178.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -79.85 34.33 0.28 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.146 1.378 . . . . 0.0 114.134 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 5.9 m -62.1 -34.08 75.65 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.573 1.549 . . . . 0.0 112.829 -178.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 170.17 74.9 0.04 OUTLIER Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.745 1.164 . . . . 0.0 112.644 178.204 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -54.13 -27.74 47.85 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.16 3.24 . . . . 0.0 116.476 -177.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 21.9 p -86.88 -32.0 20.46 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.44 1.096 . . . . 0.0 112.652 178.029 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -80.58 -30.66 36.94 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.346 1.458 . . . . 0.0 112.581 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 16.8 t70 -76.34 121.28 84.62 Favored Pre-proline 0 CA--C 1.549 0.904 0 C-N-CA 124.963 1.305 . . . . 0.0 109.884 176.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -59.1 -40.97 65.3 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.395 2.063 . . . . 0.0 114.852 -176.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -66.69 -46.32 76.01 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 121.361 -0.837 . . . . 0.0 111.517 -179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 81.0 mttt -63.77 -39.85 95.26 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 117.792 -1.099 . . . . 0.0 112.021 177.336 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 10.5 ptt-85 -64.52 -35.97 82.69 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.641 1.564 . . . . 0.0 111.655 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -63.07 -38.39 91.01 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.171 0.896 . . . . 0.0 111.267 173.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 97.6 mt -63.69 -38.88 92.79 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.714 0.688 . . . . 0.0 111.198 176.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -68.05 -51.96 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 118.928 0.785 . . . . 0.0 109.851 175.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -52.89 -53.64 46.19 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.226 1.01 . . . . 0.0 111.373 179.108 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -38.06 88.14 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 119.282 0.946 . . . . 0.0 112.503 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -70.13 -45.91 65.85 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.681 0.673 . . . . 0.0 111.119 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.0 tt -63.05 -43.05 99.71 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.587 0.755 . . . . 0.0 109.948 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 61.9 t -63.94 -24.34 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 120.737 -1.227 . . . . 0.0 111.131 174.047 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.44 -31.25 57.74 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.292 -1.505 . . . . 0.0 111.612 173.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.7 mp -59.86 -41.65 91.93 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 169.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.3 mp -67.26 -47.46 70.65 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 117.704 -1.141 . . . . 0.0 111.997 176.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 30.2 t60 -55.06 -55.01 35.84 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.746 1.157 . . . . 0.0 108.719 176.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.38 -45.92 66.0 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.147 0.979 . . . . 0.0 113.27 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -69.43 -39.26 77.94 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.513 -0.742 . . . . 0.0 112.817 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 49.1 mttp -74.9 -32.8 61.92 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.007 -1.058 . . . . 0.0 111.736 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 8.3 t -68.52 -42.14 78.93 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.253 1.821 . . . . 0.0 109.424 173.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -58.39 -43.89 88.7 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.232 1.413 . . . . 0.0 110.056 172.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 3.4 mmp_? -66.89 -36.05 81.41 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.312 -0.868 . . . . 0.0 112.549 175.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -35.6 72.81 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.706 1.203 . . . . 0.0 110.861 174.094 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -75.83 -44.31 41.66 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.111 0.564 . . . . 0.0 110.865 176.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -58.28 -34.13 70.19 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.659 0.784 . . . . 0.0 112.356 177.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -69.71 -10.02 56.68 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.664 1.186 . . . . 0.0 114.109 177.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -120.15 -47.25 2.38 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.517 1.527 . . . . 0.0 113.148 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 76.78 3.88 80.69 Favored Glycine 0 CA--C 1.539 1.537 0 N-CA-C 117.369 1.708 . . . . 0.0 117.369 177.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -127.27 -37.67 2.02 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 119.843 1.821 . . . . 0.0 114.038 -178.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 27.2 m -65.52 154.46 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 113.531 0.938 . . . . 0.0 113.531 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 79.0 mmt-85 -82.57 163.55 21.41 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.075 1.35 . . . . 0.0 111.018 176.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -74.16 173.14 10.53 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -178.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 1.9 t -54.3 150.98 7.93 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 127.807 2.443 . . . . 0.0 115.042 -177.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 50.1 m -81.03 -14.2 58.1 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.955 1.302 . . . . 0.0 112.856 177.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 67.0 tp -82.95 114.5 52.98 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.809 1.644 . . . . 0.0 110.354 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -57.99 -35.77 98.53 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.556 2.171 . . . . 0.0 113.735 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 19.7 m170 -63.81 -38.18 90.14 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 5.1 t -64.94 -51.84 59.6 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.091 1.357 . . . . 0.0 109.228 175.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -52.02 -41.87 62.58 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.179 1.792 . . . . 0.0 111.774 175.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 5.1 m -66.99 -58.63 4.58 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.934 1.294 . . . . 0.0 111.252 176.086 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.2 mmt -62.67 -33.1 74.38 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -177.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -67.09 -30.39 70.4 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 121.138 1.79 . . . . 0.0 112.51 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -72.07 -36.81 69.65 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 122.875 0.47 . . . . 0.0 110.264 172.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 71.2 t -62.61 -46.94 95.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 123.076 0.55 . . . . 0.0 110.13 175.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.23 -41.29 92.8 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.253 1.021 . . . . 0.0 112.002 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -63.6 -39.55 94.66 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.013 0.525 . . . . 0.0 111.762 175.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.8 -50.75 27.03 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.268 0.627 . . . . 0.0 111.15 176.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 30.1 ttp -57.54 -34.9 69.64 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.318 1.847 . . . . 0.0 114.378 -175.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 13.0 t -74.35 -16.1 60.92 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 120.06 1.3 . . . . 0.0 112.544 175.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -98.84 -30.64 12.29 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.53 1.532 . . . . 0.0 112.039 176.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 36.4 t -61.95 145.15 53.79 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.418 1.887 . . . . 0.0 112.279 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -121.33 -5.39 9.37 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.406 1.482 . . . . 0.0 114.718 -177.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -88.95 -15.5 34.12 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.486 1.039 . . . . 0.0 113.211 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 58.69 -126.9 43.9 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 121.38 -0.825 . . . . 0.0 112.007 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -66.48 -10.06 40.64 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -94.26 0.35 55.59 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.573 1.149 . . . . 0.0 113.445 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.1 t -59.17 140.77 55.57 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.331 1.062 . . . . 0.0 110.383 177.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 55.1 mm-40 -77.94 -9.0 58.87 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.853 1.261 . . . . 0.0 113.319 -176.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 10.9 t -93.94 124.13 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.491 1.116 . . . . 0.0 108.652 175.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.63 -50.36 65.88 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -176.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -62.4 -32.85 73.73 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -178.318 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 49.7 t -68.61 -59.37 3.17 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.937 0.789 . . . . 0.0 109.992 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.73 68.67 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.647 0.779 . . . . 0.0 112.419 178.058 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 19.8 m -69.32 -51.9 32.57 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.314 -0.866 . . . . 0.0 112.08 176.106 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 36.7 m -62.9 -33.64 75.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.853 1.206 . . . . 0.0 112.066 178.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -59.65 -34.15 72.45 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.474 -0.766 . . . . 0.0 111.872 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -65.93 -27.83 68.47 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 118.924 0.784 . . . . 0.0 111.697 175.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 11.6 mt -76.73 -48.02 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.171 0.989 . . . . 0.0 109.886 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 20.4 mm -59.25 -38.02 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 124.191 0.996 . . . . 0.0 110.741 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 22.3 t -58.46 -29.34 66.1 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.799 1.239 . . . . 0.0 112.8 176.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 10.8 t60 -61.53 -55.89 26.07 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.295 -0.878 . . . . 0.0 110.453 176.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 51.7 m95 -61.3 -31.96 71.8 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 178.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -67.23 -34.76 78.15 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 118.606 -0.711 . . . . 0.0 112.824 178.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.6 p30 -100.1 -30.76 11.77 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 11.1 t -78.58 125.7 29.73 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.775 1.23 . . . . 0.0 112.095 -178.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 54.4 p -111.32 1.66 17.23 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.858 1.663 . . . . 0.0 113.941 -178.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 64.7 mtm180 -85.35 162.07 19.22 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.346 1.458 . . . . 0.0 114.084 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 15.3 t-160 -106.67 -37.96 6.27 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.656 1.582 . . . . 0.0 108.425 170.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -85.75 69.88 10.64 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.094 1.758 . . . . 0.0 111.097 175.526 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 44.3 t -131.62 136.79 29.07 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 126.898 2.079 . . . . 0.0 109.224 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -55.29 -28.38 62.15 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.903 2.402 . . . . 0.0 114.566 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.9 t -92.14 -52.14 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 119.461 1.028 . . . . 0.0 111.941 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 4.9 m -68.39 -34.89 76.83 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 115.203 1.556 . . . . 0.0 115.203 -174.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -54.8 -58.9 12.22 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-O 117.678 -1.153 . . . . 0.0 113.083 -178.62 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.23 -31.83 93.56 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.983 1.789 . . . . 0.0 113.402 179.494 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.72 -48.09 60.78 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.706 0.802 . . . . 0.0 111.988 178.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -67.22 -25.19 65.99 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.115 0.966 . . . . 0.0 111.993 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 18.9 t30 -77.46 -40.37 43.43 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.112 1.365 . . . . 0.0 111.699 175.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -79.74 -41.86 25.77 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -179.198 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 73.8 m -97.79 128.31 44.35 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.71 1.204 . . . . 0.0 112.007 -179.121 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -131.74 43.1 3.09 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.918 1.687 . . . . 0.0 113.091 -177.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -59.32 -19.92 50.35 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -177.169 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 26.9 ttp180 . . . . . 0 N--CA 1.476 0.873 0 C-N-CA 125.472 1.509 . . . . 0.0 111.365 179.711 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.383 0 CA-C-O 121.324 0.402 . . . . 0.0 113.874 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.2 m -77.37 50.54 0.79 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.823 1.649 . . . . 0.0 113.36 -179.004 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -72.04 154.21 41.27 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.381 1.472 . . . . 0.0 112.822 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 14.4 tpt -72.41 148.51 45.13 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.159 0.983 . . . . 0.0 111.823 178.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -71.94 -30.51 65.39 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 -177.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -147.36 158.14 44.32 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 125.167 1.387 . . . . 0.0 112.674 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.72 136.45 75.62 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 123.135 2.557 . . . . 0.0 113.449 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -95.1 157.71 15.78 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.792 1.237 . . . . 0.0 111.33 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 20.1 m -74.13 44.52 0.19 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.767 1.627 . . . . 0.0 114.942 -177.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 12.6 t70 -73.69 140.99 78.7 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.127 1.371 . . . . 0.0 110.178 176.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -49.61 -20.56 4.42 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 124.233 3.289 . . . . 0.0 117.92 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 89.0 p -82.78 -7.1 59.68 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 178.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 13.6 p -141.5 158.92 21.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 125.464 1.506 . . . . 0.0 112.569 -177.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -127.1 82.52 67.98 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.0 1.32 . . . . 0.0 110.89 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -57.52 -47.29 22.34 Favored 'Trans proline' 0 CA--C 1.549 1.264 0 C-N-CA 123.089 2.526 . . . . 0.0 115.282 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -80.64 169.2 17.1 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 122.861 2.374 . . . . 0.0 112.032 179.11 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 7.8 tt -78.5 122.91 26.47 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.364 -0.835 . . . . 0.0 110.437 177.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 19.4 t -90.43 157.26 17.68 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.7 1.2 . . . . 0.0 113.246 -178.116 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -59.13 -29.5 67.45 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.778 1.231 . . . . 0.0 112.838 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.15 -19.45 61.12 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 179.303 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 86.2 m -64.96 -60.01 3.53 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.232 0.924 . . . . 0.0 111.069 -178.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -60.29 -27.31 67.19 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.661 -0.649 . . . . 0.0 112.462 174.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 53.7 m -71.54 -31.23 66.8 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.43 0.692 . . . . 0.0 112.802 178.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.1 t70 -90.15 -28.62 18.81 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.438 1.095 . . . . 0.0 112.966 175.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.1 tt -44.39 -60.1 2.1 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.926 2.09 . . . . 0.0 113.314 -178.227 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.8 p-90 -70.94 -4.81 26.57 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -112.02 -59.97 1.92 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.736 1.754 . . . . 0.0 115.736 -177.419 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 7.0 mp -120.23 14.27 12.12 Favored 'General case' 0 CA--C 1.554 1.135 0 N-CA-C 116.372 1.99 . . . . 0.0 116.372 -174.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 4.4 tt -54.21 134.55 60.14 Favored Pre-proline 0 CA--C 1.552 1.048 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -178.437 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -84.82 170.11 10.17 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 124.656 3.571 . . . . 0.0 113.548 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.5 -5.72 21.08 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 178.661 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.67 56.75 2.31 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.297 1.439 . . . . 0.0 111.361 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -139.49 139.65 37.03 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.546 1.538 . . . . 0.0 112.299 -178.149 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 35.8 m -132.23 12.43 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 C-N-CA 125.851 1.66 . . . . 0.0 113.182 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 42.3 tp -69.64 -24.29 63.61 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.601 1.16 . . . . 0.0 113.919 -177.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 29.2 m -53.94 115.46 8.2 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.754 1.622 . . . . 0.0 114.316 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -71.78 153.92 58.97 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 122.687 2.258 . . . . 0.0 111.09 176.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 87.0 mt -74.02 148.26 86.64 Favored Pre-proline 0 CA--C 1.544 0.729 0 CA-C-O 118.44 -0.791 . . . . 0.0 111.208 178.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -53.77 -29.68 53.39 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 123.453 2.768 . . . . 0.0 115.069 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 56.0 p -82.75 -10.82 58.71 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.839 1.656 . . . . 0.0 114.256 177.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -117.6 -21.41 8.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.134 1.774 . . . . 0.0 113.514 -178.317 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -66.02 158.06 29.3 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.589 1.555 . . . . 0.0 114.403 -177.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.85 21.29 0.16 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 128.215 2.606 . . . . 0.0 114.265 178.024 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.39 -16.8 64.44 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.702 1.201 . . . . 0.0 113.286 -179.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -63.04 -21.07 65.91 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.739 1.216 . . . . 0.0 113.487 176.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 29.5 tp -110.42 9.96 23.36 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 127.001 2.12 . . . . 0.0 112.114 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 13.3 tpt -76.81 150.88 36.1 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -175.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.9 mp -125.04 159.91 30.25 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 125.602 1.561 . . . . 0.0 111.992 177.003 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.3 m -66.63 152.16 95.5 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 170.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -64.02 -11.49 27.57 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 122.25 1.967 . . . . 0.0 115.788 -174.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -80.08 -18.02 51.1 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.406 -0.809 . . . . 0.0 112.236 177.195 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -84.85 -9.97 57.61 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.481 1.112 . . . . 0.0 112.232 177.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 95.8 mt -58.55 -35.25 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.658 1.183 . . . . 0.0 109.711 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -65.58 -11.24 42.38 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.077 1.351 . . . . 0.0 113.167 177.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -82.94 -25.37 32.44 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.604 1.162 . . . . 0.0 112.286 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.3 p-90 -109.69 -26.07 10.06 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.517 1.127 . . . . 0.0 113.677 178.321 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -113.6 109.93 19.41 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 169.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.07 144.54 50.36 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -174.636 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -91.01 178.22 6.06 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.169 1.387 . . . . 0.0 110.561 172.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -65.79 120.2 66.94 Favored Pre-proline 0 CA--C 1.552 1.023 0 O-C-N 120.668 -1.27 . . . . 0.0 110.618 177.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -82.8 -12.11 9.94 Favored 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 123.211 2.608 . . . . 0.0 114.497 -176.449 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 96.35 -146.53 18.3 Favored Glycine 0 CA--C 1.543 1.816 0 C-N-CA 125.232 1.396 . . . . 0.0 112.951 -178.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -74.92 -10.26 21.27 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 124.128 3.219 . . . . 0.0 114.672 -177.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -140.0 166.15 25.43 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.459 1.903 . . . . 0.0 110.997 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 80.59 19.05 69.32 Favored Glycine 0 CA--C 1.538 1.501 0 N-CA-C 115.221 0.848 . . . . 0.0 115.221 178.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 18.1 m -76.56 13.55 0.96 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.68 1.592 . . . . 0.0 114.695 -179.222 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 57.0 m -50.14 -27.98 6.62 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.221 2.209 . . . . 0.0 114.722 -178.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -56.13 -25.45 46.2 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.29 1.436 . . . . 0.0 113.987 179.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 32.1 t30 -78.05 -25.1 47.58 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.714 0.806 . . . . 0.0 111.957 175.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -91.92 -30.27 10.58 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 125.826 1.679 . . . . 0.0 113.707 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 72.2 p -73.01 -25.31 60.92 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 118.62 1.21 . . . . 0.0 112.266 177.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -84.47 142.83 29.79 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.718 1.207 . . . . 0.0 111.275 176.006 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 63.0 m -123.96 140.69 52.73 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.019 1.327 . . . . 0.0 110.696 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 73.47 -113.94 4.46 Favored Glycine 0 CA--C 1.542 1.736 0 CA-C-O 118.328 -1.262 . . . . 0.0 112.72 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -63.09 171.57 6.09 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 124.287 3.325 . . . . 0.0 114.13 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 7.2 m -48.22 -36.33 13.64 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 126.966 2.106 . . . . 0.0 113.958 -179.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -130.7 128.83 41.66 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.315 1.846 . . . . 0.0 108.005 175.127 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 13.0 t70 -61.87 137.53 95.34 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 123.32 0.648 . . . . 0.0 112.447 -177.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -53.23 -40.64 76.81 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.022 2.482 . . . . 0.0 114.291 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -69.55 -35.26 75.24 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.34 -0.85 . . . . 0.0 111.59 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -68.04 -38.53 82.61 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 118.601 0.637 . . . . 0.0 110.365 175.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 42.3 mtm105 -63.73 -38.16 90.07 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 118.617 -0.706 . . . . 0.0 111.665 175.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -58.08 -36.72 73.25 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 119.082 0.855 . . . . 0.0 111.492 173.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 55.6 mt -64.17 -45.0 90.34 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.646 0.657 . . . . 0.0 110.937 176.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -58.23 -51.11 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-N 118.142 0.428 . . . . 0.0 110.102 177.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -57.34 -53.08 62.23 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.531 1.133 . . . . 0.0 111.414 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.98 -33.29 75.47 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.458 1.026 . . . . 0.0 112.847 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -67.86 -46.19 72.45 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.315 0.962 . . . . 0.0 109.305 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 12.0 tp -61.78 -39.65 92.41 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.949 1.3 . . . . 0.0 111.861 177.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 96.1 t -60.29 -32.52 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.056 1.298 . . . . 0.0 110.331 174.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.4 tp -73.65 -29.49 62.36 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 120.86 -1.15 . . . . 0.0 112.779 175.01 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.37 -29.93 69.24 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 120.102 1.319 . . . . 0.0 109.56 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.5 mt -71.67 -53.68 12.8 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.483 -0.761 . . . . 0.0 109.768 175.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 12.4 t60 -54.62 -53.62 52.24 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.381 0.673 . . . . 0.0 110.925 178.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -59.91 -21.94 61.75 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -178.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -87.53 -32.99 19.11 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.119 0.872 . . . . 0.0 111.958 174.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 39.2 mttm -84.16 -41.5 16.97 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.043 1.337 . . . . 0.0 113.346 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 34.5 t -56.73 -45.74 81.76 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.382 1.873 . . . . 0.0 111.212 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -60.41 -38.55 84.41 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 176.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -69.69 -43.94 71.45 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.625 -0.672 . . . . 0.0 110.551 177.618 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 3.4 tmm_? -56.41 -42.85 78.67 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.757 1.623 . . . . 0.0 111.296 176.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -69.08 -49.26 58.88 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.694 0.798 . . . . 0.0 111.745 178.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -66.64 -38.13 86.26 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -178.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -69.46 -33.76 73.39 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.911 0.885 . . . . 0.0 113.121 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -81.01 -48.85 11.67 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.527 0.731 . . . . 0.0 112.142 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 74.04 -15.16 3.35 Favored Glycine 0 CA--C 1.54 1.632 0 N-CA-C 116.977 1.551 . . . . 0.0 116.977 178.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -97.01 -37.86 10.01 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.923 1.861 . . . . 0.0 111.837 178.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 13.1 m -86.83 165.38 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.762 1.225 . . . . 0.0 110.997 176.006 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 77.1 mmt-85 -118.98 171.29 8.35 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.2 1.4 . . . . 0.0 111.218 178.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -60.45 160.72 8.39 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.053 0.941 . . . . 0.0 113.278 -178.449 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 16.8 p -67.77 174.35 3.67 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 126.059 1.744 . . . . 0.0 114.179 -178.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 75.8 p -92.6 3.96 54.54 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.439 1.496 . . . . 0.0 114.668 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 5.1 tt -72.31 125.09 91.53 Favored Pre-proline 0 CA--C 1.554 1.11 0 C-N-CA 124.738 1.215 . . . . 0.0 110.041 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -65.9 -46.72 4.47 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.96 2.44 . . . . 0.0 115.055 -174.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 72.8 m80 -74.73 -13.48 60.61 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.4 t -62.27 -49.15 76.82 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.242 1.017 . . . . 0.0 110.379 178.021 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 31.5 tpt180 -55.21 -37.58 67.32 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.916 1.286 . . . . 0.0 111.96 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 52.0 m -68.84 -55.77 10.1 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.672 0.789 . . . . 0.0 111.389 177.374 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.9 mmt -64.45 -35.25 80.33 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -64.74 -33.29 75.62 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.711 1.596 . . . . 0.0 112.335 178.15 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -70.72 -40.89 72.52 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.49 0.716 . . . . 0.0 110.298 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 78.6 t -62.61 -47.54 92.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 123.353 0.661 . . . . 0.0 110.566 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.13 -42.83 95.63 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.182 0.993 . . . . 0.0 112.575 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -65.08 -30.33 71.28 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 177.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 64.8 t60 -78.32 -52.48 8.56 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.577 0.751 . . . . 0.0 110.3 174.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.6 ttp -55.6 -35.84 66.25 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.1 1.76 . . . . 0.0 113.698 -176.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 6.0 t -71.44 -11.46 60.9 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.101 1.319 . . . . 0.0 113.55 178.105 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -112.9 -22.74 10.48 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.365 1.466 . . . . 0.0 112.791 176.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 39.0 t -56.91 138.19 54.22 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.475 1.51 . . . . 0.0 112.452 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -103.48 -16.55 15.53 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.672 1.589 . . . . 0.0 113.699 -178.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -95.68 -31.18 13.36 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.34 1.056 . . . . 0.0 112.678 -178.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.76 -108.06 0.65 Allowed Glycine 0 CA--C 1.536 1.35 0 C-N-CA 124.561 1.076 . . . . 0.0 112.917 178.57 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 67.3 mttm -58.37 -25.08 61.62 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 121.446 -1.032 . . . . 0.0 113.13 177.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -96.09 -0.69 49.96 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.335 1.454 . . . . 0.0 114.005 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.2 t -60.07 144.24 50.08 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 122.341 1.067 . . . . 0.0 111.007 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -80.01 -8.77 59.53 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.611 1.165 . . . . 0.0 113.036 -177.07 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.9 t -89.56 117.41 32.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 173.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.58 -40.73 72.39 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -177.516 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -64.06 -38.37 90.82 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.664 0.786 . . . . 0.0 112.915 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 51.9 t -68.03 -57.14 6.64 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.458 1.503 . . . . 0.0 110.285 178.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.35 -28.09 62.85 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.296 1.039 . . . . 0.0 113.084 177.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 68.7 m -79.32 -49.77 11.91 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.739 0.816 . . . . 0.0 112.268 176.18 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.6 m -61.61 -33.98 74.86 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.498 -0.751 . . . . 0.0 111.962 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -58.75 -31.87 68.73 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.014 0.926 . . . . 0.0 112.546 176.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -68.74 -35.3 76.94 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.074 0.852 . . . . 0.0 111.592 176.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 7.9 mt -68.84 -45.23 81.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 123.846 0.858 . . . . 0.0 109.668 176.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 18.1 mm -62.44 -40.75 89.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.151 0.98 . . . . 0.0 110.911 175.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 70.8 m -61.09 -26.66 67.81 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.968 0.907 . . . . 0.0 113.106 178.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.5 t60 -62.14 -56.59 17.26 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.688 1.131 . . . . 0.0 109.889 177.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 41.5 m95 -60.19 -30.63 69.49 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 178.123 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -72.8 -28.13 62.4 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 178.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -100.14 -34.97 9.82 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 179.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.3 t -74.39 134.16 42.44 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.413 1.485 . . . . 0.0 111.225 -178.374 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 61.6 p -123.22 -9.65 8.11 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -176.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -78.91 159.81 27.56 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 0.0 113.499 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 39.2 p-80 -93.14 -25.22 17.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.695 1.198 . . . . 0.0 111.324 172.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 17.5 t0 -106.84 86.13 2.27 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.615 1.966 . . . . 0.0 110.797 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 50.9 t -138.69 135.87 18.25 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 126.842 2.057 . . . . 0.0 108.7 179.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -58.76 -26.55 80.45 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 123.049 2.5 . . . . 0.0 114.627 -177.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 39.4 t -92.07 -48.97 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.636 1.107 . . . . 0.0 111.643 176.363 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.5 m -69.96 -43.98 70.43 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -175.405 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.03 -54.31 48.62 Favored Pre-proline 0 CA--C 1.552 1.021 0 O-C-N 120.904 -1.123 . . . . 0.0 112.845 -178.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -65.8 -4.41 9.88 Favored 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 122.91 2.406 . . . . 0.0 114.996 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.6 mt -100.0 -47.61 4.94 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.91 1.284 . . . . 0.0 109.911 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -58.59 -36.86 74.65 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.204 1.402 . . . . 0.0 111.918 176.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 16.6 p30 -83.93 -10.02 58.27 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 179.033 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -102.81 -38.96 7.2 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.947 1.299 . . . . 0.0 113.619 -178.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 32.8 t -73.37 142.03 47.02 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 121.684 0.754 . . . . 0.0 112.504 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 38.0 t70 -84.54 -6.05 59.34 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.904 1.282 . . . . 0.0 112.844 178.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -79.11 40.64 0.42 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 126.028 1.731 . . . . 0.0 113.383 -178.072 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 40.9 ptt180 . . . . . 0 N--CA 1.478 0.951 0 C-N-CA 126.996 2.119 . . . . 0.0 113.973 -178.507 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 34.5 m . . . . . 0 N--CA 1.472 0.652 0 CA-C-O 119.029 -0.51 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -60.02 -27.37 66.84 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 177.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 67.0 m -74.53 -34.49 63.01 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 178.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.7 t70 -90.25 -27.43 19.49 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.426 1.09 . . . . 0.0 113.229 176.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -42.9 -54.38 4.22 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.731 2.412 . . . . 0.0 112.966 -178.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 42.1 p-90 -75.3 -4.84 41.5 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -175.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 87.1 mttt -107.91 -60.32 1.73 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -177.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 26.0 mt -120.14 12.14 11.79 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -169.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.5 tt . . . . . 0 CA--C 1.55 0.976 0 C-N-CA 125.191 1.396 . . . . 0.0 114.028 -176.514 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 86.5 mt . . . . . 0 CA--C 1.551 0.987 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.27 152.75 32.7 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -174.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 90.9 mt -125.19 179.96 4.84 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 129.209 3.004 . . . . 0.0 113.557 -177.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 88.0 p -100.11 152.58 37.87 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.85 1.66 . . . . 0.0 106.999 169.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_exo -56.48 -23.78 49.41 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.569 2.179 . . . . 0.0 114.889 -178.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.2 t70 -71.42 -29.15 64.56 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.945 0.898 . . . . 0.0 112.98 178.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 15.5 t70 -76.58 -15.0 59.96 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 93.8 mt -58.13 -35.38 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 O-C-N 121.435 -0.791 . . . . 0.0 109.947 175.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -69.14 -9.85 54.83 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.75 1.22 . . . . 0.0 113.391 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -83.73 -29.06 27.81 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.285 1.034 . . . . 0.0 111.715 177.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.3 p-90 . . . . . 0 N--CA 1.471 0.589 0 C-N-CA 123.847 0.859 . . . . 0.0 112.498 176.51 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 30.7 mmtp . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 119.714 -0.184 . . . . 0.0 110.524 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -64.99 -39.5 93.57 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.819 0.848 . . . . 0.0 111.34 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -59.0 -41.0 86.62 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.132 0.878 . . . . 0.0 111.11 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 94.3 mt -64.84 -38.44 90.97 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.683 0.793 . . . . 0.0 111.848 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -65.5 -53.83 35.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 CA-C-N 119.066 0.848 . . . . 0.0 109.454 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -52.29 -52.06 55.05 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.184 0.994 . . . . 0.0 111.563 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -35.53 80.46 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -179.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 14.0 tp60 -74.21 -44.05 54.75 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.044 0.838 . . . . 0.0 110.88 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.8 tt -59.63 -46.25 89.56 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.863 1.265 . . . . 0.0 110.435 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 92.4 t -58.24 -32.13 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.008 0.822 . . . . 0.0 111.221 175.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.58 -26.15 61.6 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.827 -1.17 . . . . 0.0 113.854 175.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.8 mp -63.6 -32.59 74.11 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 120.104 1.32 . . . . 0.0 108.911 173.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 4.1 mt -69.14 -50.42 48.09 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.708 1.203 . . . . 0.0 109.564 175.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 17.9 t60 -55.79 -53.55 55.28 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 122.603 0.361 . . . . 0.0 110.365 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -58.31 -27.29 63.96 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -86.28 -28.36 23.81 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.996 0.816 . . . . 0.0 112.885 176.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 40.9 mttm -86.06 -36.21 19.81 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.017 1.327 . . . . 0.0 112.223 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 49.5 t -60.85 -48.4 82.0 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 127.067 2.147 . . . . 0.0 111.051 177.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.5 pt20 . . . . . 0 CA--C 1.547 0.85 0 O-C-N 121.322 -0.861 . . . . 0.0 112.335 175.736 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 95.2 m-70 . . . . . 0 N--CA 1.472 0.659 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.7 t -67.61 -50.44 58.16 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.3 1.44 . . . . 0.0 109.258 175.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -55.49 -40.83 72.21 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.123 1.369 . . . . 0.0 111.585 174.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.3 m -64.74 -56.53 13.08 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.526 1.13 . . . . 0.0 111.044 177.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.7 mmt -64.25 -36.81 85.31 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.79 -32.08 73.41 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.909 1.686 . . . . 0.0 112.667 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -71.48 -41.4 69.37 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.165 0.586 . . . . 0.0 110.398 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 76.1 t -62.56 -48.06 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.467 0.707 . . . . 0.0 110.839 177.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.71 -44.63 90.44 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.918 0.887 . . . . 0.0 111.635 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -67.74 -17.43 64.55 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 177.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 58.2 t60 -88.75 -49.75 6.65 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.857 0.863 . . . . 0.0 109.512 173.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.2 ttp -56.77 -28.15 60.76 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.273 1.829 . . . . 0.0 113.591 -177.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.9 p -67.77 -27.7 66.99 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.569 1.148 . . . . 0.0 112.783 175.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -105.26 -17.55 14.42 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.775 1.63 . . . . 0.0 113.853 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 30.4 t -62.1 146.97 48.92 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.24 1.416 . . . . 0.0 112.218 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -116.79 -13.72 10.75 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.53 1.532 . . . . 0.0 113.881 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -94.81 -27.24 15.87 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.096 0.959 . . . . 0.0 112.373 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.34 -112.89 2.58 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.619 1.105 . . . . 0.0 113.007 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -61.78 -18.18 58.9 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 121.392 -1.064 . . . . 0.0 113.309 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.26 -0.25 44.35 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.45 1.5 . . . . 0.0 113.644 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 15.4 t -59.69 144.01 49.15 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 122.473 1.13 . . . . 0.0 110.779 179.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 56.4 mm-40 -78.52 -8.39 58.51 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.5 1.12 . . . . 0.0 113.053 -176.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 90.8 t -91.05 115.04 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 173.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.34 -36.88 66.76 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -177.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -67.49 -32.63 73.59 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.374 1.07 . . . . 0.0 112.809 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 47.9 t -74.73 -55.42 5.87 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.357 1.463 . . . . 0.0 109.72 177.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -54.91 -45.81 74.8 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.261 1.025 . . . . 0.0 112.624 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 23.8 p -63.9 -46.33 85.36 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 177.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 62.8 m -63.17 -33.22 75.01 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 118.859 0.754 . . . . 0.0 112.039 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -63.7 -30.8 71.86 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 118.168 -0.92 . . . . 0.0 112.674 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -63.98 -37.98 89.4 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.213 1.37 . . . . 0.0 110.692 173.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.9 mt -66.99 -42.49 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.205 1.002 . . . . 0.0 110.365 178.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 19.4 mm -66.09 -36.74 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 123.599 0.76 . . . . 0.0 110.911 176.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 54.1 m -66.11 -24.08 66.62 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.422 1.089 . . . . 0.0 113.251 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -62.35 -59.03 5.58 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.243 0.928 . . . . 0.0 110.852 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 56.5 m95 -60.61 -26.22 66.84 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 48.1 mttp -72.95 -33.75 66.1 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.869 0.868 . . . . 0.0 113.144 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.7 p30 -100.05 -29.56 12.45 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 6.3 t -79.05 133.92 36.78 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.439 1.096 . . . . 0.0 112.315 -178.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 74.2 p -130.12 2.14 4.74 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.658 1.583 . . . . 0.0 114.311 -178.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -78.31 155.78 29.98 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.203 1.401 . . . . 0.0 113.612 -178.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -88.56 -33.11 17.83 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.875 0.87 . . . . 0.0 110.646 171.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 19.8 t0 -103.03 80.24 1.84 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.851 2.06 . . . . 0.0 111.478 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 42.8 t -132.19 134.97 25.69 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 126.995 2.118 . . . . 0.0 107.958 177.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -59.96 -22.9 70.86 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 122.252 1.968 . . . . 0.0 113.52 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 5.0 t -92.14 -51.49 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 119.409 1.004 . . . . 0.0 111.634 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 19.6 m -65.68 -44.06 87.36 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -177.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.52 -56.4 27.27 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.149 -175.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -63.34 -30.65 73.25 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 121.789 1.675 . . . . 0.0 113.068 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 97.8 mt -69.84 -44.16 70.45 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.47 1.032 . . . . 0.0 111.288 176.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -64.74 -35.06 79.86 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.192 0.997 . . . . 0.0 111.184 175.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 57.4 t30 -68.12 -40.3 82.56 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.458 1.103 . . . . 0.0 111.065 175.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.748 0 C-N-CA 124.378 1.071 . . . . 0.0 112.763 177.619 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 95.9 m . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 119.733 -0.175 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -60.19 -28.48 68.0 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.61 0.764 . . . . 0.0 112.924 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 42.5 m -70.19 -34.2 72.66 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.853 0.861 . . . . 0.0 112.631 178.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -90.1 -26.61 20.14 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.593 1.157 . . . . 0.0 113.365 175.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.2 tt -45.41 -60.04 2.37 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 126.913 2.085 . . . . 0.0 113.498 -176.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 40.0 p-90 -66.72 -10.52 47.71 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -173.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 9.1 ptmm? -112.12 -57.72 2.23 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 47.2 mt -116.05 13.96 15.95 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 -171.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.9 tt . . . . . 0 CA--C 1.551 1.014 0 C-N-CA 125.701 1.6 . . . . 0.0 113.703 179.366 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 24.0 tp . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 62.1 mmm -67.3 159.5 29.11 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.732 1.753 . . . . 0.0 115.732 -177.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 96.3 mt -125.06 170.51 11.1 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 127.666 2.386 . . . . 0.0 112.766 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 30.7 t -86.36 146.65 42.67 Favored Pre-proline 0 CA--C 1.543 0.696 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 169.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.8 Cg_exo -54.14 -21.45 22.14 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.89 2.394 . . . . 0.0 115.087 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 32.7 t70 -73.27 -22.07 60.46 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.342 1.057 . . . . 0.0 113.006 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -78.92 -17.44 55.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.062 0.945 . . . . 0.0 112.994 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.65 -34.26 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 125.134 1.374 . . . . 0.0 110.667 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -68.41 -10.03 52.43 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.702 1.201 . . . . 0.0 113.814 178.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 52.6 tp60 -82.35 -39.11 23.24 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.093 -1.004 . . . . 0.0 111.373 177.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.255 3.9 p-90 . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 179.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 56.1 mtpt . . . . . 0 N--CA 1.474 0.75 0 CA-C-O 119.377 -0.344 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 6.9 mmp_? -58.47 -42.98 88.7 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.957 0.903 . . . . 0.0 111.544 176.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -64.43 -28.65 69.82 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 177.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 98.7 mt -69.92 -37.86 76.06 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.534 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -63.13 -52.75 55.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 174.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -52.51 -55.71 20.22 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.949 0.9 . . . . 0.0 111.412 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -34.26 77.41 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -178.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -69.47 -44.87 70.29 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.485 1.039 . . . . 0.0 110.365 177.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 5.1 tt -60.07 -43.8 95.21 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.603 1.161 . . . . 0.0 110.017 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 85.4 t -58.94 -31.43 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.1 0.864 . . . . 0.0 111.525 175.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 4.4 tp -72.26 -29.61 64.07 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.137 1.335 . . . . 0.0 112.816 175.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -60.97 -33.83 73.82 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 120.394 1.452 . . . . 0.0 109.14 174.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 7.0 mt -66.7 -51.84 51.47 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.307 1.043 . . . . 0.0 109.998 175.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 31.4 t60 -57.3 -57.35 13.0 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 119.19 -0.433 . . . . 0.0 110.291 177.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -51.79 -41.21 61.51 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.419 1.088 . . . . 0.0 113.548 -178.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -75.32 -35.99 61.13 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 36.9 mttm -73.31 -46.84 47.2 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.954 0.902 . . . . 0.0 110.844 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 35.3 t -55.79 -45.51 78.19 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 127.123 2.169 . . . . 0.0 111.151 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 7.7 tt0 . . . . . 0 CA--C 1.54 0.569 0 C-N-CA 125.782 1.633 . . . . 0.0 112.659 175.7 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 37.7 m80 . . . . . 0 CA--C 1.539 0.533 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.5 t -66.42 -51.84 52.7 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.806 1.243 . . . . 0.0 109.019 175.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -55.87 -38.86 70.69 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.806 1.242 . . . . 0.0 111.367 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 33.1 m -66.16 -57.14 8.29 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.959 0.904 . . . . 0.0 111.538 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.2 mmt -64.35 -36.33 83.79 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -177.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -64.71 -28.9 69.91 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 120.738 1.608 . . . . 0.0 112.773 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -74.06 -39.74 63.27 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.129 0.572 . . . . 0.0 110.449 173.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 92.8 t -63.01 -44.84 99.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 121.753 -0.592 . . . . 0.0 110.744 176.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.54 -44.8 95.71 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.957 0.903 . . . . 0.0 110.576 177.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -63.52 -31.4 72.55 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.127 0.876 . . . . 0.0 113.202 175.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 74.5 t60 -74.73 -50.64 16.74 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.324 -0.86 . . . . 0.0 109.303 175.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.7 ttp -58.65 -30.95 67.71 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.32 1.848 . . . . 0.0 114.127 -177.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 25.0 p -70.22 -27.85 64.81 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 119.958 1.254 . . . . 0.0 112.307 174.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 78.6 t60 -96.83 -24.02 16.1 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.032 1.733 . . . . 0.0 113.556 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 20.0 t -60.06 148.68 34.87 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.373 1.469 . . . . 0.0 113.182 -177.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -113.87 -14.59 12.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.303 1.841 . . . . 0.0 113.503 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -103.9 -31.98 9.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.453 1.101 . . . . 0.0 112.536 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.55 -107.78 0.58 Allowed Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.559 1.076 . . . . 0.0 113.601 177.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 64.6 tttp -59.29 -25.51 64.17 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.034 -1.274 . . . . 0.0 112.48 177.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -94.97 -0.23 54.05 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.453 1.501 . . . . 0.0 113.833 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.1 t -61.71 143.64 55.87 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 122.407 1.099 . . . . 0.0 110.581 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.8 mm-40 -80.15 -6.14 57.24 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.513 1.125 . . . . 0.0 113.373 -176.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 16.8 t -92.82 124.53 45.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.748 1.219 . . . . 0.0 108.653 175.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.59 -46.25 70.3 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -176.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.56 -31.88 71.4 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 -178.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 51.2 t -67.65 -57.48 6.32 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.914 0.886 . . . . 0.0 109.859 178.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -61.76 -15.53 41.93 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.7 m -89.05 -55.61 3.61 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.341 1.057 . . . . 0.0 112.121 176.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.2 m -61.34 -31.98 71.86 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.478 1.036 . . . . 0.0 111.989 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -61.43 -32.75 72.72 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.548 -0.72 . . . . 0.0 111.987 175.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -66.26 -32.28 73.6 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.503 1.047 . . . . 0.0 111.481 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 12.3 mt -71.18 -46.83 64.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.252 1.021 . . . . 0.0 109.675 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 23.2 mm -60.87 -44.06 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 123.942 0.897 . . . . 0.0 110.687 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 44.9 m -57.56 -22.44 44.69 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 178.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.0 t60 -63.31 -53.06 58.71 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.636 1.107 . . . . 0.0 110.277 176.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 64.6 m95 -65.05 -27.91 69.12 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -68.72 -33.02 73.22 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.579 0.752 . . . . 0.0 112.31 175.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -100.04 -35.64 9.63 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 -177.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.2 t -80.53 137.18 36.4 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.352 1.461 . . . . 0.0 112.555 -176.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 22.1 m -129.99 -19.77 3.19 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.476 1.511 . . . . 0.0 113.274 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -68.39 140.78 55.84 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.514 1.525 . . . . 0.0 112.048 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -77.81 -38.11 47.16 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.222 0.609 . . . . 0.0 112.387 177.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 24.0 t70 -86.98 69.95 10.28 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.055 1.742 . . . . 0.0 111.745 179.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.8 t -124.17 135.22 26.14 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 126.543 1.937 . . . . 0.0 109.763 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -58.89 -25.47 77.11 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.964 2.443 . . . . 0.0 114.405 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.5 t -92.21 -51.16 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 119.748 1.158 . . . . 0.0 111.726 176.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.8 m -69.6 -39.64 77.14 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -175.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.5 tt -56.44 -55.65 40.31 Favored Pre-proline 0 CA--C 1.547 0.852 0 O-C-N 120.893 -1.129 . . . . 0.0 112.76 -178.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -61.44 -28.79 84.24 Favored 'Trans proline' 0 C--N 1.353 0.765 0 CA-C-N 121.609 1.61 . . . . 0.0 113.264 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 91.2 mt -70.15 -45.53 66.59 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.807 1.185 . . . . 0.0 111.401 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -63.84 -33.27 75.32 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.191 0.597 . . . . 0.0 111.229 176.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 59.1 t30 -72.81 -40.63 65.67 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.79 1.236 . . . . 0.0 111.833 176.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.629 0 C-N-CA 125.044 1.338 . . . . 0.0 113.892 179.429 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 20.9 m . . . . . 0 N--CA 1.473 0.675 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -60.26 -31.37 70.15 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.772 0.829 . . . . 0.0 112.738 174.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 54.0 m -69.45 -32.8 71.96 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.1 t70 -90.08 -29.52 18.29 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.74 1.216 . . . . 0.0 113.058 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -45.2 -58.14 3.46 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.843 2.057 . . . . 0.0 113.508 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -69.99 -9.76 56.29 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -112.06 -51.78 2.83 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 116.835 2.161 . . . . 0.0 116.835 -176.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 55.4 mt -117.04 20.19 13.92 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -170.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 7.5 tp . . . . . 0 CA--C 1.55 0.945 0 C-N-CA 125.911 1.685 . . . . 0.0 115.012 -174.409 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 83.7 mt . . . . . 0 CA--C 1.547 0.855 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 5.6 tpt -62.98 135.41 57.28 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -173.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.5 tt -124.99 144.88 50.15 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.391 2.276 . . . . 0.0 111.379 -177.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 52.2 m -73.24 151.53 90.08 Favored Pre-proline 0 N--CA 1.475 0.811 0 C-N-CA 124.946 1.299 . . . . 0.0 113.141 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -60.78 -23.92 77.65 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.574 2.849 . . . . 0.0 115.252 -177.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -78.71 -23.76 45.33 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.47 -0.769 . . . . 0.0 112.315 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -83.48 -9.86 58.71 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.61 1.564 . . . . 0.0 112.526 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 89.2 mt -57.87 -32.16 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 119.131 0.878 . . . . 0.0 109.46 173.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -69.74 -9.92 56.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.372 1.069 . . . . 0.0 113.476 177.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -77.89 -28.78 49.98 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.109 0.964 . . . . 0.0 111.7 177.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.4 p-90 . . . . . 0 N--CA 1.469 0.504 0 C-N-CA 124.068 0.947 . . . . 0.0 112.853 177.612 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 59.0 mtpt . . . . . 0 N--CA 1.472 0.669 0 N-CA-C 110.476 -0.194 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 27.3 ttp-105 -57.04 -51.29 69.84 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.535 1.134 . . . . 0.0 112.509 178.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -67.41 -29.69 69.26 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.112 0.869 . . . . 0.0 112.766 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 60.4 mt -66.37 -42.13 88.46 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.941 0.791 . . . . 0.0 111.192 174.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.4 mt -64.22 -51.23 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.527 1.058 . . . . 0.0 109.569 175.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -53.88 -52.13 61.45 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.533 0.733 . . . . 0.0 111.558 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -37.05 85.68 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.176 0.898 . . . . 0.0 113.099 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 16.1 tp60 -69.82 -44.08 70.69 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.794 0.724 . . . . 0.0 111.045 178.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.0 tt -63.45 -41.91 98.64 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.471 0.709 . . . . 0.0 110.231 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 94.5 t -59.8 -32.21 49.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 119.398 0.999 . . . . 0.0 111.15 174.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 1.6 tp -71.2 -26.31 62.9 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.913 -1.117 . . . . 0.0 112.995 175.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.33 -29.13 70.22 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 120.597 1.544 . . . . 0.0 109.612 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.3 mt -73.37 -53.63 10.28 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.734 1.213 . . . . 0.0 108.906 175.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 15.4 t60 -54.98 -56.06 23.95 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 122.887 0.475 . . . . 0.0 110.792 177.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -55.99 -23.49 32.9 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -90.07 -33.6 16.24 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.144 -0.972 . . . . 0.0 113.112 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 42.4 mttm -82.34 -31.13 30.02 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.441 1.497 . . . . 0.0 112.693 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.1 t -68.98 -51.91 34.52 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.227 2.211 . . . . 0.0 111.488 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.4 pt20 . . . . . 0 N--CA 1.476 0.857 0 O-C-N 121.062 -1.024 . . . . 0.0 113.405 178.377 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 75.7 m80 . . . . . 0 N--CA 1.472 0.641 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.9 t -68.03 -50.23 56.65 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 174.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -56.06 -37.2 68.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.577 1.551 . . . . 0.0 111.563 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 24.1 m -68.26 -58.18 4.82 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.511 1.124 . . . . 0.0 111.296 176.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -39.14 91.09 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.564 -0.732 . . . . 0.0 112.729 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -63.27 -33.77 76.22 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.483 1.492 . . . . 0.0 112.956 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -70.83 -41.06 72.01 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.118 0.567 . . . . 0.0 110.582 174.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 70.1 t -63.84 -47.28 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.381 0.672 . . . . 0.0 110.989 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.58 -43.99 89.65 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.998 0.919 . . . . 0.0 111.237 179.034 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -68.39 -17.07 64.14 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 176.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 56.6 t60 -89.99 -48.33 7.28 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.916 0.886 . . . . 0.0 109.963 174.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.7 ttp -56.41 -27.77 57.46 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.377 1.871 . . . . 0.0 113.392 -178.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 12.4 p -69.53 -24.27 63.71 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.976 1.31 . . . . 0.0 113.037 175.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 66.0 m80 -108.96 -17.77 13.84 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.261 1.824 . . . . 0.0 114.093 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.9 t -61.19 149.05 38.74 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.542 1.537 . . . . 0.0 112.72 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -118.38 -15.15 9.72 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.891 1.676 . . . . 0.0 113.747 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -98.8 -28.89 13.28 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.325 1.05 . . . . 0.0 112.802 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.13 -111.24 1.89 Allowed Glycine 0 CA--C 1.536 1.376 0 C-N-CA 124.336 0.969 . . . . 0.0 113.112 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.7 mttt -61.28 -20.82 63.32 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 121.22 -1.164 . . . . 0.0 113.226 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.95 -0.6 50.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.637 1.575 . . . . 0.0 113.537 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.5 t -63.95 141.53 58.73 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.114 0.959 . . . . 0.0 109.935 177.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -80.33 -5.14 55.86 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.208 1.003 . . . . 0.0 113.675 -175.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 84.1 t -89.21 112.98 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 172.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.55 -38.76 64.14 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -69.31 -30.98 69.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.481 1.113 . . . . 0.0 113.423 -178.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 41.5 t -73.1 -54.82 7.54 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.135 1.374 . . . . 0.0 108.997 176.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.83 -25.59 65.11 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 90.1 p -82.24 -48.88 10.73 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.386 0.993 . . . . 0.0 112.151 175.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 69.8 m -61.59 -33.59 74.14 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.372 -0.83 . . . . 0.0 112.259 178.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 43.9 tpt85 -61.63 -29.99 70.41 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.486 -0.759 . . . . 0.0 112.934 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -71.0 -32.61 69.47 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.019 0.927 . . . . 0.0 111.212 176.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 27.9 mt -70.78 -44.76 75.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 124.156 0.982 . . . . 0.0 109.227 176.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 22.7 mm -61.79 -36.71 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.984 0.914 . . . . 0.0 110.947 174.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 61.0 m -63.02 -23.56 67.51 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.676 0.79 . . . . 0.0 113.121 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 6.8 t60 -63.63 -58.35 7.2 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.331 0.969 . . . . 0.0 110.694 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 56.2 m95 -61.69 -23.19 65.94 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 177.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 94.4 mttt -76.49 -35.57 58.31 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.937 0.895 . . . . 0.0 112.768 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -100.03 -30.31 12.04 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 179.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.6 t -76.14 136.52 39.81 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.099 1.359 . . . . 0.0 111.469 -179.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.8 p -127.72 -6.98 5.64 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -176.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 -81.76 147.22 29.55 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.353 1.061 . . . . 0.0 113.335 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.7 p-80 -81.67 -27.8 33.86 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.738 0.815 . . . . 0.0 110.534 171.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 16.1 p-10 -98.69 69.93 1.88 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.487 2.315 . . . . 0.0 111.94 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 54.0 t -127.14 134.71 26.43 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 126.533 1.933 . . . . 0.0 109.248 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -57.0 -26.97 71.3 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 123.099 2.533 . . . . 0.0 114.551 -178.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 8.1 t -92.14 -52.96 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-N 119.441 1.019 . . . . 0.0 111.59 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.4 m -67.22 -39.11 86.22 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -174.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.1 tt -54.24 -57.79 16.71 Favored Pre-proline 0 CA--C 1.547 0.844 0 CA-C-O 117.804 -1.093 . . . . 0.0 113.209 -177.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.53 -31.25 92.14 Favored 'Trans proline' 0 C--N 1.352 0.736 0 CA-C-N 121.644 1.623 . . . . 0.0 113.041 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.13 -49.87 46.33 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.01 0.924 . . . . 0.0 112.44 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -65.52 -28.92 69.52 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.108 0.867 . . . . 0.0 111.862 176.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 9.4 t30 -71.87 -43.1 66.02 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.71 1.204 . . . . 0.0 111.949 175.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.59 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -179.008 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 90.8 m . . . . . 0 N--CA 1.469 0.488 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.19 -30.88 69.64 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 175.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 22.9 t -70.13 -33.65 72.09 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.5 t70 -90.15 -26.13 20.33 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.849 -1.157 . . . . 0.0 113.437 174.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -42.63 -58.02 2.47 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.891 2.076 . . . . 0.0 113.106 -179.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 45.3 p-90 -70.52 -11.91 61.23 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -172.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 50.4 pttt -112.03 -60.27 1.88 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -177.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 58.2 mt -120.21 18.59 12.28 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 116.65 2.092 . . . . 0.0 116.65 -172.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 5.4 tt . . . . . 0 CA--C 1.552 1.031 0 C-N-CA 125.266 1.426 . . . . 0.0 113.595 -178.754 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 22.7 tp . . . . . 0 CA--C 1.553 1.083 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 7.7 tpt -71.95 154.65 41.06 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -176.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 25.7 mt -124.26 169.81 11.39 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.503 2.321 . . . . 0.0 112.546 -176.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.2 m -76.92 151.44 82.06 Favored Pre-proline 0 CA--C 1.544 0.729 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 169.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -60.07 -14.59 29.13 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 123.086 2.524 . . . . 0.0 115.264 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.0 t70 -78.96 -19.17 52.36 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 120.916 -1.115 . . . . 0.0 112.978 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -81.65 -13.31 58.08 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.356 1.062 . . . . 0.0 113.081 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 91.3 mt -54.84 -36.93 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.471 1.509 . . . . 0.0 111.495 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -76.1 -9.91 59.0 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -84.53 -25.09 29.01 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.138 0.975 . . . . 0.0 113.526 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.678 0 CA-C-N 119.556 1.071 . . . . 0.0 112.301 -178.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 31.0 mmtp . . . . . 0 N--CA 1.474 0.747 0 CA-C-O 119.179 -0.438 . . . . 0.0 110.697 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -42.37 93.79 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.783 0.833 . . . . 0.0 111.136 174.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -58.84 -40.36 83.99 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.037 0.835 . . . . 0.0 111.289 174.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.8 -36.68 83.94 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 118.395 -0.812 . . . . 0.0 111.676 177.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -67.36 -55.14 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 119.216 0.916 . . . . 0.0 109.479 174.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -49.68 -52.33 31.85 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.687 1.195 . . . . 0.0 111.51 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 4.0 pp0? -65.22 -36.77 85.18 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 112.924 0.712 . . . . 0.0 112.924 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -69.69 -46.0 67.03 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.061 0.846 . . . . 0.0 110.139 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.11 -41.44 96.7 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.756 1.222 . . . . 0.0 111.156 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 83.8 t -60.15 -32.45 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-N 119.44 1.018 . . . . 0.0 110.937 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.37 -29.14 62.44 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.17 -0.956 . . . . 0.0 113.18 176.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -62.15 -37.45 85.26 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.445 1.02 . . . . 0.0 108.692 171.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.2 mt -65.59 -49.17 69.78 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.659 0.784 . . . . 0.0 110.077 177.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 28.5 t60 -56.58 -54.58 44.25 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 118.702 -0.666 . . . . 0.0 110.228 177.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.36 -46.27 66.09 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 118.603 0.638 . . . . 0.0 112.035 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -64.51 -45.2 88.26 Favored 'General case' 0 C--N 1.345 0.373 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 58.4 mttm -69.4 -25.34 64.09 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.688 1.195 . . . . 0.0 113.054 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.8 t -80.68 -52.26 7.75 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 127.11 2.164 . . . . 0.0 110.654 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.9 pt20 . . . . . 0 N--CA 1.474 0.761 0 O-C-N 120.202 -1.561 . . . . 0.0 112.791 179.416 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 99.2 m-70 . . . . . 0 N--CA 1.472 0.648 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.5 t -68.38 -50.42 53.12 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.906 1.282 . . . . 0.0 109.035 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -55.29 -39.07 69.43 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.028 1.331 . . . . 0.0 111.582 174.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 21.5 m -67.39 -57.43 6.59 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.459 1.104 . . . . 0.0 111.063 176.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.9 mmt -62.03 -37.07 83.54 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -177.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -65.23 -37.14 86.34 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.319 1.418 . . . . 0.0 113.053 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -65.14 -39.06 92.48 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 122.653 0.381 . . . . 0.0 110.539 175.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 96.9 t -65.12 -48.08 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 123.058 0.543 . . . . 0.0 110.459 175.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -39.35 92.23 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.161 0.984 . . . . 0.0 112.449 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 43.9 m-20 -61.31 -39.05 89.06 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.461 0.704 . . . . 0.0 111.501 175.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.2 t60 -78.75 -50.08 11.96 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.197 0.999 . . . . 0.0 111.733 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -56.84 -32.88 66.21 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.832 1.653 . . . . 0.0 114.116 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 6.6 t -72.71 -15.07 61.69 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 119.91 1.232 . . . . 0.0 112.818 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 81.7 t60 -105.27 -28.99 10.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.897 1.679 . . . . 0.0 112.639 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 30.4 t -58.5 144.77 41.32 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.105 1.762 . . . . 0.0 112.836 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -117.9 -12.25 10.18 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.602 1.561 . . . . 0.0 113.726 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -91.21 -27.16 18.65 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.209 1.004 . . . . 0.0 112.175 178.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.48 -112.33 2.32 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.764 1.173 . . . . 0.0 112.75 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.3 mttt -61.49 -19.57 62.21 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 121.588 -0.948 . . . . 0.0 113.417 178.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.85 -2.44 47.43 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.179 1.391 . . . . 0.0 113.625 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 18.1 t -59.93 144.46 48.93 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 122.323 1.058 . . . . 0.0 110.737 178.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -79.03 -8.3 58.83 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.463 1.105 . . . . 0.0 113.17 -176.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 97.6 t -89.99 115.01 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 173.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.66 -38.84 70.14 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -176.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -67.39 -37.99 83.99 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.796 0.838 . . . . 0.0 112.461 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 43.0 t -66.08 -56.63 10.55 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.687 1.595 . . . . 0.0 109.536 176.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -56.84 -31.44 64.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.389 1.076 . . . . 0.0 112.968 177.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.5 m -77.01 -49.89 14.36 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.027 0.931 . . . . 0.0 112.351 177.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 70.8 m -60.08 -36.0 76.42 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 121.529 -0.732 . . . . 0.0 111.6 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -58.87 -33.03 70.01 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.132 0.973 . . . . 0.0 112.782 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -67.09 -32.75 74.12 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 118.876 0.762 . . . . 0.0 111.671 177.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 1.7 mt -76.39 -45.42 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 123.289 0.636 . . . . 0.0 109.816 177.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 35.7 mm -60.57 -37.66 75.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.268 1.027 . . . . 0.0 110.735 176.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 22.7 t -58.14 -29.9 65.91 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.328 1.051 . . . . 0.0 112.252 176.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.3 t60 -63.94 -52.84 57.89 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.161 0.891 . . . . 0.0 109.995 176.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 39.1 m95 -61.74 -30.28 70.67 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 10.7 mtpm? -70.88 -28.61 64.69 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.458 0.703 . . . . 0.0 112.758 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -100.11 -38.12 8.67 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.951 1.464 . . . . 0.0 114.951 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.6 t -78.23 134.64 37.55 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.474 1.51 . . . . 0.0 112.929 -176.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 79.9 p -130.09 -1.67 4.6 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.646 1.578 . . . . 0.0 114.242 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 22.9 ttt-85 -83.07 145.68 29.13 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.193 1.397 . . . . 0.0 112.683 -177.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 41.9 p-80 -78.06 -30.11 49.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.509 0.724 . . . . 0.0 112.35 176.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 20.7 t0 -103.1 84.16 2.31 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.044 1.738 . . . . 0.0 111.316 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 46.8 t -139.67 135.79 17.06 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 126.85 2.06 . . . . 0.0 108.468 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -57.47 -27.48 76.44 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.17 2.58 . . . . 0.0 115.383 -176.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 16.6 t -92.14 -49.86 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 CA-C-N 119.805 1.184 . . . . 0.0 111.387 176.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 4.1 m -69.54 -39.91 77.17 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -174.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.1 tt -55.09 -57.02 21.88 Favored Pre-proline 0 N--CA 1.475 0.804 0 CA-C-O 117.748 -1.12 . . . . 0.0 112.934 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.54 -31.08 91.94 Favored 'Trans proline' 0 C--N 1.354 0.824 0 CA-C-N 121.682 1.636 . . . . 0.0 113.082 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.8 mt -70.55 -45.13 66.04 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.211 0.914 . . . . 0.0 111.601 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 60.1 mttm -60.99 -37.65 83.25 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.423 1.089 . . . . 0.0 110.898 175.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 20.4 t30 -73.3 -41.56 63.42 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.354 1.461 . . . . 0.0 112.745 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.628 0 C-N-CA 124.05 0.94 . . . . 0.0 113.453 -179.149 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.6 m-85 -60.28 -29.15 68.63 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.408 0.683 . . . . 0.0 112.277 174.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 35.9 m -68.01 -34.62 76.85 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.231 0.923 . . . . 0.0 112.916 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.4 t70 -90.03 -30.29 17.84 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.218 1.007 . . . . 0.0 113.136 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.1 tt -43.4 -58.38 2.6 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.105 2.162 . . . . 0.0 113.168 -178.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 44.5 p-90 -71.08 -11.45 60.96 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 -173.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -110.1 -60.08 1.84 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 116.312 1.967 . . . . 0.0 116.312 -175.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 77.9 mt -120.28 16.78 12.3 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 116.665 2.098 . . . . 0.0 116.665 -172.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 6.1 tt . . . . . 0 CA--C 1.554 1.127 0 C-N-CA 125.243 1.417 . . . . 0.0 113.349 -178.35 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 85.8 mt . . . . . 0 CA--C 1.547 0.832 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 68.0 mmm -66.03 148.07 52.37 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -177.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.05 178.18 5.67 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.688 1.995 . . . . 0.0 111.372 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 74.4 m -89.02 152.85 48.82 Favored Pre-proline 0 CA--C 1.546 0.791 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 169.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.74 -18.56 49.14 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 122.546 2.164 . . . . 0.0 115.781 -176.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -76.47 -17.08 59.48 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.04 -1.038 . . . . 0.0 112.596 177.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -82.79 -12.44 57.48 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.313 1.045 . . . . 0.0 112.535 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 96.4 mt -59.07 -35.88 59.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.869 1.268 . . . . 0.0 110.753 178.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -73.32 -9.8 59.08 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.811 1.244 . . . . 0.0 113.265 178.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -79.6 -20.72 46.19 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.964 0.906 . . . . 0.0 111.138 175.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.8 p-90 . . . . . 0 N--CA 1.468 0.441 0 C-N-CA 124.437 1.095 . . . . 0.0 113.033 177.171 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 39.9 ttmt . . . . . 0 CA--C 1.536 0.429 0 CA-C-O 119.61 -0.233 . . . . 0.0 111.495 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 96.9 mtm-85 -69.12 -33.28 73.22 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.427 -0.796 . . . . 0.0 111.181 174.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -65.36 -33.24 75.5 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 118.826 0.739 . . . . 0.0 111.367 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.44 -36.36 83.49 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 118.872 0.76 . . . . 0.0 111.052 175.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -67.01 -52.96 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 118.551 0.614 . . . . 0.0 109.63 175.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -51.94 -56.07 16.44 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.848 0.859 . . . . 0.0 111.443 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -36.05 83.05 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.0 tp60 -70.96 -41.76 70.63 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 119.234 0.925 . . . . 0.0 110.393 178.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.9 tt -62.18 -40.86 97.47 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.578 0.751 . . . . 0.0 109.919 177.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 97.1 t -59.62 -33.37 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.13 0.877 . . . . 0.0 110.942 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.0 tp -73.23 -25.55 60.78 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.875 1.216 . . . . 0.0 113.835 175.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -62.72 -30.19 71.23 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.788 1.176 . . . . 0.0 109.044 172.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.3 mt -72.95 -54.38 8.81 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.118 0.967 . . . . 0.0 108.513 174.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 20.4 t60 -49.4 -55.87 11.55 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.678 0.672 . . . . 0.0 111.273 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -57.65 -22.96 48.75 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -90.04 -24.65 21.12 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -88.0 -41.54 13.05 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 119.843 1.201 . . . . 0.0 112.211 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 25.4 t -59.59 -41.61 90.65 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.107 1.363 . . . . 0.0 111.108 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 6.7 pt20 . . . . . 0 CA--C 1.549 0.919 0 O-C-N 120.651 -1.281 . . . . 0.0 113.055 174.492 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 39.0 m80 . . . . . 0 CA--C 1.54 0.595 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 30.8 t -64.16 -50.05 69.71 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.643 1.177 . . . . 0.0 109.752 176.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -53.92 -43.58 69.87 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.222 1.409 . . . . 0.0 111.015 174.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 19.4 m -64.02 -55.34 22.99 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.699 0.8 . . . . 0.0 111.787 176.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.7 mmt -65.0 -34.64 78.92 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -67.37 -34.94 78.33 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 121.142 1.792 . . . . 0.0 112.081 178.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -66.19 -37.82 86.54 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.214 0.461 . . . . 0.0 110.46 174.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 78.7 t -64.96 -52.17 57.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 123.49 0.716 . . . . 0.0 110.448 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.11 -44.86 87.91 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.722 1.209 . . . . 0.0 112.666 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 37.7 m-20 -66.41 -20.39 66.05 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.562 0.745 . . . . 0.0 112.653 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 63.7 t60 -90.17 -50.92 5.72 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.362 1.065 . . . . 0.0 109.933 172.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.1 ttp -54.99 -34.53 63.49 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.646 1.978 . . . . 0.0 113.474 -177.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 14.8 t -64.12 -27.33 69.01 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 119.276 0.944 . . . . 0.0 112.403 177.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 41.6 m80 -98.28 -26.25 14.58 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.362 1.465 . . . . 0.0 113.302 177.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 49.6 t -63.38 132.49 51.63 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.509 1.523 . . . . 0.0 112.889 -178.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -106.67 -14.15 15.1 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.38 1.472 . . . . 0.0 113.717 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -84.31 -32.96 24.04 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.283 0.947 . . . . 0.0 111.216 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.55 -106.55 0.32 Allowed Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.066 1.317 . . . . 0.0 113.188 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.74 -21.56 63.11 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.753 -0.851 . . . . 0.0 113.2 177.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -97.86 -2.66 40.31 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.639 1.576 . . . . 0.0 113.571 177.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.8 t -60.13 144.59 49.44 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 122.304 1.049 . . . . 0.0 110.612 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -81.26 -10.06 59.66 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.962 1.305 . . . . 0.0 113.234 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 98.2 t -89.16 115.98 29.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 174.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.32 -41.46 72.44 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -64.08 -42.16 97.05 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.478 0.711 . . . . 0.0 112.389 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.7 t -63.12 -53.37 54.52 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.033 1.333 . . . . 0.0 109.974 176.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -56.06 -38.86 71.21 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.97 0.908 . . . . 0.0 112.375 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 25.5 m -67.06 -53.37 31.68 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.975 0.91 . . . . 0.0 113.135 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.8 m -59.34 -26.95 65.48 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.162 0.892 . . . . 0.0 112.823 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.6 -31.5 71.57 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 118.335 -0.841 . . . . 0.0 112.229 175.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -65.93 -38.67 89.25 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.921 1.237 . . . . 0.0 110.89 174.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 9.4 mt -68.39 -48.15 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.129 0.972 . . . . 0.0 110.323 179.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 16.8 mm -62.13 -36.29 73.49 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 123.918 0.887 . . . . 0.0 111.232 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 71.9 m -61.63 -23.71 66.22 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 176.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.7 t60 -64.58 -56.46 13.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.584 1.084 . . . . 0.0 110.268 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 55.5 m95 -61.21 -29.35 69.77 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -70.28 -30.29 67.27 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.939 0.896 . . . . 0.0 112.782 177.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -100.06 -38.91 8.36 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.2 t -80.07 133.4 36.11 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.483 1.513 . . . . 0.0 112.611 -176.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 71.7 p -130.0 1.61 4.78 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.929 1.692 . . . . 0.0 113.893 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -75.91 154.71 35.79 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.273 1.429 . . . . 0.0 113.299 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 18.8 t60 -88.26 -39.2 14.61 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.588 0.755 . . . . 0.0 110.365 172.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 20.1 t0 -94.96 80.49 3.66 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.915 1.686 . . . . 0.0 111.374 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.5 t -134.97 135.45 23.11 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.736 2.014 . . . . 0.0 109.123 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -59.05 -25.18 76.87 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.751 2.3 . . . . 0.0 114.153 -178.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.7 t -92.16 -52.97 9.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 119.817 1.189 . . . . 0.0 111.618 176.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 9.0 m -68.61 -37.73 80.02 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.235 1.569 . . . . 0.0 115.235 -174.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -56.27 -57.53 22.17 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-O 117.63 -1.176 . . . . 0.0 112.8 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -61.08 -31.62 90.9 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 121.933 1.755 . . . . 0.0 113.411 179.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 93.3 mt -68.13 -48.49 65.25 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.888 0.767 . . . . 0.0 111.175 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -63.95 -35.79 81.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.753 0.821 . . . . 0.0 111.37 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 49.4 t30 -64.51 -46.72 81.72 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.525 1.13 . . . . 0.0 110.894 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.77 0 C-N-CA 123.901 0.88 . . . . 0.0 112.515 176.97 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 86.6 m . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 119.46 -0.305 . . . . 0.0 111.25 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -60.11 -29.54 68.67 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.403 0.681 . . . . 0.0 112.602 176.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 70.5 m -71.04 -31.09 67.46 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.888 0.875 . . . . 0.0 113.215 178.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.1 t70 -90.05 -31.14 17.29 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.811 1.244 . . . . 0.0 112.826 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.8 tt -42.59 -60.02 1.69 Allowed 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 127.665 2.386 . . . . 0.0 113.489 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.4 p-90 -70.18 -11.36 60.84 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 115.272 1.582 . . . . 0.0 115.272 -174.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -111.5 -60.03 1.9 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 116.034 1.864 . . . . 0.0 116.034 -175.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 6.6 mp -120.18 20.21 12.07 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -174.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 3.0 tt . . . . . 0 N--CA 1.476 0.829 0 C-N-CA 124.979 1.311 . . . . 0.0 114.137 -178.938 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 21.3 tp . . . . . 0 CA--C 1.554 1.116 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 76.5 mmm -66.33 155.37 37.48 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 -177.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.07 167.18 15.12 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.071 2.148 . . . . 0.0 114.984 -178.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 88.2 p -91.58 162.26 32.02 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 127.202 2.201 . . . . 0.0 108.749 169.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -62.78 -24.56 74.6 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.023 1.815 . . . . 0.0 113.327 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.0 t70 -63.54 -29.12 70.43 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.756 0.823 . . . . 0.0 112.944 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 11.5 t70 -90.12 -17.58 27.42 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 75.5 mt -59.88 -38.33 75.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 CA-C-N 119.792 1.178 . . . . 0.0 110.942 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . 0.304 0.0 OUTLIER -67.98 -9.82 48.56 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 176.628 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -79.37 -29.84 42.3 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.105 -0.997 . . . . 0.0 111.77 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.27 15.0 p-90 . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 178.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 14.2 mptt . . . . . 0 N--CA 1.47 0.535 0 CA-C-O 118.309 -0.853 . . . . 0.0 110.387 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -55.79 -43.93 77.3 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 119.615 1.098 . . . . 0.0 111.586 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -60.71 -38.56 85.46 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.699 0.8 . . . . 0.0 111.582 176.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 93.2 mt -66.3 -38.79 88.54 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.36 0.664 . . . . 0.0 111.637 177.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -62.29 -54.57 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 119.027 0.83 . . . . 0.0 109.754 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -53.63 -55.57 24.72 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.818 1.247 . . . . 0.0 111.095 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -33.36 75.65 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -69.75 -46.56 65.59 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.809 1.186 . . . . 0.0 109.781 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 5.9 tp -59.22 -41.95 89.84 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.56 0.744 . . . . 0.0 111.195 177.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 63.4 t -59.08 -31.89 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-N 119.996 1.271 . . . . 0.0 111.485 176.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 5.8 tp -72.49 -31.42 65.38 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.707 -1.245 . . . . 0.0 112.871 175.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.0 mp -60.48 -31.14 70.18 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 120.249 1.386 . . . . 0.0 109.603 172.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.6 mt -71.1 -51.7 23.6 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.546 0.738 . . . . 0.0 109.975 176.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 21.6 t60 -56.29 -55.8 28.93 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.264 0.625 . . . . 0.0 111.071 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -50.39 -41.74 52.5 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.717 1.207 . . . . 0.0 114.004 -175.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -73.93 -44.44 55.04 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.212 0.915 . . . . 0.0 112.569 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 44.4 mttm -65.73 -43.13 89.96 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.364 1.066 . . . . 0.0 111.229 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 42.2 t -62.21 -47.35 84.83 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.196 1.798 . . . . 0.0 110.388 175.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 14.7 tt0 . . . . . 0 CA--C 1.539 0.548 0 O-C-N 121.302 -0.874 . . . . 0.0 112.881 177.413 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 32.6 m80 . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 43.5 t -67.15 -51.45 53.69 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.292 1.437 . . . . 0.0 109.656 177.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -57.11 -34.93 68.85 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.912 1.285 . . . . 0.0 111.6 174.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.5 m -69.21 -60.97 1.99 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.239 1.016 . . . . 0.0 110.908 175.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.1 mmt -59.4 -35.34 73.78 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -177.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -66.56 -34.47 77.98 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 120.659 1.572 . . . . 0.0 112.722 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -69.73 -37.36 76.47 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.914 -0.491 . . . . 0.0 110.311 173.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 59.3 t -64.78 -40.84 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-O 118.966 -0.54 . . . . 0.0 110.264 175.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.94 -43.78 94.78 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.908 1.283 . . . . 0.0 111.014 175.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -63.7 -36.6 84.37 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.222 0.609 . . . . 0.0 112.006 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 63.5 t60 -74.72 -52.55 11.27 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.741 0.816 . . . . 0.0 110.687 177.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.3 ttp -58.24 -33.27 69.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.741 1.616 . . . . 0.0 113.668 -176.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 3.9 t -75.45 -10.06 59.12 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 119.657 1.117 . . . . 0.0 113.275 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 46.6 m80 -117.37 -16.72 10.24 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.761 1.625 . . . . 0.0 113.717 177.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 38.1 t -57.57 144.72 36.2 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.466 1.506 . . . . 0.0 112.946 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -103.77 -15.12 15.82 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.046 1.738 . . . . 0.0 113.564 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -106.94 -34.0 7.34 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.329 1.052 . . . . 0.0 112.448 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.5 -105.73 0.24 Allowed Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.828 1.204 . . . . 0.0 114.096 177.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -60.09 -21.9 62.07 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 121.133 -1.216 . . . . 0.0 112.828 177.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -100.78 0.2 38.32 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.272 1.829 . . . . 0.0 113.522 176.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 12.5 t -63.67 143.28 57.97 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 122.261 1.029 . . . . 0.0 110.375 178.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -84.6 -6.48 59.37 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.761 1.224 . . . . 0.0 113.51 -176.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 88.0 t -83.96 120.91 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 173.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.66 -44.38 69.59 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 72.3 m80 -62.28 -42.3 99.23 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 50.2 t -64.91 -55.95 16.2 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.78 1.232 . . . . 0.0 111.311 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.61 -32.75 70.69 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.371 0.668 . . . . 0.0 112.482 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 74.2 m -73.63 -47.0 43.43 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.543 0.737 . . . . 0.0 111.549 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 69.6 m -62.27 -36.61 82.59 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.584 1.154 . . . . 0.0 112.1 178.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -61.65 -31.77 71.89 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.318 -0.864 . . . . 0.0 113.009 175.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -69.65 -28.53 65.97 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.146 0.884 . . . . 0.0 111.27 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.8 mm -70.83 -50.38 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 123.888 0.875 . . . . 0.0 109.645 174.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 12.9 mm -61.34 -42.22 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 124.949 1.299 . . . . 0.0 111.425 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 50.2 m -60.41 -20.81 61.03 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.431 0.901 . . . . 0.0 113.431 179.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.3 t60 -64.78 -55.9 16.89 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.474 1.034 . . . . 0.0 110.728 176.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 50.1 m95 -62.54 -24.72 67.66 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -74.08 -30.74 62.52 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.539 0.736 . . . . 0.0 112.461 176.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -100.05 -38.12 8.69 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.9 t -78.53 135.23 37.26 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.426 1.49 . . . . 0.0 112.373 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 79.7 p -129.97 2.17 4.81 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.518 1.527 . . . . 0.0 114.175 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -82.23 152.17 26.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.236 1.414 . . . . 0.0 113.499 -178.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 15.0 t60 -86.62 -37.92 17.59 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.862 0.865 . . . . 0.0 109.934 171.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 21.4 t0 -94.3 78.48 3.94 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.017 1.727 . . . . 0.0 111.336 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.8 t -132.67 135.44 26.11 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 126.819 2.047 . . . . 0.0 109.232 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -59.79 -24.24 75.1 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.798 2.332 . . . . 0.0 114.027 -178.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 8.1 t -92.22 -52.99 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-N 119.608 1.095 . . . . 0.0 111.855 176.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 15.2 m -68.97 -40.4 78.86 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -175.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.8 tt -55.92 -56.12 33.85 Favored Pre-proline 0 CA--C 1.545 0.785 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.571 -178.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -61.7 -30.15 84.7 Favored 'Trans proline' 0 C--N 1.355 0.873 0 CA-C-N 121.679 1.635 . . . . 0.0 113.287 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 91.2 mt -69.73 -45.7 67.58 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.873 1.215 . . . . 0.0 111.494 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -63.26 -35.85 81.72 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.917 0.887 . . . . 0.0 110.749 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 22.9 t30 -71.41 -40.12 70.68 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.004 1.322 . . . . 0.0 112.197 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.613 0 C-N-CA 124.804 1.242 . . . . 0.0 113.251 178.941 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 99.4 m . . . . . 0 N--CA 1.476 0.862 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -60.11 -29.3 68.52 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 177.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 69.8 m -70.55 -29.94 66.54 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.781 0.832 . . . . 0.0 112.911 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.9 t70 -90.22 -30.37 17.6 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.615 1.166 . . . . 0.0 113.156 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.5 tt -45.66 -59.96 2.46 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.88 2.072 . . . . 0.0 113.252 -177.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.4 p-90 -67.99 -8.5 37.94 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -174.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -111.99 -58.07 2.18 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 44.1 mt -120.15 19.95 12.13 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 116.061 1.874 . . . . 0.0 116.061 -171.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.1 tt . . . . . 0 CA--C 1.55 0.957 0 C-N-CA 125.871 1.668 . . . . 0.0 114.999 -178.216 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 35.6 tp . . . . . 0 CA--C 1.549 0.917 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 47.9 mmm -62.19 153.24 30.95 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 -177.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 94.7 mt -125.21 155.96 39.23 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 127.336 2.254 . . . . 0.0 112.337 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 33.5 p -75.95 160.01 79.5 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 170.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -61.81 -17.43 55.11 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 121.83 1.687 . . . . 0.0 114.139 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 28.8 t70 -77.08 -25.76 52.67 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.216 1.006 . . . . 0.0 112.877 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -77.89 -14.11 59.66 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.859 0.864 . . . . 0.0 112.703 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 77.7 mt -58.41 -37.46 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.892 1.277 . . . . 0.0 110.615 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -68.14 -9.96 50.52 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.068 1.747 . . . . 0.0 113.113 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -86.71 -27.05 23.94 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.666 1.186 . . . . 0.0 112.561 178.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 . . . . . 0 N--CA 1.477 0.913 0 C-N-CA 123.981 0.912 . . . . 0.0 112.349 174.871 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 33.4 mmtp . . . . . 0 N--CA 1.471 0.581 0 CA-C-O 118.233 -0.889 . . . . 0.0 112.116 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -54.35 -43.86 71.65 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 120.039 1.29 . . . . 0.0 112.106 178.228 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -60.7 -31.2 70.48 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 96.4 mt -71.41 -41.16 69.92 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.2 0.909 . . . . 0.0 111.705 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.9 mt -64.22 -51.75 64.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -55.94 -54.64 42.26 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.636 1.174 . . . . 0.0 111.258 177.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -35.6 80.79 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -177.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -66.35 -46.25 77.43 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.765 1.166 . . . . 0.0 109.773 176.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 10.3 tp -59.94 -42.03 93.11 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.118 0.567 . . . . 0.0 111.017 176.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 84.3 t -60.93 -31.01 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.661 1.119 . . . . 0.0 111.285 175.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.6 tp -74.79 -28.18 60.62 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.228 1.376 . . . . 0.0 112.816 174.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 8.6 mp -61.31 -28.13 68.98 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 120.288 1.404 . . . . 0.0 108.934 171.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.9 mt -74.55 -58.7 3.12 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.079 -0.962 . . . . 0.0 108.926 174.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 25.2 t60 -47.6 -55.37 9.43 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.062 0.846 . . . . 0.0 110.438 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -51.0 -36.08 37.35 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.355 1.062 . . . . 0.0 113.74 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -83.62 -37.8 22.41 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 178.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -70.06 -37.32 75.48 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 119.848 1.204 . . . . 0.0 110.578 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 36.5 t -65.95 -43.04 89.12 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.813 2.045 . . . . 0.0 110.899 176.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 24.5 tt0 . . . . . 0 N--CA 1.476 0.858 0 C-N-CA 124.631 1.172 . . . . 0.0 113.135 175.957 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 54.2 m80 . . . . . 0 CA--C 1.539 0.542 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 24.6 t -68.96 -53.13 22.45 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.532 1.133 . . . . 0.0 108.605 175.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 20.6 ttt85 -55.12 -32.45 62.06 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.517 1.527 . . . . 0.0 111.644 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.2 m -73.36 -59.06 2.89 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.17 1.388 . . . . 0.0 111.336 174.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.7 mmt -62.28 -36.25 81.5 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -65.15 -29.29 70.11 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 120.588 1.54 . . . . 0.0 112.711 178.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -74.9 -38.52 61.82 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.35 0.66 . . . . 0.0 110.447 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 84.1 t -63.17 -44.28 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.729 0.695 . . . . 0.0 110.011 175.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -47.65 84.06 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.189 0.996 . . . . 0.0 110.784 177.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -63.81 -22.96 67.17 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 176.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 71.5 t60 -83.94 -49.78 8.66 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.998 0.817 . . . . 0.0 109.632 174.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 34.8 ttp -57.57 -29.4 64.4 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.418 1.887 . . . . 0.0 113.559 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 20.2 p -69.85 -29.1 66.26 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 121.087 -1.008 . . . . 0.0 112.528 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -95.79 -26.34 15.7 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.894 1.678 . . . . 0.0 112.992 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 18.0 t -60.63 150.26 32.46 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.598 1.559 . . . . 0.0 112.873 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -121.25 -13.18 8.53 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.888 1.675 . . . . 0.0 113.638 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -95.57 -27.64 15.24 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.254 1.022 . . . . 0.0 112.421 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.55 -113.07 2.77 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 124.534 1.064 . . . . 0.0 113.132 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -63.46 -15.58 58.16 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.149 -1.206 . . . . 0.0 113.644 178.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -97.92 -1.71 42.28 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.242 1.417 . . . . 0.0 113.128 175.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 18.5 t -60.33 144.02 51.6 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 122.278 1.037 . . . . 0.0 110.839 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 58.1 mm-40 -78.88 -7.75 58.22 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.562 1.145 . . . . 0.0 113.0 -176.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 93.8 t -90.23 116.57 31.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 173.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.34 -38.6 68.97 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -65.93 -44.74 84.23 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.212 0.605 . . . . 0.0 112.247 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 40.4 t -59.94 -55.9 28.32 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.992 1.317 . . . . 0.0 110.728 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.95 -22.59 64.58 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.7 m -83.4 -51.56 7.29 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.882 0.873 . . . . 0.0 111.368 176.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 57.7 m -58.51 -35.98 73.1 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.269 -0.895 . . . . 0.0 112.354 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 37.3 tpt85 -63.7 -24.76 67.91 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.48 -0.762 . . . . 0.0 112.982 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -72.62 -30.4 64.31 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.015 0.825 . . . . 0.0 111.152 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.0 mm -70.51 -44.73 76.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 175.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 26.7 mm -60.22 -37.91 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.725 1.21 . . . . 0.0 110.645 176.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 67.4 m -61.64 -25.23 67.24 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.047 0.939 . . . . 0.0 113.324 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.2 t60 -62.84 -56.73 14.8 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.87 1.214 . . . . 0.0 110.838 179.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 51.8 m95 -62.85 -21.47 65.98 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 64.0 mttm -82.19 -26.77 33.07 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.331 1.052 . . . . 0.0 112.799 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -100.12 -43.64 6.26 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.955 1.302 . . . . 0.0 113.341 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 9.4 t -84.0 133.53 34.67 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.579 1.952 . . . . 0.0 110.958 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 69.4 p -129.97 -4.69 4.52 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.644 1.35 . . . . 0.0 114.644 -177.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 77.1 mtp85 -66.19 153.39 42.56 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.815 1.646 . . . . 0.0 113.64 -178.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -86.97 -26.45 23.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.444 0.698 . . . . 0.0 111.349 171.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 21.3 t0 -108.06 78.7 1.2 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.865 2.066 . . . . 0.0 111.433 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.0 t -136.48 136.01 21.49 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 127.289 2.236 . . . . 0.0 108.334 178.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -59.01 -24.28 72.62 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.763 2.309 . . . . 0.0 114.068 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.9 t -92.15 -52.01 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.694 1.134 . . . . 0.0 111.288 175.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 10.8 m -68.6 -42.1 78.63 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.974 1.472 . . . . 0.0 114.974 -175.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.2 tt -52.27 -57.48 15.18 Favored Pre-proline 0 CA--C 1.547 0.844 0 CA-C-O 117.802 -1.094 . . . . 0.0 113.316 -177.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -60.46 -31.65 92.79 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.78 1.654 . . . . 0.0 113.54 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.6 mt -73.25 -44.58 59.14 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.659 0.784 . . . . 0.0 112.255 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -58.94 -37.86 77.69 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.842 0.857 . . . . 0.0 110.305 174.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 38.5 t30 -73.37 -36.57 66.11 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.94 1.696 . . . . 0.0 113.385 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -178.207 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 91.2 m . . . . . 0 N--CA 1.477 0.893 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.35 -29.37 68.85 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.157 0.983 . . . . 0.0 112.956 174.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 18.2 m -69.26 -33.92 73.98 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -90.18 -28.07 19.15 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.062 0.945 . . . . 0.0 112.985 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -44.76 -60.13 2.18 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 126.761 2.024 . . . . 0.0 113.932 -176.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -68.03 -10.24 52.16 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -171.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.67 -56.59 2.36 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -176.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 53.2 mt -119.99 11.4 11.74 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 -171.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.552 1.03 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 27.8 tp . . . . . 0 CA--C 1.553 1.062 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.85 137.85 56.9 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -174.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -125.03 139.37 53.87 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 128.088 2.555 . . . . 0.0 111.994 -179.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 73.8 p -64.79 146.29 98.62 Favored Pre-proline 0 N--CA 1.473 0.725 0 C-N-CA 124.109 0.963 . . . . 0.0 113.237 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -60.79 -30.26 89.86 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.816 2.344 . . . . 0.0 114.393 -177.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.27 -22.57 66.31 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.526 -0.734 . . . . 0.0 112.623 176.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 13.6 t70 -90.06 -9.85 46.95 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 84.7 mt -55.92 -37.81 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-N 119.638 1.108 . . . . 0.0 111.035 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -64.07 -9.73 18.02 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.133 1.373 . . . . 0.0 113.961 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.4 tp60 -77.43 -37.87 50.8 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.079 -1.013 . . . . 0.0 111.323 174.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 . . . . . 0 N--CA 1.472 0.638 0 C-N-CA 123.486 0.714 . . . . 0.0 111.979 178.783 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 72.9 mmtt . . . . . 0 N--CA 1.469 0.499 0 CA-C-O 119.536 -0.269 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -53.64 -44.3 69.47 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.092 0.957 . . . . 0.0 112.16 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -63.5 -30.98 72.02 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 177.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 75.9 mt -70.14 -40.93 74.5 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.618 0.767 . . . . 0.0 110.031 175.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.5 mt -60.65 -50.78 79.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.19 -53.18 57.04 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.413 1.085 . . . . 0.0 111.516 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -35.45 79.56 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -69.41 -46.77 66.05 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.951 0.796 . . . . 0.0 110.865 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.7 tt -58.81 -43.1 90.51 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.034 0.934 . . . . 0.0 110.379 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 60.2 t -61.56 -31.81 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.979 0.809 . . . . 0.0 111.515 175.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 33.6 tp -67.02 -37.55 84.34 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.606 -1.309 . . . . 0.0 111.976 174.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.93 -25.57 63.58 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 119.326 0.966 . . . . 0.0 110.955 176.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 7.0 mt -74.07 -55.12 6.49 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.734 0.814 . . . . 0.0 109.737 176.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 14.2 t60 -56.96 -50.48 72.51 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 119.192 -0.432 . . . . 0.0 110.898 178.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -60.01 -22.53 62.71 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -178.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -90.14 -31.06 17.25 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.975 -1.078 . . . . 0.0 112.927 173.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 58.1 mttm -80.09 -40.01 28.45 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.104 1.362 . . . . 0.0 112.6 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.5 t -63.06 -45.79 90.53 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.527 1.931 . . . . 0.0 111.44 177.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.7 pt20 . . . . . 0 CA--C 1.545 0.772 0 O-C-N 121.292 -0.88 . . . . 0.0 111.783 175.382 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 35.9 m80 . . . . . 0 N--CA 1.472 0.647 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 40.4 t -62.32 -46.74 87.35 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.27 1.028 . . . . 0.0 109.91 176.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -54.92 -35.22 63.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.36 1.464 . . . . 0.0 112.146 175.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 49.3 m -72.07 -60.18 2.36 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.614 0.765 . . . . 0.0 110.807 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 15.6 mmt -60.34 -34.03 73.25 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -64.88 -33.58 76.35 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 120.566 1.53 . . . . 0.0 112.675 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -72.14 -37.91 69.34 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.131 0.572 . . . . 0.0 110.197 174.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 66.9 t -62.45 -46.61 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 122.948 0.499 . . . . 0.0 110.696 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.0 -43.7 98.5 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.975 0.91 . . . . 0.0 111.799 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -64.86 -32.89 74.81 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 176.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 61.0 t60 -75.04 -52.07 11.99 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.728 0.811 . . . . 0.0 110.204 175.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 40.6 ttp -56.73 -31.16 64.26 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.524 1.93 . . . . 0.0 114.304 -177.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.7 t -77.98 -9.94 59.35 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 120.059 1.3 . . . . 0.0 112.99 176.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -118.93 -14.0 9.43 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.749 1.619 . . . . 0.0 113.916 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 43.5 t -56.61 144.65 31.16 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.684 1.594 . . . . 0.0 113.045 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -96.71 -13.84 22.45 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.003 1.721 . . . . 0.0 113.588 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -118.7 -30.68 5.05 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.268 1.027 . . . . 0.0 113.558 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.21 -107.58 0.6 Allowed Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.717 1.151 . . . . 0.0 113.436 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -61.62 -20.59 63.52 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 121.053 -1.263 . . . . 0.0 112.945 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -100.51 1.52 41.11 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.062 1.745 . . . . 0.0 113.561 176.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.5 t -63.54 139.86 58.81 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.262 1.025 . . . . 0.0 110.013 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -81.44 0.14 38.98 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -175.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 16.6 t -90.49 125.3 43.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.732 1.213 . . . . 0.0 109.159 176.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.38 -28.1 51.83 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -175.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -90.06 -18.63 25.57 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.686 1.735 . . . . 0.0 115.686 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 52.7 t -83.17 -59.86 2.33 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.126 1.37 . . . . 0.0 111.076 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.02 -29.53 65.38 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 4.7 p -73.57 -54.92 7.06 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 124.958 1.303 . . . . 0.0 111.822 176.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 53.0 m -59.4 -34.68 72.74 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.47 0.708 . . . . 0.0 111.692 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 45.1 tpt85 -62.86 -30.02 71.2 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -67.78 -34.7 77.31 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.307 0.958 . . . . 0.0 110.963 175.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 10.2 mt -67.82 -45.64 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 124.15 0.98 . . . . 0.0 109.731 176.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 15.0 mm -60.76 -36.74 73.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.918 0.887 . . . . 0.0 111.229 176.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.14 -21.17 66.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 177.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.0 t60 -64.11 -59.97 3.8 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.422 1.01 . . . . 0.0 110.726 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 62.4 m95 -60.62 -26.95 67.39 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 63.4 mttm -71.5 -34.76 70.41 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.831 0.852 . . . . 0.0 112.787 178.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.14 -32.31 10.97 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 178.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 9.6 t -78.21 133.78 37.69 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.444 1.498 . . . . 0.0 111.996 -178.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 71.5 p -130.09 -1.04 4.64 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.335 1.454 . . . . 0.0 114.492 -178.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -80.14 150.26 30.27 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.738 1.215 . . . . 0.0 112.685 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.1 p-80 -84.37 -36.13 22.69 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.329 0.652 . . . . 0.0 111.569 175.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.8 t0 -94.19 70.05 3.8 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.069 1.748 . . . . 0.0 111.854 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 47.7 t -122.99 134.2 24.94 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 126.329 1.852 . . . . 0.0 109.524 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -58.33 -25.64 73.68 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.927 2.418 . . . . 0.0 114.36 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 39.3 t -92.12 -52.55 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 119.209 0.913 . . . . 0.0 111.65 176.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 7.8 m -69.73 -36.97 76.31 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -175.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -57.36 -57.12 27.26 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 117.625 -1.178 . . . . 0.0 112.337 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -59.94 -30.9 92.82 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.778 1.652 . . . . 0.0 113.197 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 94.5 mt -70.28 -47.02 63.1 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.183 0.901 . . . . 0.0 111.869 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -63.64 -37.97 89.36 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.725 0.693 . . . . 0.0 110.635 176.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 34.3 t30 -65.47 -36.55 84.23 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.638 1.175 . . . . 0.0 112.267 176.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.699 0 C-N-CA 124.304 1.041 . . . . 0.0 113.325 178.54 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 6.2 m . . . . . 0 N--CA 1.475 0.796 0 N-CA-C 110.832 -0.062 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -60.24 -31.14 69.92 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.527 0.731 . . . . 0.0 112.49 176.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 49.0 m -69.86 -29.32 66.52 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.863 0.756 . . . . 0.0 112.871 177.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.0 t70 -90.17 -29.76 18.05 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.776 1.231 . . . . 0.0 113.23 176.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.1 tt -45.49 -60.0 2.41 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.943 2.097 . . . . 0.0 113.42 -177.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.0 p-90 -69.6 -10.49 58.41 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -173.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -109.6 -53.77 2.63 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 115.748 1.759 . . . . 0.0 115.748 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 59.6 mt -119.9 11.61 11.86 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 116.263 1.949 . . . . 0.0 116.263 -172.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 7.0 tt . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 124.249 1.019 . . . . 0.0 111.279 178.914 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 98.5 mt . . . . . 0 CA--C 1.548 0.896 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 71.6 mmm -62.39 151.49 36.81 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.09 168.0 14.0 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.874 2.07 . . . . 0.0 110.866 178.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 59.4 m -75.49 145.6 79.51 Favored Pre-proline 0 CA--C 1.546 0.825 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 169.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -57.02 -18.66 29.35 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.755 2.303 . . . . 0.0 115.527 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -77.16 -24.29 51.52 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.531 1.133 . . . . 0.0 112.723 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 18.5 t70 -81.84 -9.91 59.47 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.028 0.931 . . . . 0.0 113.221 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 67.7 mt -55.88 -35.24 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.277 1.431 . . . . 0.0 110.283 175.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -67.06 -9.87 43.87 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.784 1.634 . . . . 0.0 113.643 178.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -82.28 -27.04 32.59 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.034 0.934 . . . . 0.0 111.7 176.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.3 p-90 . . . . . 0 N--CA 1.472 0.632 0 CA-C-O 118.106 -0.95 . . . . 0.0 112.316 176.362 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 54.5 mtpt . . . . . 0 N--CA 1.47 0.566 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -50.24 -43.76 53.1 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.77 1.628 . . . . 0.0 113.018 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -61.7 -32.61 72.83 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 177.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 83.2 mt -71.72 -39.34 70.18 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.345 1.058 . . . . 0.0 110.985 177.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 3.0 mt -62.79 -52.45 59.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.343 0.657 . . . . 0.0 109.583 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -56.18 -58.26 8.71 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.634 1.174 . . . . 0.0 111.218 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -35.78 81.72 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -177.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -65.62 -43.07 90.7 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.802 1.183 . . . . 0.0 110.332 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 8.0 tp -62.06 -39.89 93.92 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.25 0.62 . . . . 0.0 110.627 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 63.3 t -60.86 -34.3 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.131 0.878 . . . . 0.0 110.802 174.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 3.4 tp -71.48 -27.77 63.48 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 120.286 1.403 . . . . 0.0 112.853 175.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.9 mp -63.51 -29.2 70.51 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 120.523 1.51 . . . . 0.0 109.63 173.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.1 mt -75.55 -51.39 13.02 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.99 0.916 . . . . 0.0 108.739 174.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 30.6 t60 -53.31 -55.9 20.94 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 123.652 0.781 . . . . 0.0 110.827 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.97 -41.97 65.07 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.09 0.956 . . . . 0.0 113.338 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -72.34 -42.65 65.12 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.537 -0.727 . . . . 0.0 112.399 178.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 56.1 mttm -71.01 -36.47 72.43 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.638 1.175 . . . . 0.0 112.229 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 12.0 t -67.69 -41.44 83.61 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.44 1.896 . . . . 0.0 109.834 175.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.0 tt0 . . . . . 0 CA--C 1.543 0.679 0 C-N-CA 124.357 1.063 . . . . 0.0 110.347 172.392 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 41.2 m80 . . . . . 0 CA--C 1.538 0.494 0 N-CA-C 113.032 0.752 . . . . 0.0 113.032 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 40.7 t -67.55 -51.92 44.95 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.012 1.325 . . . . 0.0 109.678 177.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -57.15 -38.77 74.03 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.7 1.2 . . . . 0.0 111.123 174.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.9 m -65.98 -57.06 8.66 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.465 1.106 . . . . 0.0 111.596 177.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 15.0 mmt -63.41 -37.07 85.86 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 118.235 -0.888 . . . . 0.0 113.147 -177.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -65.34 -32.69 74.46 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 121.143 1.792 . . . . 0.0 112.084 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -69.92 -38.93 76.38 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.911 -0.493 . . . . 0.0 110.777 173.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 89.0 t -64.66 -42.73 95.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 118.791 0.723 . . . . 0.0 110.436 175.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.47 -45.98 84.21 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.344 1.057 . . . . 0.0 110.374 176.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -66.07 -21.54 66.37 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 177.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 60.3 t60 -86.43 -49.56 7.53 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.64 0.776 . . . . 0.0 109.697 174.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -58.31 -27.44 64.1 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.254 1.822 . . . . 0.0 113.532 -177.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 19.4 p -72.34 -26.54 61.96 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.519 1.128 . . . . 0.0 112.618 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 80.3 t60 -102.36 -21.83 14.22 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.06 1.744 . . . . 0.0 113.523 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 25.0 t -57.71 143.06 43.13 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.281 1.432 . . . . 0.0 113.144 -177.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -107.88 -15.7 14.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.999 1.72 . . . . 0.0 113.418 -178.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -103.23 -32.82 9.42 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.561 1.144 . . . . 0.0 112.281 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.56 -105.87 0.26 Allowed Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.979 1.276 . . . . 0.0 113.869 177.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -59.15 -22.13 60.45 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.31 -1.112 . . . . 0.0 112.943 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -102.59 1.78 35.24 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.398 1.879 . . . . 0.0 113.828 177.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 19.5 t -62.32 141.49 58.26 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.216 1.006 . . . . 0.0 110.575 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -81.74 -5.46 58.16 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.324 1.05 . . . . 0.0 113.333 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 97.8 t -86.86 115.57 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 172.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.09 -39.59 69.47 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -176.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.34 -40.89 96.78 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.659 0.784 . . . . 0.0 112.552 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.2 t -65.25 -57.16 9.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.469 1.508 . . . . 0.0 110.818 178.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -61.1 -27.65 68.52 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 68.5 m -76.85 -45.27 29.03 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.381 -0.825 . . . . 0.0 111.198 175.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 64.0 m -62.84 -35.98 81.71 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.239 1.016 . . . . 0.0 111.554 176.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 3.3 mmm-85 -61.81 -30.39 70.79 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -68.37 -29.56 68.3 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.363 0.983 . . . . 0.0 111.243 176.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 1.8 mm -73.28 -47.01 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 176.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 24.6 mm -61.15 -37.99 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.947 1.299 . . . . 0.0 111.571 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 49.1 m -62.78 -21.28 65.75 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.961 0.904 . . . . 0.0 113.222 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.6 t60 -66.24 -60.47 2.76 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.334 0.97 . . . . 0.0 110.448 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 67.2 m95 -59.6 -28.99 67.66 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 89.7 mttt -67.79 -36.09 79.83 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.652 0.781 . . . . 0.0 113.03 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.18 -31.82 11.2 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.1 t -79.22 135.19 36.71 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.198 1.399 . . . . 0.0 112.165 -177.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.7 p -130.1 -2.27 4.56 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.248 1.419 . . . . 0.0 114.644 -177.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -81.75 149.83 28.23 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.736 1.214 . . . . 0.0 112.876 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -84.56 -30.99 24.61 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.549 0.739 . . . . 0.0 111.493 174.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.3 t0 -97.33 69.93 2.28 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.228 1.811 . . . . 0.0 111.346 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.9 t -126.14 135.02 26.54 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 126.296 1.839 . . . . 0.0 109.723 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -57.76 -25.64 69.53 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 123.049 2.499 . . . . 0.0 114.606 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 14.7 t -92.23 -50.89 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 119.48 1.036 . . . . 0.0 111.795 176.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 6.9 m -70.44 -40.28 73.87 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -174.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.4 tt -54.43 -55.94 32.07 Favored Pre-proline 0 CA--C 1.547 0.862 0 CA-C-O 117.825 -1.083 . . . . 0.0 112.854 -178.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -60.92 -30.27 89.66 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.761 1.641 . . . . 0.0 113.454 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.88 -44.17 66.87 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.41 1.004 . . . . 0.0 111.645 177.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -64.97 -31.12 72.2 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.7 0.8 . . . . 0.0 111.35 175.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 32.4 t30 -75.98 -37.13 58.87 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.057 1.343 . . . . 0.0 112.074 176.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.653 0 C-N-CA 124.565 1.146 . . . . 0.0 113.53 -179.437 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 85.9 m . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 119.725 -0.179 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -60.01 -27.09 66.59 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.6 0.76 . . . . 0.0 112.71 176.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 45.5 m -74.79 -30.62 61.5 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.931 0.892 . . . . 0.0 113.06 178.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.2 t70 -90.12 -29.38 18.34 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.581 1.152 . . . . 0.0 112.878 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -43.31 -60.15 1.81 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 127.515 2.326 . . . . 0.0 113.933 -177.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 51.7 p-90 -68.59 -9.79 51.87 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 -172.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -111.96 -56.83 2.34 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 -177.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 63.9 mt -120.02 14.26 12.3 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -170.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.8 tt . . . . . 0 CA--C 1.552 1.054 0 C-N-CA 125.795 1.638 . . . . 0.0 113.842 179.388 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 25.3 tp . . . . . 0 CA--C 1.55 0.977 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.1 141.58 57.4 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -175.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.3 tt -125.16 142.39 51.52 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 128.657 2.783 . . . . 0.0 111.158 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 40.7 t -66.44 142.69 97.85 Favored Pre-proline 0 N--CA 1.477 0.878 0 C-N-CA 124.088 0.955 . . . . 0.0 112.372 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.66 -21.4 47.01 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.76 2.306 . . . . 0.0 115.445 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.7 t70 -75.78 -24.81 56.02 Favored 'General case' 0 CA--C 1.549 0.921 0 O-C-N 121.395 -0.815 . . . . 0.0 112.164 176.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -83.79 -9.72 58.59 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.371 1.869 . . . . 0.0 112.569 177.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 85.2 mt -56.02 -31.15 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.429 1.013 . . . . 0.0 109.678 174.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -67.85 -9.87 48.28 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.011 1.324 . . . . 0.0 113.703 176.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -80.78 -25.14 38.1 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.089 1.356 . . . . 0.0 111.803 177.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 4.5 p-90 . . . . . 0 N--CA 1.472 0.66 0 C-N-CA 124.6 1.16 . . . . 0.0 113.455 177.369 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 54.0 mttp . . . . . 0 N--CA 1.471 0.616 0 CA-C-O 119.036 -0.507 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -54.56 -46.05 73.59 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.22 0.918 . . . . 0.0 111.876 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -62.3 -30.16 70.95 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 177.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.49 -38.82 71.15 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.658 0.783 . . . . 0.0 110.649 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.6 mt -64.32 -53.14 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -53.17 -51.98 60.28 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.399 1.08 . . . . 0.0 111.461 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.53 -34.51 78.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -179.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -71.0 -49.62 43.19 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.815 0.734 . . . . 0.0 110.136 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.5 tt -58.0 -44.8 87.43 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.116 1.366 . . . . 0.0 111.178 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 88.5 t -59.57 -32.94 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 119.457 1.026 . . . . 0.0 111.662 176.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 4.4 tp -74.41 -24.45 59.1 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.847 1.203 . . . . 0.0 113.086 175.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.2 mp -62.77 -31.14 72.05 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 120.546 1.521 . . . . 0.0 109.08 171.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 5.6 mt -70.02 -53.19 18.73 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.123 0.969 . . . . 0.0 109.476 175.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.4 t60 -54.82 -56.04 23.68 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.09 0.556 . . . . 0.0 110.717 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.28 -27.23 54.63 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -86.78 -26.38 24.15 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.467 1.03 . . . . 0.0 113.392 176.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 43.9 mttm -89.94 -36.3 15.08 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.186 1.794 . . . . 0.0 112.683 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.3 t -61.68 -47.96 82.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.957 2.103 . . . . 0.0 111.273 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 13.3 pt20 . . . . . 0 CA--C 1.549 0.939 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 177.167 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 55.4 m80 . . . . . 0 N--CA 1.472 0.671 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.7 t -69.18 -50.72 45.03 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.763 1.225 . . . . 0.0 108.967 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 19.0 tpp85 -55.9 -36.15 67.34 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.412 1.485 . . . . 0.0 111.733 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 8.2 m -69.46 -57.59 5.05 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.145 1.378 . . . . 0.0 111.171 176.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.6 mmt -64.33 -35.48 80.99 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -177.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -63.94 -32.35 73.86 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 120.889 1.677 . . . . 0.0 112.359 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -72.32 -42.39 65.47 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.372 0.669 . . . . 0.0 110.46 174.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 76.8 t -60.51 -47.78 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 123.221 0.608 . . . . 0.0 110.797 176.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.18 -45.16 94.08 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.557 1.143 . . . . 0.0 112.377 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 24.4 m-80 -63.31 -33.59 75.85 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 177.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 66.9 t60 -75.24 -49.42 19.38 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.221 0.609 . . . . 0.0 110.827 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.7 ttp -57.37 -31.21 65.55 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.93 1.692 . . . . 0.0 114.286 -176.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 13.1 t -77.85 -14.41 59.57 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.974 1.261 . . . . 0.0 112.535 176.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 84.3 t60 -99.86 -29.39 12.62 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.771 1.628 . . . . 0.0 111.774 175.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 19.0 t -60.78 152.38 27.14 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.548 1.939 . . . . 0.0 112.513 179.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -127.44 -10.46 5.72 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.381 1.472 . . . . 0.0 114.024 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -92.28 -25.23 18.69 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.071 0.948 . . . . 0.0 112.593 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 55.15 -115.64 5.91 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.259 0.933 . . . . 0.0 112.582 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 62.7 tttp -60.63 -21.28 62.57 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.356 -1.085 . . . . 0.0 112.998 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.07 -1.66 57.75 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.753 1.221 . . . . 0.0 113.628 177.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.9 t -64.65 141.49 58.75 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.056 0.932 . . . . 0.0 109.83 177.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -80.48 -5.21 56.28 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 90.4 t -89.51 113.69 26.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.64 -40.82 66.14 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -176.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -67.62 -30.46 70.04 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.63 1.172 . . . . 0.0 113.609 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.5 t -74.18 -55.53 5.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.068 1.347 . . . . 0.0 109.257 177.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.34 -25.81 66.1 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 85.1 p -81.72 -49.26 10.66 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.34 0.973 . . . . 0.0 111.852 175.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 50.1 m -60.07 -34.49 73.51 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.462 0.705 . . . . 0.0 112.234 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 48.0 tpt85 -61.1 -29.92 70.04 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.464 -0.772 . . . . 0.0 113.028 177.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -69.95 -33.31 71.94 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.712 0.805 . . . . 0.0 110.974 176.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 16.8 mt -69.03 -43.88 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 124.638 1.175 . . . . 0.0 109.373 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 16.9 mm -62.85 -38.12 81.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 123.993 0.917 . . . . 0.0 110.793 174.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 5.6 t -62.44 -27.38 69.06 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.131 0.972 . . . . 0.0 112.65 177.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.9 t60 -60.81 -55.95 26.99 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.292 0.951 . . . . 0.0 111.011 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 43.7 m95 -61.96 -28.72 69.75 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 92.3 mttt -73.3 -28.0 61.85 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.143 0.977 . . . . 0.0 112.794 178.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -100.09 -38.58 8.49 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.5 t -76.7 134.6 39.18 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.787 1.635 . . . . 0.0 112.835 -176.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.5 p -130.07 -0.51 4.67 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.535 1.534 . . . . 0.0 114.361 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -82.85 153.52 25.12 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.019 1.327 . . . . 0.0 113.255 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 16.2 t60 -86.45 -40.38 15.38 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.831 0.853 . . . . 0.0 111.13 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.3 t0 -91.48 69.91 5.89 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.604 1.561 . . . . 0.0 111.852 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.4 t -121.32 132.59 24.18 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 126.297 1.839 . . . . 0.0 109.22 178.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -59.9 -24.41 76.07 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.596 2.197 . . . . 0.0 114.378 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.6 t -92.2 -50.87 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 119.525 1.057 . . . . 0.0 111.476 175.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 12.9 m -69.92 -38.64 76.3 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.9 tt -54.19 -56.37 26.94 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-O 117.752 -1.118 . . . . 0.0 113.006 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -61.41 -30.1 86.56 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 121.77 1.647 . . . . 0.0 113.327 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 93.5 mt -70.95 -46.22 62.79 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.341 0.973 . . . . 0.0 111.736 177.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -62.89 -31.75 72.86 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.636 0.774 . . . . 0.0 111.019 176.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 18.8 t30 -74.35 -39.84 62.53 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.332 1.453 . . . . 0.0 112.137 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.74 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -179.976 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 15.3 m . . . . . 0 N--CA 1.472 0.635 0 CA-C-O 119.444 -0.313 . . . . 0.0 110.218 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -60.07 -30.47 69.24 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.497 0.719 . . . . 0.0 112.289 174.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 50.6 m -70.16 -32.73 70.84 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.7 t70 -90.18 -29.87 17.97 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.098 0.959 . . . . 0.0 112.857 176.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.3 tt -41.46 -58.31 1.93 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 127.484 2.314 . . . . 0.0 113.497 -178.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 48.4 p-90 -71.77 -9.9 58.98 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -173.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.06 -60.16 1.9 Allowed 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 116.504 2.039 . . . . 0.0 116.504 -179.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 48.2 mt -120.16 19.72 12.17 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -170.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 CA--C 1.553 1.069 0 C-N-CA 126.045 1.738 . . . . 0.0 114.487 -177.561 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 94.6 mt . . . . . 0 CA--C 1.548 0.894 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 68.4 mmm -65.94 149.73 49.76 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.685 1.13 . . . . 0.0 113.502 -178.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.87 175.72 7.1 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.975 1.71 . . . . 0.0 111.436 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 74.5 p -78.72 151.16 76.68 Favored Pre-proline 0 CA--C 1.544 0.729 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 169.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.58 -12.23 27.2 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.188 2.592 . . . . 0.0 115.136 -179.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -95.55 -18.97 20.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.29 1.036 . . . . 0.0 112.974 177.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.68 -9.97 59.59 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.074 -1.016 . . . . 0.0 112.404 177.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 77.3 mt -54.81 -31.86 25.12 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 125.979 1.712 . . . . 0.0 110.8 175.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -66.09 -10.08 37.13 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.487 1.515 . . . . 0.0 113.544 177.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.1 tm0? -76.75 -33.85 58.09 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.001 -1.062 . . . . 0.0 111.488 177.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 . . . . . 0 N--CA 1.47 0.55 0 CA-C-O 117.918 -1.039 . . . . 0.0 113.124 178.298 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 81.7 mttt . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 119.208 -0.425 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -57.16 -45.6 83.49 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.543 0.737 . . . . 0.0 111.889 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -60.02 -41.8 92.97 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 118.842 0.746 . . . . 0.0 111.725 175.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.17 -40.05 90.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.746 0.819 . . . . 0.0 112.152 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.5 mt -64.0 -52.03 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 119.504 1.047 . . . . 0.0 109.714 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -53.51 -56.95 12.67 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.217 1.007 . . . . 0.0 111.171 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.87 -36.56 84.75 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -69.53 -42.99 73.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.724 1.147 . . . . 0.0 110.656 178.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 8.2 tp -61.51 -40.09 93.36 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.545 0.738 . . . . 0.0 110.395 176.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 95.8 t -60.52 -32.43 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 119.204 0.911 . . . . 0.0 110.929 174.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.8 tp -72.72 -27.58 62.14 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 120.055 1.298 . . . . 0.0 113.306 174.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -61.88 -33.73 74.73 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 120.412 1.46 . . . . 0.0 108.815 173.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.3 mt -68.89 -51.12 43.5 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.174 0.99 . . . . 0.0 110.046 175.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 19.6 t60 -56.79 -55.85 29.09 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.392 177.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -50.8 -45.8 59.47 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -70.19 -35.3 73.84 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 43.9 mttm -77.73 -38.45 47.09 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.22 1.008 . . . . 0.0 111.745 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 49.6 t -60.8 -46.65 89.7 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.47 2.308 . . . . 0.0 109.587 175.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.4 tt0 . . . . . 0 CA--C 1.541 0.632 0 C-N-CA 125.974 1.71 . . . . 0.0 111.062 173.725 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 36.3 m80 . . . . . 0 CA--C 1.536 0.405 0 CA-C-O 117.747 -1.12 . . . . 0.0 113.941 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . 0.322 0.8 OUTLIER -72.81 -35.15 67.28 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 120.326 1.421 . . . . 0.0 111.207 178.1 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -60.21 -40.85 91.6 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.752 1.221 . . . . 0.0 110.611 171.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.9 m -65.11 -55.37 19.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.688 1.195 . . . . 0.0 110.667 176.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.7 mmt -62.78 -39.2 93.46 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.604 0.965 . . . . 0.0 113.604 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -64.7 -29.61 70.6 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 120.794 1.634 . . . . 0.0 113.133 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -72.67 -39.42 67.11 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.01 0.524 . . . . 0.0 110.483 173.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 90.5 t -63.41 -45.83 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.194 0.598 . . . . 0.0 110.188 175.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.92 -42.86 90.69 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.983 1.313 . . . . 0.0 112.104 178.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -63.01 -32.79 74.23 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.224 0.609 . . . . 0.0 112.385 176.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 65.2 t60 -79.61 -49.31 12.36 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.642 0.777 . . . . 0.0 110.768 176.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 31.3 ttp -56.55 -34.04 66.7 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.717 1.607 . . . . 0.0 113.904 -176.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 10.2 t -73.21 -13.06 61.08 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 120.181 1.355 . . . . 0.0 113.085 176.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 58.9 m80 -107.1 -24.79 11.83 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.478 1.511 . . . . 0.0 112.595 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.4 t -61.59 150.06 37.33 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.538 1.535 . . . . 0.0 112.343 178.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -128.89 -8.86 4.93 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.87 1.668 . . . . 0.0 113.641 -179.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.76 -28.22 21.85 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.242 0.928 . . . . 0.0 111.86 178.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.65 -109.66 1.0 Allowed Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.952 1.263 . . . . 0.0 112.761 178.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -60.23 -22.98 63.68 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.155 0.982 . . . . 0.0 113.247 177.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.87 -1.46 49.36 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.296 1.438 . . . . 0.0 113.846 178.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.9 t -61.0 141.97 56.95 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 122.289 1.042 . . . . 0.0 110.62 178.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.8 mm-40 -78.62 -10.54 59.78 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.721 1.208 . . . . 0.0 113.115 -176.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 64.6 t -90.65 114.85 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 124.874 1.27 . . . . 0.0 107.582 174.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.32 -37.0 66.84 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -64.93 -41.63 95.38 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.445 1.098 . . . . 0.0 112.204 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.5 t -67.04 -56.38 10.31 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.594 1.558 . . . . 0.0 109.994 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.57 -26.94 62.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.28 1.032 . . . . 0.0 113.255 178.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 70.8 m -82.33 -47.27 12.55 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.049 0.94 . . . . 0.0 112.124 175.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 60.2 m -62.17 -34.8 77.11 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 121.56 -0.713 . . . . 0.0 111.873 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -59.07 -31.53 68.97 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.338 1.055 . . . . 0.0 112.503 176.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -67.71 -34.14 76.29 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.873 0.869 . . . . 0.0 111.299 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.4 mt -72.23 -46.04 59.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 124.343 1.057 . . . . 0.0 110.035 177.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 19.2 mm -62.57 -39.69 85.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.142 0.977 . . . . 0.0 111.301 176.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 16.5 t -60.39 -26.16 66.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.085 0.954 . . . . 0.0 112.712 177.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.6 t60 -61.54 -57.28 12.73 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.092 0.86 . . . . 0.0 111.159 177.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 59.5 m95 -62.45 -22.56 66.31 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 178.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -79.66 -29.92 41.03 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.509 1.123 . . . . 0.0 112.614 178.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -99.96 -36.32 9.42 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 179.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.4 t -74.04 139.33 44.64 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.354 1.461 . . . . 0.0 111.289 -178.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 74.2 p -130.12 -2.84 4.52 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 -177.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -96.09 141.51 29.38 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.227 1.411 . . . . 0.0 112.647 -177.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -74.34 -34.4 63.41 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 121.728 -0.607 . . . . 0.0 111.819 176.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 36.7 t0 -90.89 79.34 5.93 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.718 1.607 . . . . 0.0 111.038 178.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.4 t -135.13 137.43 26.85 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 127.106 2.162 . . . . 0.0 109.124 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -56.72 -26.54 66.27 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.858 2.372 . . . . 0.0 114.604 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.8 t -92.24 -51.65 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-N 119.783 1.174 . . . . 0.0 111.604 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 6.1 m -69.63 -39.72 76.97 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 -174.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 1.6 tt -56.24 -55.91 37.0 Favored Pre-proline 0 CA--C 1.546 0.823 0 CA-C-O 117.578 -1.201 . . . . 0.0 112.903 -177.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.18 -32.49 94.56 Favored 'Trans proline' 0 C--N 1.354 0.848 0 CA-C-N 121.845 1.695 . . . . 0.0 113.169 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 98.4 mt -69.31 -46.19 67.72 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.001 0.819 . . . . 0.0 111.47 177.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 48.7 mttm -62.63 -41.89 99.28 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.026 0.93 . . . . 0.0 110.472 176.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.0 t30 -63.71 -39.19 93.7 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.274 1.429 . . . . 0.0 112.252 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.74 0 C-N-CA 124.325 1.05 . . . . 0.0 113.662 178.576 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.477 0.883 0 CA-C-O 119.698 -0.191 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -60.17 -25.76 65.79 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 175.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 45.3 m -75.05 -31.89 61.4 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.378 -0.826 . . . . 0.0 112.642 177.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -90.06 -25.45 20.78 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.62 1.168 . . . . 0.0 112.902 175.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.9 tt -45.51 -60.01 2.41 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 127.451 2.3 . . . . 0.0 113.87 -178.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.2 p-90 -70.08 -8.36 48.76 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -173.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 10.2 ptmm? -112.15 -56.0 2.45 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 4.2 mp -120.12 16.88 12.44 Favored 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 117.055 2.243 . . . . 0.0 117.055 -176.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.9 tt . . . . . 0 N--CA 1.48 1.044 0 O-C-N 120.473 -1.392 . . . . 0.0 113.802 179.27 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 28.3 tp . . . . . 0 CA--C 1.552 1.027 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.4 tpt -62.75 145.52 54.64 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -175.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.89 149.29 47.71 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 128.251 2.621 . . . . 0.0 109.682 177.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 24.2 m -71.51 134.41 84.4 Favored Pre-proline 0 N--CA 1.474 0.737 0 CA-C-O 118.327 -0.844 . . . . 0.0 110.966 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -55.39 -28.8 65.19 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.002 2.468 . . . . 0.0 116.085 -176.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -70.72 -15.25 62.68 Favored 'General case' 0 CA--C 1.55 0.954 0 O-C-N 120.912 -1.118 . . . . 0.0 113.196 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.1 t70 -89.76 -9.83 47.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.243 1.817 . . . . 0.0 113.13 178.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 72.7 mt -52.56 -34.35 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 125.045 1.338 . . . . 0.0 111.33 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -67.44 -9.73 44.64 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.562 1.145 . . . . 0.0 113.697 177.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -75.65 -20.2 58.64 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 120.928 -1.108 . . . . 0.0 111.109 175.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.54 0.591 0 CA-C-N 119.022 0.828 . . . . 0.0 109.876 178.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 30.1 mtpp . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 77.9 mtm-85 -60.68 -39.27 87.82 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.868 0.867 . . . . 0.0 112.619 179.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -63.58 -27.87 69.54 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 86.3 mt -70.26 -37.71 74.96 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.176 0.59 . . . . 0.0 110.593 175.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.5 mt -62.1 -51.81 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 175.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -54.57 -54.01 46.98 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.966 0.906 . . . . 0.0 111.016 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -36.17 83.12 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.164 0.893 . . . . 0.0 113.352 -178.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -71.74 -44.15 64.59 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.888 0.767 . . . . 0.0 110.96 179.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 12.3 tp -63.76 -38.35 90.79 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.569 0.747 . . . . 0.0 110.784 177.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 87.8 t -61.87 -32.27 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 CA-C-N 119.735 1.152 . . . . 0.0 110.619 174.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 15.6 tp -69.53 -34.98 75.02 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 120.762 -1.211 . . . . 0.0 111.608 174.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.4 mp -59.14 -26.14 64.48 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 120.11 1.323 . . . . 0.0 110.271 174.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 4.0 mt -77.5 -53.25 7.84 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.289 -0.882 . . . . 0.0 109.933 176.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.6 t60 -54.93 -52.93 61.42 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.13 0.572 . . . . 0.0 110.226 177.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -58.19 -22.78 53.04 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.79 1.236 . . . . 0.0 113.968 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -90.07 -29.42 18.37 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.157 -0.964 . . . . 0.0 113.417 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 31.9 mttp -86.07 -34.67 20.62 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.682 1.193 . . . . 0.0 112.623 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 20.2 t -63.92 -44.83 91.72 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.277 1.831 . . . . 0.0 110.946 177.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.0 pt20 . . . . . 0 CA--C 1.546 0.825 0 O-C-N 120.797 -1.19 . . . . 0.0 111.819 174.178 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 7.6 m170 . . . . . 0 N--CA 1.47 0.573 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 33.6 t -62.44 -49.07 76.91 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.024 1.329 . . . . 0.0 109.716 177.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -55.41 -36.99 67.06 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.933 1.293 . . . . 0.0 111.813 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.6 m -70.67 -56.52 6.26 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.887 0.875 . . . . 0.0 111.772 176.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 14.6 mmt -65.07 -32.71 74.56 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -65.51 -32.21 73.69 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 120.753 1.615 . . . . 0.0 112.303 178.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -72.47 -38.55 68.18 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.534 0.734 . . . . 0.0 110.449 174.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 77.0 t -62.22 -47.24 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.277 0.631 . . . . 0.0 110.327 175.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.57 -45.11 95.15 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.878 0.871 . . . . 0.0 111.708 178.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -67.83 -21.22 65.21 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.2 t60 -83.86 -49.39 9.07 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 118.803 0.729 . . . . 0.0 109.339 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.0 ttp -57.55 -27.92 63.07 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.189 1.796 . . . . 0.0 113.778 -177.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 17.2 p -70.75 -30.35 66.83 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 119.507 1.049 . . . . 0.0 112.244 174.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 84.1 t60 -92.39 -27.08 17.73 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.831 1.652 . . . . 0.0 112.835 178.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 14.2 t -63.13 153.02 35.63 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.853 1.661 . . . . 0.0 112.776 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -133.15 -7.24 3.02 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.555 1.542 . . . . 0.0 114.23 -179.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -90.55 -22.85 21.09 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.385 0.993 . . . . 0.0 113.012 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.3 -116.61 5.91 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.448 1.023 . . . . 0.0 112.354 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 58.1 tptt -56.4 -24.3 43.91 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.774 1.23 . . . . 0.0 113.211 176.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.48 -1.86 57.41 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.576 1.151 . . . . 0.0 114.043 178.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 20.0 t -62.66 141.88 58.33 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.112 0.958 . . . . 0.0 110.586 178.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.7 mm-40 -78.09 -9.4 59.13 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.592 1.157 . . . . 0.0 113.163 -176.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 99.3 t -91.87 114.56 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 173.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.85 -42.99 72.68 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -64.42 -37.88 89.09 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.866 0.866 . . . . 0.0 112.945 -178.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 29.7 t -65.86 -59.59 3.71 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.508 1.523 . . . . 0.0 110.378 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.13 -30.86 64.77 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.874 0.87 . . . . 0.0 112.58 178.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.3 m -75.52 -50.63 15.08 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.757 0.823 . . . . 0.0 112.486 176.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 63.6 m -60.04 -36.39 77.18 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.663 -0.648 . . . . 0.0 111.801 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 48.2 tpt85 -59.81 -29.54 68.31 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.849 0.86 . . . . 0.0 113.047 177.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -70.29 -30.06 66.97 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.72 0.808 . . . . 0.0 111.245 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 6.6 mt -73.45 -44.63 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.168 0.987 . . . . 0.0 109.221 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 24.0 mm -58.71 -39.18 75.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 123.86 0.864 . . . . 0.0 109.887 174.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 4.1 t -60.72 -28.56 68.76 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.037 0.935 . . . . 0.0 113.054 176.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.1 t60 -61.76 -55.25 32.15 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.404 1.002 . . . . 0.0 110.44 177.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 44.2 m95 -61.69 -30.65 70.88 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 178.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -70.29 -27.95 64.81 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.703 0.801 . . . . 0.0 112.703 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -100.05 -38.98 8.34 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 179.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.8 t -75.62 137.66 40.9 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.796 1.638 . . . . 0.0 112.862 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 68.2 p -129.97 4.11 4.89 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.692 1.597 . . . . 0.0 114.045 -178.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 69.8 mtm180 -82.1 158.5 23.69 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.126 1.37 . . . . 0.0 113.551 -178.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 23.9 t60 -95.88 -40.22 9.42 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.34 1.056 . . . . 0.0 109.84 170.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.6 t0 -92.79 69.99 4.73 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.7 1.6 . . . . 0.0 111.655 178.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 52.7 t -123.27 133.65 24.67 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 126.653 1.981 . . . . 0.0 108.412 177.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -59.01 -25.61 78.44 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.709 2.273 . . . . 0.0 114.425 -176.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 6.3 t -92.13 -50.29 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 119.519 1.054 . . . . 0.0 111.649 176.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.4 m -68.86 -41.32 78.58 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -175.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.9 tt -50.75 -57.18 14.31 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.472 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -61.3 -31.77 89.42 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.021 1.814 . . . . 0.0 113.591 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 89.7 mt -70.87 -46.44 62.63 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.76 0.824 . . . . 0.0 111.676 178.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -62.26 -36.74 82.97 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.155 0.982 . . . . 0.0 110.397 176.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 13.9 t30 -69.92 -38.32 76.19 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.29 1.436 . . . . 0.0 112.448 175.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 113.777 1.028 . . . . 0.0 113.777 179.562 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 61.4 m . . . . . 0 N--CA 1.474 0.77 0 CA-C-O 119.419 -0.324 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -60.03 -21.94 62.0 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.504 0.928 . . . . 0.0 113.504 178.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 21.3 t -79.0 -33.65 44.77 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.32 1.048 . . . . 0.0 112.646 178.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 36.4 t70 -89.77 -26.5 20.57 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.838 0.855 . . . . 0.0 112.104 175.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.7 tt -45.82 -60.06 2.45 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 127.176 2.191 . . . . 0.0 113.367 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.2 p-90 -68.91 -8.96 49.07 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -172.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -111.89 -58.51 2.12 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 -178.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 58.0 mt -120.05 16.29 12.46 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -171.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.6 tt . . . . . 0 CA--C 1.551 0.989 0 C-N-CA 124.915 1.286 . . . . 0.0 113.046 179.977 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 83.8 mt . . . . . 0 CA--C 1.551 1.019 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.24 151.61 46.64 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -175.154 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 95.9 mt -125.19 170.28 11.4 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.778 2.831 . . . . 0.0 113.504 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.7 m -90.8 150.43 42.14 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 169.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -53.72 -25.1 32.75 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.069 2.512 . . . . 0.0 115.651 -178.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.8 t70 -69.87 -24.08 63.37 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.891 0.876 . . . . 0.0 112.889 178.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -76.17 -18.04 59.28 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.86 0.864 . . . . 0.0 112.361 178.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 93.3 mt -59.5 -34.02 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.59 0.756 . . . . 0.0 109.322 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -71.18 -9.87 58.8 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -84.15 -29.77 26.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.93 0.892 . . . . 0.0 111.521 176.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.3 p-90 . . . . . 0 CA--C 1.542 0.656 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 176.619 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 80.6 tttt . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 119.64 -0.219 . . . . 0.0 111.581 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 70.2 mtp180 -62.38 -41.49 98.68 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.779 0.832 . . . . 0.0 111.122 174.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -59.59 -33.04 70.96 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.065 0.946 . . . . 0.0 112.103 179.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 83.6 mt -65.67 -40.56 92.52 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.963 0.801 . . . . 0.0 112.018 178.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.1 mt -68.35 -51.19 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-N 118.342 0.519 . . . . 0.0 109.677 176.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -55.13 -54.41 43.58 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.576 1.15 . . . . 0.0 110.889 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -34.99 79.49 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.148 -0.97 . . . . 0.0 113.168 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -68.67 -48.99 62.54 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.092 0.86 . . . . 0.0 109.655 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 16.8 tp -59.82 -43.93 94.28 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.425 0.69 . . . . 0.0 111.413 177.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 61.0 t -61.43 -24.98 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 O-C-N 120.64 -1.288 . . . . 0.0 111.331 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 3.7 tp -79.81 -26.09 40.64 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.289 1.404 . . . . 0.0 112.408 172.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.5 mp -60.84 -45.27 95.15 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 120.596 1.544 . . . . 0.0 107.367 170.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.2 mp -61.41 -50.59 72.22 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.307 1.043 . . . . 0.0 111.102 175.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 31.0 t60 -55.61 -57.3 12.54 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.424 1.011 . . . . 0.0 110.285 177.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.59 -30.93 63.76 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.549 1.14 . . . . 0.0 114.032 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 43.1 t60 -75.48 -38.63 59.44 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.522 -0.736 . . . . 0.0 112.04 176.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 42.7 mttm -79.81 -33.62 40.26 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.521 1.128 . . . . 0.0 111.853 -179.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 13.6 t -63.26 -44.77 94.21 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 127.406 2.283 . . . . 0.0 111.677 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.6 pt20 . . . . . 0 N--CA 1.475 0.807 0 O-C-N 120.726 -1.234 . . . . 0.0 111.727 174.64 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 35.3 m80 . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 53.2 t -68.17 -51.03 50.35 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.813 1.245 . . . . 0.0 108.858 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 43.2 ttp-105 -54.42 -39.65 67.53 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.11 1.364 . . . . 0.0 111.283 173.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.2 m -65.43 -56.57 11.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.523 1.129 . . . . 0.0 111.394 176.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 19.9 mmt -66.45 -34.54 78.17 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -177.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -65.44 -32.25 73.77 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 120.88 1.673 . . . . 0.0 112.286 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -70.62 -39.71 73.56 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.034 0.534 . . . . 0.0 110.491 174.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 71.5 t -63.77 -46.9 93.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.261 0.625 . . . . 0.0 111.025 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.5 -43.38 93.37 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.647 0.779 . . . . 0.0 111.259 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -68.32 -18.09 64.42 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 176.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 66.6 t60 -88.03 -49.82 6.8 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.535 0.734 . . . . 0.0 109.432 173.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 27.2 ttp -57.15 -27.86 62.25 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.151 1.781 . . . . 0.0 113.616 -178.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 11.4 p -69.37 -26.52 64.7 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 121.114 -0.991 . . . . 0.0 112.641 175.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 68.8 m80 -104.32 -18.65 14.36 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.111 1.765 . . . . 0.0 113.947 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.0 t -62.84 150.77 40.84 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.282 1.433 . . . . 0.0 112.517 -179.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -121.52 -14.79 8.16 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.846 1.658 . . . . 0.0 113.743 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -97.29 -29.33 13.61 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.339 1.056 . . . . 0.0 112.598 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.92 -110.24 1.22 Allowed Glycine 0 CA--C 1.535 1.308 0 C-N-CA 124.484 1.04 . . . . 0.0 113.41 177.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -60.76 -20.27 60.98 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.095 -1.238 . . . . 0.0 113.3 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.49 -0.49 43.28 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.858 1.663 . . . . 0.0 113.588 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.7 t -63.7 142.46 58.39 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 122.106 0.955 . . . . 0.0 110.284 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -81.87 -3.2 53.52 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 86.2 t -89.75 115.81 30.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 173.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.42 -37.29 67.46 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -71.11 -27.36 63.53 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.125 0.97 . . . . 0.0 113.231 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 43.0 t -78.18 -56.86 4.13 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.6 1.56 . . . . 0.0 110.044 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.52 -27.69 66.41 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 179.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 16.2 p -77.18 -50.37 13.1 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.394 -0.816 . . . . 0.0 111.587 175.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 57.9 m -61.65 -36.37 80.59 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.524 -0.735 . . . . 0.0 112.55 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -61.1 -31.72 71.4 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 121.664 -0.647 . . . . 0.0 112.655 177.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -66.22 -29.94 70.29 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.018 0.826 . . . . 0.0 111.465 175.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.8 mt -76.29 -46.85 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 124.455 1.102 . . . . 0.0 109.807 176.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 33.3 mm -58.48 -36.91 61.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.157 0.983 . . . . 0.0 110.522 175.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 68.9 m -63.95 -21.38 66.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.358 1.063 . . . . 0.0 113.395 177.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.9 t60 -66.15 -57.45 7.62 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.88 1.218 . . . . 0.0 110.843 178.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 43.9 m95 -61.67 -21.25 64.27 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 177.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 92.8 mttt -79.38 -28.38 41.9 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.5 1.12 . . . . 0.0 112.713 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -100.13 -42.89 6.52 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.883 1.273 . . . . 0.0 113.697 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 12.7 t -81.39 133.2 35.38 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.463 1.905 . . . . 0.0 111.652 -178.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.9 p -130.04 -5.18 4.46 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -179.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 74.7 mtp85 -67.15 156.14 36.97 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.1 1.76 . . . . 0.0 114.18 -178.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -85.19 -34.05 22.15 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.846 0.858 . . . . 0.0 111.394 173.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 18.4 t0 -104.45 86.36 2.5 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.727 2.011 . . . . 0.0 111.278 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.0 t -136.5 137.0 22.89 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 126.572 1.949 . . . . 0.0 109.604 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -56.21 -29.11 74.33 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.386 2.724 . . . . 0.0 114.632 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 20.1 t -92.24 -54.86 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 CA-C-N 119.276 0.944 . . . . 0.0 111.934 175.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 9.7 m -66.39 -37.64 85.71 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -173.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.29 -57.98 17.48 Favored Pre-proline 0 CA--C 1.548 0.901 0 CA-C-N 120.046 1.294 . . . . 0.0 112.743 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.0 -29.03 87.18 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 121.806 1.671 . . . . 0.0 113.497 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 92.0 mt -70.44 -44.04 68.65 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.555 1.07 . . . . 0.0 111.482 177.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -62.32 -36.51 82.39 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 118.38 0.536 . . . . 0.0 110.766 175.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.0 t30 -69.21 -36.18 76.99 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 124.706 1.202 . . . . 0.0 112.349 176.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.706 0 C-N-CA 125.071 1.349 . . . . 0.0 114.203 178.767 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 22.8 m . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 119.399 -0.334 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.24 -30.66 69.56 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.754 0.706 . . . . 0.0 112.299 175.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 43.6 m -71.4 -31.37 67.19 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 31.7 t70 -90.11 -28.06 19.22 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.983 1.313 . . . . 0.0 113.391 176.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.5 tt -42.99 -59.99 1.8 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 127.335 2.254 . . . . 0.0 113.347 -177.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.3 p-90 -69.22 -9.43 52.99 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 -174.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -111.98 -59.88 1.93 Allowed 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -178.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 45.8 mt -120.25 20.25 12.02 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -171.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.7 tt . . . . . 0 CA--C 1.555 1.157 0 C-N-CA 125.764 1.626 . . . . 0.0 114.425 -177.211 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 25.3 tp . . . . . 0 CA--C 1.553 1.082 0 CA-C-O 120.765 0.317 . . . . 0.0 111.558 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.9 tpt -65.1 141.72 58.62 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 -175.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.5 tt -125.05 148.52 48.47 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.438 2.295 . . . . 0.0 111.75 -176.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 43.3 t -72.63 138.88 80.45 Favored Pre-proline 0 N--CA 1.474 0.755 0 C-N-CA 124.101 0.961 . . . . 0.0 111.383 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -57.15 -26.5 69.69 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 122.659 2.239 . . . . 0.0 114.71 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.6 t70 -69.3 -21.35 63.87 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 121.452 -0.78 . . . . 0.0 112.658 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 19.1 t70 -89.97 -9.89 47.07 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.809 1.644 . . . . 0.0 113.699 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 63.0 mt -51.63 -38.42 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 125.031 1.332 . . . . 0.0 111.244 177.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -67.16 -9.74 43.08 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.233 1.413 . . . . 0.0 113.611 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -78.32 -29.63 47.78 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.032 -1.042 . . . . 0.0 111.661 175.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.2 p-90 . . . . . 0 N--CA 1.473 0.714 0 CA-C-O 118.247 -0.882 . . . . 0.0 112.186 176.836 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 48.5 tptt . . . . . 0 N--CA 1.469 0.487 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.96 -41.29 11.83 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.666 1.587 . . . . 0.0 110.668 175.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.6 mtpt -59.4 -34.16 72.11 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.243 1.017 . . . . 0.0 112.257 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 54.7 mt -62.46 -37.82 87.41 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.332 0.969 . . . . 0.0 111.932 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.9 mt -67.82 -51.82 46.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.709 0.804 . . . . 0.0 109.552 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -54.75 -55.07 33.86 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.656 1.182 . . . . 0.0 111.032 178.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -34.84 78.85 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -177.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -69.35 -45.41 69.46 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.074 0.852 . . . . 0.0 110.518 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 7.2 tp -62.71 -39.36 93.81 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.365 0.666 . . . . 0.0 111.146 178.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 71.7 t -60.51 -31.99 50.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 119.656 1.116 . . . . 0.0 110.987 175.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 7.9 tp -72.62 -28.55 62.82 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 120.714 -1.241 . . . . 0.0 112.299 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.35 -28.54 70.07 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 120.403 1.456 . . . . 0.0 110.178 174.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 1.9 mt -74.15 -51.34 15.87 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.96 0.904 . . . . 0.0 108.772 175.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 20.4 t60 -55.3 -54.77 39.41 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.512 0.725 . . . . 0.0 111.167 177.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.43 -23.16 36.63 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -178.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -90.06 -38.02 13.87 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.274 -0.891 . . . . 0.0 112.318 174.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 52.1 mttm -78.34 -25.04 46.28 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.607 1.563 . . . . 0.0 113.467 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 50.8 t -77.9 -53.48 7.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.418 2.287 . . . . 0.0 111.9 178.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.9 pt20 . . . . . 0 N--CA 1.478 0.967 0 O-C-N 121.185 -0.947 . . . . 0.0 112.518 177.584 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 70.5 m80 . . . . . 0 CA--C 1.54 0.589 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 51.2 t -69.44 -52.61 25.18 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.023 1.329 . . . . 0.0 108.518 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -54.78 -34.81 63.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.378 1.471 . . . . 0.0 111.602 174.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 21.4 m -71.08 -59.02 3.01 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.779 1.231 . . . . 0.0 111.591 176.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.0 mmt -62.97 -33.68 75.9 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -64.99 -32.64 74.46 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 120.81 1.641 . . . . 0.0 112.482 177.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -72.79 -38.15 67.35 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.233 0.613 . . . . 0.0 110.452 174.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 96.0 t -63.47 -46.87 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.491 0.587 . . . . 0.0 110.456 176.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -46.47 85.93 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.04 0.836 . . . . 0.0 111.136 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -66.36 -19.52 65.83 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 177.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 65.3 t60 -86.61 -49.38 7.57 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.089 0.858 . . . . 0.0 109.49 173.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 34.9 ttp -57.01 -28.99 62.97 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.445 1.898 . . . . 0.0 113.59 -177.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 16.3 p -70.29 -27.93 64.79 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.954 0.902 . . . . 0.0 112.738 175.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 73.1 m80 -101.62 -18.24 15.98 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.762 1.625 . . . . 0.0 113.906 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 16.8 t -61.5 155.24 22.48 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.183 1.393 . . . . 0.0 112.562 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -126.7 -12.23 6.04 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.782 1.633 . . . . 0.0 113.702 -178.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -96.52 -27.67 14.75 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.351 1.06 . . . . 0.0 112.051 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.23 -114.41 4.19 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.777 1.18 . . . . 0.0 113.406 177.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -62.13 -16.38 52.2 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 121.325 -1.103 . . . . 0.0 113.444 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.24 -0.51 43.93 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.342 1.457 . . . . 0.0 113.382 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.6 t -60.32 142.61 54.51 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 122.403 1.097 . . . . 0.0 110.634 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.0 mm-40 -77.86 -9.44 59.06 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.696 1.198 . . . . 0.0 113.015 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 99.8 t -88.58 115.22 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.6 -41.76 66.97 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -65.76 -41.49 92.03 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.505 0.722 . . . . 0.0 112.884 -179.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 41.1 t -61.35 -56.4 20.82 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.718 1.207 . . . . 0.0 110.665 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.42 -30.97 69.96 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.293 0.637 . . . . 0.0 112.632 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 74.7 m -71.64 -51.05 25.15 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.981 0.912 . . . . 0.0 111.161 176.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 33.6 m -58.38 -36.61 73.77 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.952 0.901 . . . . 0.0 112.146 176.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.24 -30.46 71.12 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 118.092 -0.956 . . . . 0.0 113.179 175.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -69.11 -27.46 65.6 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.664 1.12 . . . . 0.0 110.828 176.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.3 mm -74.29 -48.41 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.772 0.829 . . . . 0.0 109.58 175.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 20.2 mm -59.14 -40.56 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.403 1.081 . . . . 0.0 110.714 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 49.9 m -62.14 -22.25 65.71 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.961 0.904 . . . . 0.0 113.068 177.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.3 t60 -66.52 -56.95 8.47 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.514 1.052 . . . . 0.0 109.966 176.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 42.9 m95 -61.47 -32.66 72.67 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.273 0.942 . . . . 0.0 112.966 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -65.45 -28.55 69.31 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.352 -0.843 . . . . 0.0 112.948 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -100.02 -50.02 4.13 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.776 1.23 . . . . 0.0 114.271 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 11.1 t -79.87 132.21 36.04 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.629 1.972 . . . . 0.0 112.525 -176.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 4.4 t -130.14 -2.36 4.54 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.2 1.4 . . . . 0.0 113.872 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 83.5 mtt-85 -69.51 145.74 52.43 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.94 1.296 . . . . 0.0 113.478 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 85.0 t60 -79.79 -34.72 39.41 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 169.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -86.5 69.95 10.42 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.764 1.625 . . . . 0.0 112.14 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.7 t -136.28 133.06 19.24 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 126.055 1.742 . . . . 0.0 109.743 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -58.83 -25.07 75.05 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 122.86 2.373 . . . . 0.0 114.149 -178.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 17.6 t -92.17 -51.66 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 119.28 0.945 . . . . 0.0 111.961 176.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.4 m -71.28 -35.66 71.42 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -174.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.37 -56.56 25.21 Favored Pre-proline 0 N--CA 1.474 0.749 0 CA-C-N 119.773 1.169 . . . . 0.0 113.204 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -60.52 -33.49 93.74 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.032 1.821 . . . . 0.0 113.089 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 94.9 mt -68.4 -45.56 72.34 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.973 0.806 . . . . 0.0 111.565 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 55.4 mttm -61.94 -45.01 95.57 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.911 0.884 . . . . 0.0 109.834 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 19.2 t30 -61.38 -40.9 96.04 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.938 1.295 . . . . 0.0 112.411 176.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.731 0 C-N-CA 124.468 1.107 . . . . 0.0 113.935 179.027 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 87.1 m . . . . . 0 N--CA 1.475 0.802 0 CA-C-O 119.412 -0.327 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -60.21 -31.85 70.55 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 49.9 m -68.45 -34.52 76.11 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.76 0.709 . . . . 0.0 112.804 178.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.1 t70 -90.3 -24.32 20.92 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 174.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.6 tt -46.09 -60.08 2.49 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.233 1.813 . . . . 0.0 113.588 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 51.0 p-90 -65.11 -10.24 29.08 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -173.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 58.4 pttt -111.97 -53.46 2.7 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 6.2 mp -120.16 20.03 12.11 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 116.774 2.138 . . . . 0.0 116.774 -175.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.217 0 O-C-N 120.223 -1.548 . . . . 0.0 114.885 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 27.4 tp . . . . . 0 CA--C 1.555 1.159 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 10.8 tpt -70.95 147.87 48.27 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 14.5 mt -118.81 160.9 21.06 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.852 1.661 . . . . 0.0 113.144 -178.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 43.3 t -71.71 145.0 89.13 Favored Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 169.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -58.19 -14.76 20.65 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 123.095 2.53 . . . . 0.0 116.357 -175.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -72.93 -22.99 60.64 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.32 -0.862 . . . . 0.0 112.886 177.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 14.9 t70 -84.8 -10.08 57.55 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.406 1.082 . . . . 0.0 113.006 178.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 91.7 mt -56.59 -34.94 43.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.569 1.148 . . . . 0.0 110.584 176.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -73.45 -9.89 59.16 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.819 1.248 . . . . 0.0 113.641 178.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -84.33 -24.61 29.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.067 0.947 . . . . 0.0 112.773 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.471 0.613 0 CA-C-N 119.476 1.034 . . . . 0.0 111.756 -179.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 20.7 tptm . . . . . 0 N--CA 1.472 0.661 0 N-CA-C 111.501 0.185 . . . . 0.0 111.501 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 78.4 mtm180 -76.76 -43.96 34.92 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.088 1.355 . . . . 0.0 111.311 175.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -56.72 -35.22 68.3 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.252 1.021 . . . . 0.0 112.111 175.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 57.3 mt -59.63 -37.94 80.01 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.202 0.91 . . . . 0.0 112.016 177.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -67.1 -54.59 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 118.703 0.683 . . . . 0.0 109.245 175.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -52.71 -51.75 59.1 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.462 1.105 . . . . 0.0 112.011 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -35.17 78.63 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.338 -0.851 . . . . 0.0 113.178 -179.087 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -71.41 -42.54 68.17 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.569 1.077 . . . . 0.0 109.693 178.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.5 tt -61.81 -44.44 96.86 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.706 1.602 . . . . 0.0 110.723 178.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 89.1 t -61.81 -26.64 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 O-C-N 120.589 -1.32 . . . . 0.0 110.904 174.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.78 -27.53 58.04 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 120.465 -1.397 . . . . 0.0 111.939 173.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.7 mp -61.14 -41.17 96.24 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.478 1.49 . . . . 0.0 107.878 169.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.84 -48.72 73.31 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.503 -0.76 . . . . 0.0 111.074 176.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 15.3 t60 -55.13 -52.47 63.18 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.033 0.833 . . . . 0.0 109.743 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -60.08 -24.34 64.52 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -178.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -88.26 -29.03 20.72 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.16 0.891 . . . . 0.0 112.467 175.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 59.7 mttm -85.37 -39.56 17.47 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.52 1.528 . . . . 0.0 113.084 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.8 t -60.62 -44.6 96.16 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.362 1.865 . . . . 0.0 110.755 176.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.4 pt20 . . . . . 0 CA--C 1.547 0.845 0 O-C-N 121.415 -0.803 . . . . 0.0 112.069 174.805 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 44.8 m80 . . . . . 0 N--CA 1.469 0.486 0 CA-C-O 118.748 -0.644 . . . . 0.0 112.286 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.0 t -65.12 -51.16 62.93 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.847 0.748 . . . . 0.0 109.174 174.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -53.6 -34.3 57.93 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.064 1.346 . . . . 0.0 111.972 174.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 52.7 m -73.6 -61.06 1.97 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.162 0.985 . . . . 0.0 111.679 176.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 21.9 mmm -64.28 -30.21 71.27 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 -175.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -65.31 -34.34 78.1 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 120.727 1.603 . . . . 0.0 112.084 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -70.8 -37.27 73.26 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.41 0.684 . . . . 0.0 110.353 175.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 90.3 t -64.6 -48.63 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.578 0.751 . . . . 0.0 110.379 176.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.13 -43.57 91.99 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.976 0.911 . . . . 0.0 111.703 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -68.66 -17.13 64.03 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 177.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 72.0 t60 -90.13 -50.84 5.77 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.727 1.211 . . . . 0.0 109.997 174.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 38.7 ttp -57.31 -26.46 60.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.581 1.953 . . . . 0.0 113.513 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 2.8 p -60.31 -35.45 75.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.803 1.241 . . . . 0.0 112.886 176.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -111.94 -10.2 13.98 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.86 1.264 . . . . 0.0 114.322 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 43.4 t -63.55 129.85 41.91 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.105 0.866 . . . . 0.0 111.434 178.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -101.05 -16.12 17.21 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.103 1.361 . . . . 0.0 114.072 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.31 -31.13 20.36 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.024 0.829 . . . . 0.0 111.758 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.36 -110.77 1.48 Allowed Glycine 0 CA--C 1.532 1.114 0 C-N-CA 124.494 1.045 . . . . 0.0 112.94 178.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.53 -20.39 60.13 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 121.384 -1.068 . . . . 0.0 113.187 177.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -96.54 -2.36 45.21 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.621 1.568 . . . . 0.0 113.567 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.7 t -62.5 142.38 57.96 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.145 0.974 . . . . 0.0 110.011 177.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -81.62 -5.28 57.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.254 1.022 . . . . 0.0 113.565 -176.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.0 t -89.22 115.44 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.91 -43.56 73.37 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -62.63 -38.19 89.27 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.509 0.724 . . . . 0.0 112.872 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.6 t -67.13 -57.74 6.21 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.488 1.515 . . . . 0.0 110.165 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -55.21 -36.39 65.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.033 0.933 . . . . 0.0 112.439 178.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 13.1 m -69.95 -51.56 31.7 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 124.045 0.938 . . . . 0.0 112.394 175.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 70.2 m -61.09 -37.35 82.43 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.19 -0.944 . . . . 0.0 112.066 -179.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.41 -33.78 68.23 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.141 0.976 . . . . 0.0 112.165 176.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -67.46 -31.02 70.89 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.934 0.893 . . . . 0.0 112.057 177.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.5 mt -77.46 -45.33 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-N 118.514 0.597 . . . . 0.0 110.01 176.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 28.5 mm -58.37 -38.58 70.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.832 0.853 . . . . 0.0 110.011 176.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 67.9 m -62.23 -24.98 67.56 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.17 0.988 . . . . 0.0 113.222 176.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.1 t60 -64.81 -55.88 16.91 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.836 1.198 . . . . 0.0 109.526 176.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 48.4 m95 -59.27 -33.48 71.1 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 178.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -68.41 -30.14 68.99 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 177.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -100.09 -34.86 9.89 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.5 t -75.86 131.58 39.79 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.41 1.484 . . . . 0.0 112.95 -175.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 67.7 p -130.07 0.6 4.72 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 126.022 1.729 . . . . 0.0 113.421 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 47.6 ttt85 -74.73 135.67 41.79 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.79 1.636 . . . . 0.0 111.22 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 43.2 p-80 -75.33 -36.6 61.01 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 121.897 -0.502 . . . . 0.0 112.166 178.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -101.74 69.98 1.23 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.546 1.538 . . . . 0.0 112.462 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 44.7 t -114.62 132.79 22.71 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 126.546 1.938 . . . . 0.0 108.427 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -59.12 -26.17 80.69 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.899 2.4 . . . . 0.0 115.03 -176.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 41.8 t -92.22 -49.59 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-N 119.232 0.923 . . . . 0.0 111.601 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 13.0 m -68.88 -43.99 74.16 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.297 1.221 . . . . 0.0 114.297 -176.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.1 tt -53.21 -56.57 22.77 Favored Pre-proline 0 CA--C 1.548 0.877 0 CA-C-O 117.891 -1.052 . . . . 0.0 113.105 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -60.95 -32.68 92.72 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 121.873 1.716 . . . . 0.0 113.188 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 92.6 mt -70.16 -44.06 69.57 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.215 0.916 . . . . 0.0 111.637 177.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -60.44 -37.71 81.81 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.496 1.119 . . . . 0.0 110.731 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 17.3 t30 -73.43 -41.32 63.41 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.653 1.581 . . . . 0.0 113.087 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.664 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -177.912 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 9.6 t . . . . . 0 CA--C 1.536 0.432 0 CA-C-O 118.582 -0.723 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -50.73 -31.95 18.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.089 1.356 . . . . 0.0 112.998 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 26.9 m -72.58 -30.84 64.74 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.932 0.893 . . . . 0.0 113.153 178.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 30.8 t70 -90.28 -30.15 17.69 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.53 1.532 . . . . 0.0 113.277 174.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 1.8 tt -45.68 -60.03 2.43 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 128.276 2.63 . . . . 0.0 112.969 -175.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.4 p-90 -63.33 -13.85 43.4 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -174.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -112.07 -52.33 2.79 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 117.557 2.428 . . . . 0.0 117.557 -177.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 69.8 mt -120.03 20.46 12.11 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 116.319 1.97 . . . . 0.0 116.319 -169.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 12.9 tp . . . . . 0 CA--C 1.549 0.931 0 N-CA-C 115.911 1.819 . . . . 0.0 115.911 -172.923 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 21.7 tp . . . . . 0 CA--C 1.554 1.122 0 CA-C-O 121.059 0.457 . . . . 0.0 111.641 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.8 tpt -70.25 143.97 51.97 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 116.369 1.988 . . . . 0.0 116.369 -174.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 71.2 mt -125.02 153.15 43.27 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 127.015 2.126 . . . . 0.0 113.63 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 37.0 p -81.61 161.91 59.91 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 123.454 0.702 . . . . 0.0 110.075 171.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -59.67 -21.35 62.5 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.468 2.112 . . . . 0.0 114.869 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -76.66 -22.04 54.58 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.727 0.811 . . . . 0.0 113.099 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -80.18 -19.4 47.19 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.751 0.82 . . . . 0.0 112.664 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 64.7 mt -55.03 -38.07 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.869 1.668 . . . . 0.0 111.57 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.82 -9.87 48.11 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -82.88 -26.75 31.26 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.943 0.897 . . . . 0.0 112.36 177.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.273 4.2 p-90 . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 58.5 mtpt . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 112.43 0.529 . . . . 0.0 112.43 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -76.28 -43.27 42.44 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.794 0.838 . . . . 0.0 111.285 175.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -61.86 -36.07 80.15 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.898 0.879 . . . . 0.0 111.892 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 64.3 mt -68.87 -38.45 79.73 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.659 1.184 . . . . 0.0 111.259 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 48.4 mt -61.76 -50.65 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 118.858 0.754 . . . . 0.0 109.257 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -56.01 -54.73 41.37 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.593 0.757 . . . . 0.0 111.039 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -35.21 80.3 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -177.06 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -68.36 -47.66 66.83 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.259 0.936 . . . . 0.0 109.892 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 10.7 tp -60.37 -39.29 86.7 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.479 0.711 . . . . 0.0 111.296 177.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 90.5 t -62.21 -31.12 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.791 1.178 . . . . 0.0 110.966 175.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.6 tp -73.61 -29.53 62.43 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.658 -1.276 . . . . 0.0 111.984 174.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.71 -29.8 69.57 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 120.219 1.372 . . . . 0.0 109.901 173.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.5 mt -74.19 -51.88 14.16 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.696 0.798 . . . . 0.0 109.302 175.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 24.4 t60 -55.07 -52.99 61.48 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.38 0.672 . . . . 0.0 111.597 178.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -59.12 -23.24 61.96 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -178.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -90.1 -32.88 16.49 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.171 0.896 . . . . 0.0 112.088 173.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 49.5 mttm -74.85 -38.24 62.04 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.842 1.257 . . . . 0.0 112.198 177.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 26.0 t -61.12 -50.0 74.98 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.22 2.208 . . . . 0.0 110.951 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.8 pt20 . . . . . 0 CA--C 1.548 0.879 0 O-C-N 121.33 -0.856 . . . . 0.0 112.216 175.435 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 59.5 m80 . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 45.3 t -67.4 -50.81 57.98 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.41 1.084 . . . . 0.0 108.389 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -55.82 -37.53 68.8 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.418 1.487 . . . . 0.0 111.433 173.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.3 m -67.96 -60.08 2.78 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.289 1.035 . . . . 0.0 111.241 176.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.8 mmt -62.17 -35.13 77.87 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -64.7 -32.52 74.23 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 120.922 1.692 . . . . 0.0 112.567 177.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.5 m-80 -72.87 -38.62 66.94 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.173 0.589 . . . . 0.0 110.592 174.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 58.1 t -63.76 -47.17 92.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-N 118.597 0.635 . . . . 0.0 110.558 176.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -44.94 86.22 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.54 0.736 . . . . 0.0 110.864 178.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -66.77 -17.66 64.98 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 176.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.7 t60 -90.04 -49.08 6.79 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.021 0.928 . . . . 0.0 109.951 173.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.1 ttp -56.47 -28.45 59.74 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.579 1.951 . . . . 0.0 113.258 -178.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 14.7 p -67.91 -29.4 68.47 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.383 1.073 . . . . 0.0 112.814 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -97.85 -28.9 13.64 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.645 1.578 . . . . 0.0 112.532 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.6 t -63.77 133.71 53.98 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.94 1.296 . . . . 0.0 112.966 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -109.25 -11.94 14.83 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.42 1.488 . . . . 0.0 113.833 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.53 -29.95 20.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.883 0.873 . . . . 0.0 111.409 178.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.41 -112.78 2.88 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.507 1.051 . . . . 0.0 112.963 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 59.5 tttm -60.86 -20.48 61.93 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.44 -1.035 . . . . 0.0 112.855 177.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -93.28 -2.64 54.79 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.955 1.302 . . . . 0.0 113.47 176.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 22.7 t -59.87 142.91 52.67 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 122.384 1.088 . . . . 0.0 110.277 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -78.81 -5.74 54.17 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.463 1.105 . . . . 0.0 113.488 -176.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 6.7 t -96.98 123.55 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.821 1.248 . . . . 0.0 108.715 175.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.28 -45.12 72.42 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -176.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -30.6 71.06 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 -178.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 54.0 t -72.27 -56.37 5.63 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.164 0.986 . . . . 0.0 109.738 178.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.73 -26.44 63.95 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 177.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 46.1 m -80.56 -45.31 17.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.819 0.847 . . . . 0.0 111.586 176.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 63.7 m -64.99 -34.55 78.71 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.316 1.046 . . . . 0.0 112.741 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.55 -30.86 70.92 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.332 -0.855 . . . . 0.0 111.879 176.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -68.41 -31.18 70.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.565 0.746 . . . . 0.0 111.764 177.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.3 mm -70.39 -45.6 74.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 30.1 mm -62.49 -39.35 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 124.887 1.275 . . . . 0.0 110.429 177.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 16.5 t -59.66 -29.95 68.41 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.413 1.085 . . . . 0.0 112.717 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.5 t60 -60.06 -51.76 68.24 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.146 0.884 . . . . 0.0 110.486 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 24.8 m95 -64.74 -24.52 67.59 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 14.2 mptt -75.91 -30.4 58.76 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.586 0.754 . . . . 0.0 112.509 176.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -100.04 -34.75 9.95 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -178.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.1 t -79.27 131.29 36.11 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.992 1.317 . . . . 0.0 112.924 -176.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.0 p -130.05 -3.88 4.51 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.815 1.646 . . . . 0.0 114.209 -178.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -82.44 141.76 32.47 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.551 1.54 . . . . 0.0 111.842 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 47.7 p-80 -77.45 -40.56 42.82 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.88 -0.513 . . . . 0.0 111.993 177.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.2 t70 -87.0 69.98 10.27 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.045 1.738 . . . . 0.0 111.518 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 41.9 t -121.34 133.55 24.24 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.305 1.842 . . . . 0.0 109.347 178.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -59.66 -24.0 73.71 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.608 2.205 . . . . 0.0 113.572 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 15.8 t -92.12 -54.97 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 119.268 0.94 . . . . 0.0 111.637 176.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 17.0 m -69.22 -35.29 76.03 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -174.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -57.08 -56.89 28.78 Favored Pre-proline 0 CA--C 1.548 0.889 0 CA-C-N 120.01 1.277 . . . . 0.0 112.629 -178.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -60.21 -32.8 94.89 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 121.84 1.693 . . . . 0.0 113.161 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.2 mt -68.7 -47.85 65.38 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 118.798 0.727 . . . . 0.0 111.929 178.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -59.65 -37.1 77.79 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.034 0.533 . . . . 0.0 111.772 176.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 14.0 t30 -70.46 -40.75 73.5 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.611 1.564 . . . . 0.0 112.33 177.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.707 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -179.708 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 28.9 m . . . . . 0 N--CA 1.479 0.993 0 N-CA-C 111.132 0.049 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -60.13 -24.92 65.07 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.786 0.835 . . . . 0.0 112.737 176.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 11.2 m -70.19 -35.99 74.33 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.119 0.872 . . . . 0.0 113.104 179.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.8 t70 -90.18 -27.91 19.24 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.69 0.796 . . . . 0.0 112.818 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.8 tt -43.09 -58.4 2.47 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 126.919 2.088 . . . . 0.0 113.685 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 52.9 p-90 -70.18 -10.42 58.79 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -173.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 9.3 ptmm? -112.19 -59.91 1.93 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.251 1.945 . . . . 0.0 116.251 -175.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 59.1 mt -119.45 17.31 12.96 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 116.165 1.913 . . . . 0.0 116.165 -171.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.554 1.113 0 C-N-CA 126.154 1.781 . . . . 0.0 113.536 179.037 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 22.7 tp . . . . . 0 CA--C 1.551 1.015 0 N-CA-C 111.701 0.259 . . . . 0.0 111.701 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 7.8 tpt -64.35 146.22 54.78 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 18.2 tp -125.02 151.5 45.5 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.032 2.133 . . . . 0.0 113.047 -174.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 62.0 m -82.87 145.18 49.42 Favored Pre-proline 0 N--CA 1.476 0.84 0 C-N-CA 123.501 0.72 . . . . 0.0 110.493 174.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.47 -30.58 74.39 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.839 2.359 . . . . 0.0 115.734 -177.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.47 -22.31 66.14 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 178.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -87.98 -10.06 51.58 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.568 1.147 . . . . 0.0 113.673 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 96.6 mt -58.43 -34.49 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 CA-C-N 119.29 0.95 . . . . 0.0 109.776 175.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -66.85 -9.9 42.5 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.432 1.893 . . . . 0.0 114.058 177.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -87.51 -26.84 22.98 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.821 0.848 . . . . 0.0 112.361 178.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 . . . . . 0 N--CA 1.472 0.648 0 C-N-CA 123.787 0.835 . . . . 0.0 112.336 176.887 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 92.8 mttt . . . . . 0 N--CA 1.473 0.699 0 CA-C-O 119.044 -0.503 . . . . 0.0 110.54 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -57.96 -46.63 84.83 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.68 0.792 . . . . 0.0 111.534 176.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -60.47 -40.13 90.11 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.548 0.739 . . . . 0.0 111.393 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 71.6 mt -66.15 -40.61 90.69 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 117.916 -1.04 . . . . 0.0 111.961 177.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -62.45 -52.93 53.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 CA-C-N 120.038 1.29 . . . . 0.0 109.267 175.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -54.02 -54.01 45.03 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.014 0.925 . . . . 0.0 111.148 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -65.06 -36.17 83.48 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.379 -0.826 . . . . 0.0 112.58 -179.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -68.04 -45.45 73.9 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.039 0.836 . . . . 0.0 110.599 177.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.6 tt -62.6 -41.29 98.88 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.185 0.994 . . . . 0.0 110.516 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 99.5 t -60.17 -32.16 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 CA-C-N 119.269 0.94 . . . . 0.0 111.031 174.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.8 tp -69.98 -31.21 68.79 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.812 -1.18 . . . . 0.0 112.313 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.41 -28.36 69.2 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 120.325 1.42 . . . . 0.0 110.062 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 5.2 mt -72.89 -50.45 23.69 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.365 1.066 . . . . 0.0 109.579 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.0 t60 -57.25 -55.95 28.07 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 122.768 0.427 . . . . 0.0 110.313 176.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.01 -25.24 43.57 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.879 1.272 . . . . 0.0 114.429 -178.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -90.11 -31.35 17.15 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 175.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 41.6 mttm -83.91 -36.16 23.54 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.598 1.159 . . . . 0.0 112.122 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.3 t -61.27 -53.75 52.79 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.092 2.157 . . . . 0.0 110.948 177.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.2 pt20 . . . . . 0 N--CA 1.475 0.797 0 O-C-N 121.042 -1.036 . . . . 0.0 113.121 176.978 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 57.8 m80 . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 33.2 t -66.92 -50.17 63.25 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.313 1.045 . . . . 0.0 108.748 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -54.69 -34.39 62.24 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.341 1.456 . . . . 0.0 111.91 174.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 26.2 m -72.82 -58.44 3.34 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.672 1.189 . . . . 0.0 111.607 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -37.58 82.46 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.549 -0.719 . . . . 0.0 112.603 -178.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -62.7 -34.44 77.14 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.424 1.466 . . . . 0.0 113.071 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -71.04 -39.69 72.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.061 0.544 . . . . 0.0 110.421 175.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 94.5 t -64.38 -46.57 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.361 0.664 . . . . 0.0 110.831 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.92 -42.29 93.62 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.124 0.969 . . . . 0.0 111.84 178.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -66.59 -30.64 70.98 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 55.8 t60 -77.78 -48.67 16.02 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.988 0.813 . . . . 0.0 110.213 175.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 35.7 ttp -56.42 -31.86 64.32 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.303 1.841 . . . . 0.0 114.199 -177.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.7 t -77.48 -10.13 59.3 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 119.805 1.184 . . . . 0.0 112.999 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 50.8 m80 -114.28 -18.99 11.46 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.797 1.639 . . . . 0.0 113.175 177.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 34.8 t -57.57 145.62 33.04 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.493 1.517 . . . . 0.0 112.879 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -109.41 -14.86 14.35 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.821 1.648 . . . . 0.0 113.648 -179.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -104.55 -30.16 10.19 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.465 1.106 . . . . 0.0 112.666 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.99 -110.66 1.59 Allowed Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.61 1.1 . . . . 0.0 113.822 177.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.32 -15.77 60.92 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 120.93 -1.335 . . . . 0.0 113.372 177.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -99.52 -0.21 41.07 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.937 1.695 . . . . 0.0 113.011 174.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 15.4 t -63.71 142.03 58.55 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.326 1.05 . . . . 0.0 110.033 178.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -81.58 -5.25 57.84 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.287 1.035 . . . . 0.0 113.489 -176.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.8 t -87.22 114.49 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 172.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.78 -39.41 65.4 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -176.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -67.78 -41.05 83.83 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.344 0.658 . . . . 0.0 112.585 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.9 t -62.12 -54.82 35.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.981 1.312 . . . . 0.0 110.198 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.6 -22.96 64.31 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.044 0.938 . . . . 0.0 113.078 177.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.4 m -82.01 -52.06 7.42 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.051 0.941 . . . . 0.0 111.939 176.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 41.7 m -61.05 -34.18 74.47 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 119.17 0.895 . . . . 0.0 112.056 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -60.04 -31.31 69.85 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.285 -0.885 . . . . 0.0 112.759 175.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -69.11 -30.7 69.04 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.707 1.14 . . . . 0.0 111.229 176.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 15.0 mt -74.27 -48.42 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.502 1.121 . . . . 0.0 109.929 176.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 25.8 mm -61.86 -37.47 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.939 0.895 . . . . 0.0 111.046 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 73.1 m -61.74 -24.83 67.06 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.395 -0.815 . . . . 0.0 112.869 176.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 10.0 t60 -64.91 -54.85 24.21 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.411 1.005 . . . . 0.0 109.963 176.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 46.3 m95 -62.05 -28.83 69.87 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 177.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -71.03 -29.93 65.99 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.784 0.834 . . . . 0.0 112.709 177.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -100.19 -40.85 7.36 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.2 t -77.76 135.45 38.0 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.472 1.509 . . . . 0.0 112.381 -177.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 3.8 t -130.11 2.76 4.77 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.542 1.537 . . . . 0.0 114.008 -179.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -78.25 153.49 31.82 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.207 1.403 . . . . 0.0 114.207 -177.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 80.6 t60 -86.89 -39.26 15.97 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.086 0.955 . . . . 0.0 109.859 170.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.7 t70 -93.71 78.59 4.25 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.654 1.582 . . . . 0.0 111.682 178.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.2 t -137.79 135.06 18.52 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 126.882 2.073 . . . . 0.0 108.887 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -58.56 -26.95 80.85 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 122.809 2.339 . . . . 0.0 114.799 -177.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 4.9 t -92.11 -50.68 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 119.653 1.115 . . . . 0.0 111.869 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.7 m -69.92 -39.21 76.29 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -175.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.5 tt -53.34 -57.7 15.73 Favored Pre-proline 0 N--CA 1.474 0.746 0 CA-C-O 117.588 -1.196 . . . . 0.0 112.781 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.62 -32.7 93.64 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-N 121.569 1.596 . . . . 0.0 113.424 -179.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.27 -46.8 63.62 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.636 1.107 . . . . 0.0 112.011 178.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -64.49 -30.52 71.55 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.346 1.059 . . . . 0.0 111.416 177.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 37.8 t30 -78.07 -41.58 34.97 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.797 1.639 . . . . 0.0 112.39 176.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.557 0 C-N-CA 124.761 1.224 . . . . 0.0 114.192 -179.253 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 76.8 m . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -60.21 -24.82 65.12 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 9.1 t -75.63 -31.05 59.7 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.897 0.879 . . . . 0.0 112.359 178.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.9 t70 -90.02 -28.07 19.32 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.001 0.92 . . . . 0.0 112.319 175.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.9 tt -46.49 -59.02 3.24 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 126.993 2.117 . . . . 0.0 112.847 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.6 p-90 -69.69 -9.24 53.6 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.021 1.489 . . . . 0.0 115.021 -173.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -112.0 -56.25 2.41 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -177.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 50.1 mt -120.14 15.86 12.36 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -172.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.2 tt . . . . . 0 CA--C 1.549 0.909 0 C-N-CA 126.07 1.748 . . . . 0.0 114.891 -179.18 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 23.9 tp . . . . . 0 CA--C 1.554 1.125 0 CA-C-O 121.051 0.453 . . . . 0.0 111.756 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 8.0 tpt -71.73 151.77 43.32 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 115.923 1.823 . . . . 0.0 115.923 -175.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 91.3 mt -125.03 162.98 23.36 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.061 2.144 . . . . 0.0 113.709 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 31.2 t -83.67 144.83 46.21 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 169.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -56.86 -20.32 35.49 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.248 1.965 . . . . 0.0 114.718 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -69.04 -25.08 64.3 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.863 0.865 . . . . 0.0 112.76 177.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.3 t70 -83.76 -12.76 55.3 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 80.3 mt -56.18 -36.39 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 124.571 1.148 . . . . 0.0 110.465 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -66.01 -10.0 35.68 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.014 1.326 . . . . 0.0 113.863 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 20.8 tp60 -84.64 -29.6 25.59 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.104 -0.998 . . . . 0.0 112.596 177.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 3.2 p-90 . . . . . 0 N--CA 1.473 0.705 0 C-N-CA 123.735 0.814 . . . . 0.0 111.907 176.655 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 45.2 mmtm . . . . . 0 N--CA 1.473 0.711 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -63.3 -42.35 99.04 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.652 0.66 . . . . 0.0 110.474 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -62.07 -33.4 74.33 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.213 1.005 . . . . 0.0 112.497 176.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 71.5 mt -64.27 -41.31 96.99 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 120.1 1.318 . . . . 0.0 111.451 175.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.8 mt -64.7 -51.47 66.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.054 0.541 . . . . 0.0 109.736 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -55.35 -55.16 34.69 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.396 1.078 . . . . 0.0 111.299 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -34.42 77.79 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -177.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -68.91 -44.84 72.34 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.103 0.865 . . . . 0.0 110.52 176.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 7.6 tp -62.65 -39.69 94.69 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.609 0.641 . . . . 0.0 110.896 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 58.0 t -60.29 -32.21 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 CA-C-N 119.449 1.022 . . . . 0.0 110.95 175.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 9.3 tp -71.37 -31.71 67.64 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 120.793 -1.192 . . . . 0.0 112.138 175.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.61 -28.91 69.7 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 120.211 1.369 . . . . 0.0 109.938 174.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.9 mt -72.55 -52.9 13.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.707 0.803 . . . . 0.0 109.584 175.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.0 t60 -55.02 -54.39 43.67 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 122.902 0.481 . . . . 0.0 110.531 177.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -57.22 -25.3 58.86 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -178.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -90.01 -31.42 17.21 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.467 1.031 . . . . 0.0 113.323 175.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 76.9 mttt -80.54 -39.59 27.5 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.4 1.48 . . . . 0.0 112.231 179.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 51.9 t -62.76 -51.25 67.86 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 127.635 2.374 . . . . 0.0 112.048 178.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.0 pt20 . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -179.947 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 45.0 m80 . . . . . 0 N--CA 1.471 0.617 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 36.0 t -66.09 -50.15 65.07 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.74 1.216 . . . . 0.0 108.948 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -54.99 -34.66 63.6 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.264 1.426 . . . . 0.0 111.824 174.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.8 m -71.83 -59.56 2.69 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.526 1.13 . . . . 0.0 111.446 176.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.46 -37.79 79.1 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.771 -0.633 . . . . 0.0 112.522 -178.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -63.83 -34.34 77.71 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 120.505 1.502 . . . . 0.0 113.1 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -71.17 -37.66 72.19 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.011 0.524 . . . . 0.0 110.519 175.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 91.6 t -65.67 -47.04 87.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 122.934 0.493 . . . . 0.0 110.623 176.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.78 -43.38 85.51 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.784 0.833 . . . . 0.0 111.156 178.12 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 33.7 m-80 -68.22 -17.64 64.36 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 176.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 62.7 t60 -90.11 -47.81 7.58 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.815 0.846 . . . . 0.0 109.497 173.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -57.28 -28.44 63.01 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.339 1.856 . . . . 0.0 113.293 -178.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 7.5 p -66.88 -27.05 67.2 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.488 1.115 . . . . 0.0 112.542 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 68.8 m80 -102.51 -22.2 14.07 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.059 1.744 . . . . 0.0 113.443 178.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 19.4 t -64.18 142.86 58.26 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.442 1.497 . . . . 0.0 112.692 -179.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -117.72 -12.77 10.22 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.651 1.58 . . . . 0.0 113.814 -179.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -91.44 -27.59 18.2 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.976 0.91 . . . . 0.0 112.058 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 55.69 -114.16 4.58 Favored Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.219 0.914 . . . . 0.0 112.605 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 82.2 tttt -62.18 -20.49 64.2 Favored 'General case' 0 N--CA 1.479 0.994 0 O-C-N 121.316 -1.109 . . . . 0.0 112.803 177.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.5 -1.96 57.36 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.917 1.287 . . . . 0.0 113.466 176.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 17.5 t -63.64 141.96 58.57 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 122.058 0.932 . . . . 0.0 109.599 177.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -80.54 -3.9 51.91 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -175.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 96.5 t -91.67 115.01 29.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 172.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.89 -39.51 68.81 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -176.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -65.84 -38.89 90.09 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.675 0.79 . . . . 0.0 112.517 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 40.7 t -66.69 -55.06 16.88 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.382 1.473 . . . . 0.0 110.163 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.72 -26.12 63.61 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.005 0.922 . . . . 0.0 113.393 177.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.4 m -81.93 -46.49 13.97 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 124.214 1.006 . . . . 0.0 111.535 175.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 66.8 m -61.98 -36.05 80.31 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.375 1.07 . . . . 0.0 112.284 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -61.16 -31.98 71.71 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.747 0.819 . . . . 0.0 112.16 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -68.91 -29.68 68.0 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.4 0.68 . . . . 0.0 111.714 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.1 mm -71.17 -46.74 64.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 18.9 mm -60.99 -38.45 79.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 124.96 1.304 . . . . 0.0 110.974 177.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 70.5 m -62.15 -21.91 65.44 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.283 1.033 . . . . 0.0 113.271 177.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.2 t60 -65.28 -60.21 3.23 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.474 1.034 . . . . 0.0 110.683 178.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 52.6 m95 -60.15 -24.13 64.46 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 177.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 61.8 mtpt -74.53 -35.95 63.15 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.95 0.9 . . . . 0.0 112.748 178.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.03 -32.72 10.81 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 8.9 t -82.29 132.92 35.22 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.522 1.529 . . . . 0.0 110.979 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.2 p -129.98 0.47 4.76 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.352 1.461 . . . . 0.0 114.427 -177.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -80.09 151.95 29.58 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.831 1.252 . . . . 0.0 113.093 -178.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 40.6 p-80 -86.41 -29.22 23.04 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.694 0.798 . . . . 0.0 111.444 173.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.8 t0 -100.27 70.05 1.5 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.46 1.904 . . . . 0.0 111.511 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 41.7 t -127.88 135.18 27.1 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 126.615 1.966 . . . . 0.0 109.22 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -58.56 -25.08 72.98 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 122.814 2.343 . . . . 0.0 114.204 -178.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.2 t -92.19 -52.49 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 119.682 1.128 . . . . 0.0 111.732 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 10.4 m -68.76 -40.25 79.85 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -175.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -53.42 -57.95 14.83 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-O 117.414 -1.279 . . . . 0.0 112.866 -178.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -59.93 -34.11 95.4 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 121.918 1.745 . . . . 0.0 113.565 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.5 mt -70.24 -47.13 62.74 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.977 0.808 . . . . 0.0 111.924 178.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -64.6 -34.75 79.0 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.982 0.913 . . . . 0.0 110.886 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.8 t30 -70.12 -43.15 71.6 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.254 1.421 . . . . 0.0 111.77 176.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.623 0 C-N-CA 123.939 0.896 . . . . 0.0 112.46 178.343 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 90.5 m . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 119.946 -0.073 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -60.08 -27.49 67.04 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.619 0.767 . . . . 0.0 112.967 176.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 24.2 m -68.01 -34.72 77.05 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.611 0.764 . . . . 0.0 112.663 178.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.31 -28.73 18.56 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 174.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 2.6 tt -43.24 -60.06 1.83 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.4 1.88 . . . . 0.0 113.318 -177.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 50.1 p-90 -63.0 -12.49 26.25 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -173.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 16.1 pttp -111.94 -50.25 2.93 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -177.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 66.2 mt -120.08 20.44 12.09 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 117.203 2.297 . . . . 0.0 117.203 -169.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 12.4 tp . . . . . 0 CA--C 1.551 1.019 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -173.943 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 93.0 mt . . . . . 0 CA--C 1.551 1.009 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.39 149.51 44.25 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.844 -1.16 . . . . 0.0 113.356 -177.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.14 179.66 4.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.31 1.844 . . . . 0.0 114.242 -175.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 6.1 p -79.92 160.13 69.55 Favored Pre-proline 0 CA--C 1.545 0.769 0 O-C-N 121.464 -0.773 . . . . 0.0 109.452 169.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.37 -15.16 47.1 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 121.725 1.617 . . . . 0.0 113.009 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -85.61 -28.86 24.53 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.346 1.058 . . . . 0.0 111.452 176.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -67.71 -21.0 65.33 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.674 0.79 . . . . 0.0 112.243 177.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 97.2 mt -57.43 -35.84 50.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.993 0.917 . . . . 0.0 109.678 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -72.86 -10.0 59.31 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 179.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -78.24 -30.46 48.73 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.052 -1.03 . . . . 0.0 111.336 175.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 7.4 p-90 . . . . . 0 CA--C 1.542 0.667 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 177.704 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 81.0 mttt . . . . . 0 N--CA 1.471 0.616 0 CA-C-O 117.792 -1.099 . . . . 0.0 112.021 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 10.5 ptt-85 -64.52 -35.97 82.69 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.641 1.564 . . . . 0.0 111.655 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -63.07 -38.39 91.01 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.171 0.896 . . . . 0.0 111.267 173.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 97.6 mt -63.69 -38.88 92.79 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.714 0.688 . . . . 0.0 111.198 176.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -68.05 -51.96 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 118.928 0.785 . . . . 0.0 109.851 175.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -52.89 -53.64 46.19 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.226 1.01 . . . . 0.0 111.373 179.108 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -38.06 88.14 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 119.282 0.946 . . . . 0.0 112.503 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -70.13 -45.91 65.85 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.681 0.673 . . . . 0.0 111.119 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.0 tt -63.05 -43.05 99.71 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.587 0.755 . . . . 0.0 109.948 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 61.9 t -63.94 -24.34 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 120.737 -1.227 . . . . 0.0 111.131 174.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.44 -31.25 57.74 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.292 -1.505 . . . . 0.0 111.612 173.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.7 mp -59.86 -41.65 91.93 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 169.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.3 mp -67.26 -47.46 70.65 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 117.704 -1.141 . . . . 0.0 111.997 176.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 30.2 t60 -55.06 -55.01 35.84 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.746 1.157 . . . . 0.0 108.719 176.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.38 -45.92 66.0 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.147 0.979 . . . . 0.0 113.27 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -69.43 -39.26 77.94 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.513 -0.742 . . . . 0.0 112.817 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 49.1 mttp -74.9 -32.8 61.92 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.007 -1.058 . . . . 0.0 111.736 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 8.3 t -68.52 -42.14 78.93 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.253 1.821 . . . . 0.0 109.424 173.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 14.4 tt0 . . . . . 0 CA--C 1.544 0.742 0 C-N-CA 125.232 1.413 . . . . 0.0 110.056 172.237 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 19.7 m170 . . . . . 0 N--CA 1.471 0.59 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 5.1 t -64.94 -51.84 59.6 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.091 1.357 . . . . 0.0 109.228 175.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -52.02 -41.87 62.58 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.179 1.792 . . . . 0.0 111.774 175.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 5.1 m -66.99 -58.63 4.58 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.934 1.294 . . . . 0.0 111.252 176.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.2 mmt -62.67 -33.1 74.38 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -177.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -67.09 -30.39 70.4 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 121.138 1.79 . . . . 0.0 112.51 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -72.07 -36.81 69.65 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 122.875 0.47 . . . . 0.0 110.264 172.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 71.2 t -62.61 -46.94 95.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 123.076 0.55 . . . . 0.0 110.13 175.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.23 -41.29 92.8 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.253 1.021 . . . . 0.0 112.002 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -63.6 -39.55 94.66 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.013 0.525 . . . . 0.0 111.762 175.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.8 -50.75 27.03 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.268 0.627 . . . . 0.0 111.15 176.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 30.1 ttp -57.54 -34.9 69.64 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.318 1.847 . . . . 0.0 114.378 -175.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 13.0 t -74.35 -16.1 60.92 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 120.06 1.3 . . . . 0.0 112.544 175.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -98.84 -30.64 12.29 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.53 1.532 . . . . 0.0 112.039 176.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 36.4 t -61.95 145.15 53.79 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.418 1.887 . . . . 0.0 112.279 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -121.33 -5.39 9.37 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.406 1.482 . . . . 0.0 114.718 -177.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -88.95 -15.5 34.12 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.486 1.039 . . . . 0.0 113.211 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 58.69 -126.9 43.9 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 121.38 -0.825 . . . . 0.0 112.007 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -66.48 -10.06 40.64 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -94.26 0.35 55.59 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.573 1.149 . . . . 0.0 113.445 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.1 t -59.17 140.77 55.57 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.331 1.062 . . . . 0.0 110.383 177.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 55.1 mm-40 -77.94 -9.0 58.87 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.853 1.261 . . . . 0.0 113.319 -176.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 10.9 t -93.94 124.13 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.491 1.116 . . . . 0.0 108.652 175.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.63 -50.36 65.88 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -176.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -62.4 -32.85 73.73 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -178.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 49.7 t -68.61 -59.37 3.17 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.937 0.789 . . . . 0.0 109.992 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.73 68.67 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.647 0.779 . . . . 0.0 112.419 178.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 19.8 m -69.32 -51.9 32.57 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.314 -0.866 . . . . 0.0 112.08 176.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 36.7 m -62.9 -33.64 75.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.853 1.206 . . . . 0.0 112.066 178.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -59.65 -34.15 72.45 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.474 -0.766 . . . . 0.0 111.872 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -65.93 -27.83 68.47 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 118.924 0.784 . . . . 0.0 111.697 175.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 11.6 mt -76.73 -48.02 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.171 0.989 . . . . 0.0 109.886 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 20.4 mm -59.25 -38.02 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 124.191 0.996 . . . . 0.0 110.741 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 22.3 t -58.46 -29.34 66.1 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.799 1.239 . . . . 0.0 112.8 176.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 10.8 t60 -61.53 -55.89 26.07 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.295 -0.878 . . . . 0.0 110.453 176.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 51.7 m95 -61.3 -31.96 71.8 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 178.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -67.23 -34.76 78.15 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 118.606 -0.711 . . . . 0.0 112.824 178.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.6 p30 -100.1 -30.76 11.77 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 11.1 t -78.58 125.7 29.73 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.775 1.23 . . . . 0.0 112.095 -178.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 54.4 p -111.32 1.66 17.23 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.858 1.663 . . . . 0.0 113.941 -178.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 64.7 mtm180 -85.35 162.07 19.22 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.346 1.458 . . . . 0.0 114.084 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 15.3 t-160 -106.67 -37.96 6.27 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.656 1.582 . . . . 0.0 108.425 170.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -85.75 69.88 10.64 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.094 1.758 . . . . 0.0 111.097 175.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 44.3 t -131.62 136.79 29.07 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 126.898 2.079 . . . . 0.0 109.224 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -55.29 -28.38 62.15 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.903 2.402 . . . . 0.0 114.566 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.9 t -92.14 -52.14 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 119.461 1.028 . . . . 0.0 111.941 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 4.9 m -68.39 -34.89 76.83 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 115.203 1.556 . . . . 0.0 115.203 -174.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -54.8 -58.9 12.22 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-O 117.678 -1.153 . . . . 0.0 113.083 -178.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.23 -31.83 93.56 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.983 1.789 . . . . 0.0 113.402 179.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.72 -48.09 60.78 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.706 0.802 . . . . 0.0 111.988 178.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -67.22 -25.19 65.99 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.115 0.966 . . . . 0.0 111.993 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 18.9 t30 -77.46 -40.37 43.43 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.112 1.365 . . . . 0.0 111.699 175.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.671 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -179.198 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A 1018 ' ' THR . . . . . . . . . . . . . 86.2 m . . . . . 0 N--CA 1.474 0.733 0 CA-C-O 119.893 -0.099 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -60.29 -27.31 67.19 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.661 -0.649 . . . . 0.0 112.462 174.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1020 ' ' SER . . . . . . . . . . . . . 53.7 m -71.54 -31.23 66.8 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.43 0.692 . . . . 0.0 112.802 178.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.1 t70 -90.15 -28.62 18.81 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.438 1.095 . . . . 0.0 112.966 175.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.1 tt -44.39 -60.1 2.1 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.926 2.09 . . . . 0.0 113.314 -178.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.8 p-90 -70.94 -4.81 26.57 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -112.02 -59.97 1.92 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.736 1.754 . . . . 0.0 115.736 -177.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 7.0 mp -120.23 14.27 12.12 Favored 'General case' 0 CA--C 1.554 1.135 0 N-CA-C 116.372 1.99 . . . . 0.0 116.372 -174.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 4.4 tt . . . . . 0 CA--C 1.552 1.048 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -178.437 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 29.5 tp . . . . . 0 CA--C 1.556 1.175 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A 1044 ' ' MET . . . . . . . . . . . . . 13.3 tpt -76.81 150.88 36.1 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -175.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.9 mp -125.04 159.91 30.25 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 125.602 1.561 . . . . 0.0 111.992 177.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.3 m -66.63 152.16 95.5 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 170.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -64.02 -11.49 27.57 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 122.25 1.967 . . . . 0.0 115.788 -174.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -80.08 -18.02 51.1 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.406 -0.809 . . . . 0.0 112.236 177.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -84.85 -9.97 57.61 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.481 1.112 . . . . 0.0 112.232 177.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 95.8 mt -58.55 -35.25 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.658 1.183 . . . . 0.0 109.711 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -65.58 -11.24 42.38 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.077 1.351 . . . . 0.0 113.167 177.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -82.94 -25.37 32.44 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.604 1.162 . . . . 0.0 112.286 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.3 p-90 . . . . . 0 CA--C 1.542 0.649 0 C-N-CA 124.517 1.127 . . . . 0.0 113.677 178.321 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 57.8 mtpt . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 119.397 -0.335 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 42.3 mtm105 -63.73 -38.16 90.07 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 118.617 -0.706 . . . . 0.0 111.665 175.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -58.08 -36.72 73.25 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 119.082 0.855 . . . . 0.0 111.492 173.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 55.6 mt -64.17 -45.0 90.34 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.646 0.657 . . . . 0.0 110.937 176.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -58.23 -51.11 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-N 118.142 0.428 . . . . 0.0 110.102 177.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -57.34 -53.08 62.23 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.531 1.133 . . . . 0.0 111.414 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.98 -33.29 75.47 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.458 1.026 . . . . 0.0 112.847 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -67.86 -46.19 72.45 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.315 0.962 . . . . 0.0 109.305 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 12.0 tp -61.78 -39.65 92.41 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.949 1.3 . . . . 0.0 111.861 177.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 96.1 t -60.29 -32.52 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.056 1.298 . . . . 0.0 110.331 174.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.4 tp -73.65 -29.49 62.36 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 120.86 -1.15 . . . . 0.0 112.779 175.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.37 -29.93 69.24 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 120.102 1.319 . . . . 0.0 109.56 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.5 mt -71.67 -53.68 12.8 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.483 -0.761 . . . . 0.0 109.768 175.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 12.4 t60 -54.62 -53.62 52.24 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.381 0.673 . . . . 0.0 110.925 178.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -59.91 -21.94 61.75 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -178.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -87.53 -32.99 19.11 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.119 0.872 . . . . 0.0 111.958 174.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 39.2 mttm -84.16 -41.5 16.97 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.043 1.337 . . . . 0.0 113.346 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 34.5 t -56.73 -45.74 81.76 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.382 1.873 . . . . 0.0 111.212 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 13.5 pt20 . . . . . 0 CA--C 1.547 0.845 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 176.387 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 72.8 m80 . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.4 t -62.27 -49.15 76.82 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.242 1.017 . . . . 0.0 110.379 178.021 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 31.5 tpt180 -55.21 -37.58 67.32 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.916 1.286 . . . . 0.0 111.96 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3386 ' ' THR . . . . . . . . . . . . . 52.0 m -68.84 -55.77 10.1 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.672 0.789 . . . . 0.0 111.389 177.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.9 mmt -64.45 -35.25 80.33 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -64.74 -33.29 75.62 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.711 1.596 . . . . 0.0 112.335 178.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -70.72 -40.89 72.52 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.49 0.716 . . . . 0.0 110.298 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 78.6 t -62.61 -47.54 92.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 123.353 0.661 . . . . 0.0 110.566 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.13 -42.83 95.63 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.182 0.993 . . . . 0.0 112.575 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -65.08 -30.33 71.28 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 177.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 64.8 t60 -78.32 -52.48 8.56 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.577 0.751 . . . . 0.0 110.3 174.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.6 ttp -55.6 -35.84 66.25 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.1 1.76 . . . . 0.0 113.698 -176.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3395 ' ' THR . . . . . . . . . . . . . 6.0 t -71.44 -11.46 60.9 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.101 1.319 . . . . 0.0 113.55 178.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -112.9 -22.74 10.48 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.365 1.466 . . . . 0.0 112.791 176.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 39.0 t -56.91 138.19 54.22 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.475 1.51 . . . . 0.0 112.452 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -103.48 -16.55 15.53 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.672 1.589 . . . . 0.0 113.699 -178.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -95.68 -31.18 13.36 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.34 1.056 . . . . 0.0 112.678 -178.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.76 -108.06 0.65 Allowed Glycine 0 CA--C 1.536 1.35 0 C-N-CA 124.561 1.076 . . . . 0.0 112.917 178.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 67.3 mttm -58.37 -25.08 61.62 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 121.446 -1.032 . . . . 0.0 113.13 177.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -96.09 -0.69 49.96 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.335 1.454 . . . . 0.0 114.005 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.2 t -60.07 144.24 50.08 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 122.341 1.067 . . . . 0.0 111.007 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -80.01 -8.77 59.53 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.611 1.165 . . . . 0.0 113.036 -177.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.9 t -89.56 117.41 32.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 173.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.58 -40.73 72.39 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -177.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -64.06 -38.37 90.82 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.664 0.786 . . . . 0.0 112.915 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 51.9 t -68.03 -57.14 6.64 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.458 1.503 . . . . 0.0 110.285 178.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.35 -28.09 62.85 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.296 1.039 . . . . 0.0 113.084 177.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3410 ' ' SER . . . . . . . . . . . . . 68.7 m -79.32 -49.77 11.91 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.739 0.816 . . . . 0.0 112.268 176.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.6 m -61.61 -33.98 74.86 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.498 -0.751 . . . . 0.0 111.962 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -58.75 -31.87 68.73 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.014 0.926 . . . . 0.0 112.546 176.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -68.74 -35.3 76.94 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.074 0.852 . . . . 0.0 111.592 176.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 7.9 mt -68.84 -45.23 81.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 123.846 0.858 . . . . 0.0 109.668 176.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 18.1 mm -62.44 -40.75 89.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.151 0.98 . . . . 0.0 110.911 175.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3416 ' ' SER . . . . . . . . . . . . . 70.8 m -61.09 -26.66 67.81 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.968 0.907 . . . . 0.0 113.106 178.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.5 t60 -62.14 -56.59 17.26 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.688 1.131 . . . . 0.0 109.889 177.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 41.5 m95 -60.19 -30.63 69.49 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 178.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -72.8 -28.13 62.4 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 178.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -100.14 -34.97 9.82 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 179.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.3 t -74.39 134.16 42.44 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.413 1.485 . . . . 0.0 111.225 -178.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3422 ' ' THR . . . . . . . . . . . . . 61.6 p -123.22 -9.65 8.11 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -176.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -78.91 159.81 27.56 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 0.0 113.499 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 39.2 p-80 -93.14 -25.22 17.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.695 1.198 . . . . 0.0 111.324 172.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 17.5 t0 -106.84 86.13 2.27 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.615 1.966 . . . . 0.0 110.797 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 50.9 t -138.69 135.87 18.25 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 126.842 2.057 . . . . 0.0 108.7 179.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -58.76 -26.55 80.45 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 123.049 2.5 . . . . 0.0 114.627 -177.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 39.4 t -92.07 -48.97 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.636 1.107 . . . . 0.0 111.643 176.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.5 m -69.96 -43.98 70.43 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -175.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.03 -54.31 48.62 Favored Pre-proline 0 CA--C 1.552 1.021 0 O-C-N 120.904 -1.123 . . . . 0.0 112.845 -178.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -65.8 -4.41 9.88 Favored 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 122.91 2.406 . . . . 0.0 114.996 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.6 mt -100.0 -47.61 4.94 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.91 1.284 . . . . 0.0 109.911 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -58.59 -36.86 74.65 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.204 1.402 . . . . 0.0 111.918 176.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 16.6 p30 -83.93 -10.02 58.27 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 179.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.584 0 C-N-CA 124.947 1.299 . . . . 0.0 113.619 -178.664 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.523 0 CA-C-O 121.35 0.416 . . . . 0.0 113.986 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.4 p -75.48 -17.06 60.23 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 22.3 p80 -146.28 168.36 21.27 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.3 1.84 . . . . 0.0 111.668 179.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 26.7 ptt? -104.92 155.95 18.47 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.053 1.341 . . . . 0.0 112.415 178.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -88.99 -4.17 58.51 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.442 1.097 . . . . 0.0 113.431 177.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -43.97 -45.38 18.99 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 115.054 1.501 . . . . 0.0 115.054 -178.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -60.38 -15.03 33.05 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 123.296 2.664 . . . . 0.0 115.076 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -113.32 -25.81 8.66 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.434 1.893 . . . . 0.0 112.966 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 89.5 p -106.77 -14.12 15.08 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 -177.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 9.9 t70 -111.52 121.83 39.05 Favored Pre-proline 0 CA--C 1.554 1.111 0 CA-C-N 120.227 1.376 . . . . 0.0 112.742 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -64.49 -14.4 44.1 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 123.575 2.85 . . . . 0.0 115.489 -177.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 7.4 t -74.62 -19.76 60.17 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.173 0.897 . . . . 0.0 112.624 177.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 7.6 p -123.8 -23.08 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 125.282 1.433 . . . . 0.0 114.028 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -55.32 122.51 44.03 Favored Pre-proline 0 CA--C 1.552 1.057 0 CA-C-N 119.599 1.091 . . . . 0.0 112.126 176.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 7.0 Cg_endo -107.11 67.05 0.01 OUTLIER 'Trans proline' 0 CA--C 1.559 1.75 1 C-N-CA 125.302 4.001 . . . . 0.0 113.744 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -70.0 165.17 32.12 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.129 2.553 . . . . 0.0 113.827 -178.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 6.2 tt -67.58 147.14 53.15 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.863 1.265 . . . . 0.0 111.809 177.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 34.1 t -110.75 160.2 16.94 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.246 1.818 . . . . 0.0 112.045 178.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -60.72 -26.41 67.15 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.029 -1.044 . . . . 0.0 113.372 178.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -83.9 -14.14 51.8 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.489 0.716 . . . . 0.0 112.807 177.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 34.5 m -61.08 -51.9 67.19 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.801 0.728 . . . . 0.0 110.575 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -60.02 -27.37 66.84 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 177.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 67.0 m -74.53 -34.49 63.01 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 178.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.7 t70 -90.25 -27.43 19.49 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.426 1.09 . . . . 0.0 113.229 176.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -42.9 -54.38 4.22 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 127.731 2.412 . . . . 0.0 112.966 -178.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 42.1 p-90 -75.3 -4.84 41.5 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -175.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 87.1 mttt -107.91 -60.32 1.73 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -177.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 26.0 mt -120.14 12.14 11.79 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -169.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.5 tt -51.96 136.07 37.51 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 125.191 1.396 . . . . 0.0 114.028 -176.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -77.47 158.83 32.62 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.915 3.077 . . . . 0.0 112.325 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -76.15 10.06 2.17 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 116.201 1.926 . . . . 0.0 116.201 -178.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 46.9 p-10 -116.19 16.69 15.88 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.869 1.668 . . . . 0.0 114.13 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -65.58 151.51 46.3 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 123.865 0.866 . . . . 0.0 112.537 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 34.5 m -115.42 -1.14 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 115.974 1.842 . . . . 0.0 115.974 -176.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 50.8 tp -77.27 -11.37 59.82 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -179.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 19.8 m -35.08 100.04 0.18 Allowed Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 128.672 2.789 . . . . 0.0 115.62 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -66.58 126.53 15.63 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.473 2.782 . . . . 0.0 111.074 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 75.3 mt -92.15 142.57 26.39 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 123.456 0.703 . . . . 0.0 111.779 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -56.0 -22.16 37.54 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.516 2.811 . . . . 0.0 114.93 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 43.3 p -73.24 -17.48 61.34 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.559 1.544 . . . . 0.0 113.837 177.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -127.31 -23.41 3.54 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.183 1.393 . . . . 0.0 114.318 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -71.73 137.07 47.46 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.228 1.011 . . . . 0.0 111.564 178.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.84 47.43 0.63 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.801 1.64 . . . . 0.0 113.603 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 37.6 t70 -66.13 -18.63 65.47 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.096 1.358 . . . . 0.0 112.722 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -62.32 -21.22 65.1 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.893 1.277 . . . . 0.0 113.458 177.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 86.5 mt -89.8 16.77 7.48 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.464 1.906 . . . . 0.0 112.861 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.27 152.75 32.7 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -174.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 90.9 mt -125.19 179.96 4.84 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 129.209 3.004 . . . . 0.0 113.557 -177.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 88.0 p -100.11 152.58 37.87 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.85 1.66 . . . . 0.0 106.999 169.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_exo -56.48 -23.78 49.41 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.569 2.179 . . . . 0.0 114.889 -178.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.2 t70 -71.42 -29.15 64.56 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.945 0.898 . . . . 0.0 112.98 178.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 15.5 t70 -76.58 -15.0 59.96 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 93.8 mt -58.13 -35.38 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 O-C-N 121.435 -0.791 . . . . 0.0 109.947 175.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -69.14 -9.85 54.83 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.75 1.22 . . . . 0.0 113.391 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -83.73 -29.06 27.81 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.285 1.034 . . . . 0.0 111.715 177.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -96.78 -37.37 10.3 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.847 0.859 . . . . 0.0 112.498 176.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -109.52 109.66 20.53 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 105.088 -2.189 . . . . 0.0 105.088 169.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 3.1 m -75.57 140.92 42.97 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 116.202 1.926 . . . . 0.0 116.202 -170.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -120.1 143.83 47.94 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.389 2.276 . . . . 0.0 106.616 169.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -60.7 129.37 89.69 Favored Pre-proline 0 CA--C 1.552 1.042 0 O-C-N 121.009 -1.057 . . . . 0.0 113.629 -175.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -75.5 -21.19 15.2 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 123.319 2.68 . . . . 0.0 112.524 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 174.96 171.21 38.84 Favored Glycine 0 CA--C 1.54 1.604 0 C-N-CA 127.537 2.494 . . . . 0.0 110.594 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -65.15 -18.83 62.43 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.419 2.746 . . . . 0.0 113.82 -179.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -94.47 -3.32 50.22 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.829 1.652 . . . . 0.0 114.204 179.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 64.32 43.28 97.12 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 119.067 0.849 . . . . 0.0 113.681 -178.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 4.9 p -60.54 103.59 0.26 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.87 1.268 . . . . 0.0 110.873 178.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 26.9 p -68.76 158.03 35.15 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.587 1.555 . . . . 0.0 114.535 -175.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 18.7 p90 -145.53 168.38 20.74 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.874 1.67 . . . . 0.0 111.681 -175.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 58.0 m-20 -53.22 -37.25 61.85 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 120.89 -1.131 . . . . 0.0 113.069 -177.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -65.98 -8.21 40.94 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 125.332 1.444 . . . . 0.0 115.867 178.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 39.7 p -128.4 -34.02 2.08 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 118.902 1.351 . . . . 0.0 112.763 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -93.72 -36.26 12.4 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.695 1.369 . . . . 0.0 114.695 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 24.9 m -93.68 -42.64 9.06 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.93 0.892 . . . . 0.0 111.934 -178.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -131.25 82.66 0.32 Allowed Glycine 0 CA--C 1.534 1.271 0 C-N-CA 125.415 1.483 . . . . 0.0 111.004 177.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.69 159.03 18.18 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 124.512 3.475 . . . . 0.0 115.682 -177.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 38.5 p -58.85 -21.29 56.65 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.726 1.61 . . . . 0.0 114.432 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -80.15 -4.31 52.45 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.975 1.31 . . . . 0.0 114.095 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -65.63 143.9 98.75 Favored Pre-proline 0 CA--C 1.546 0.802 0 O-C-N 121.25 -0.906 . . . . 0.0 111.618 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -60.68 -33.49 93.22 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.742 2.295 . . . . 0.0 113.281 -178.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -68.37 -32.42 72.49 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.184 -0.947 . . . . 0.0 112.377 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -62.55 -37.96 88.18 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 118.793 0.724 . . . . 0.0 110.524 174.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -64.99 -39.5 93.57 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.819 0.848 . . . . 0.0 111.34 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -59.0 -41.0 86.62 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.132 0.878 . . . . 0.0 111.11 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 94.3 mt -64.84 -38.44 90.97 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.683 0.793 . . . . 0.0 111.848 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -65.5 -53.83 35.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 CA-C-N 119.066 0.848 . . . . 0.0 109.454 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -52.29 -52.06 55.05 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.184 0.994 . . . . 0.0 111.563 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -35.53 80.46 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -179.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 14.0 tp60 -74.21 -44.05 54.75 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.044 0.838 . . . . 0.0 110.88 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.8 tt -59.63 -46.25 89.56 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.863 1.265 . . . . 0.0 110.435 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 92.4 t -58.24 -32.13 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 119.008 0.822 . . . . 0.0 111.221 175.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.58 -26.15 61.6 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.827 -1.17 . . . . 0.0 113.854 175.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.8 mp -63.6 -32.59 74.11 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 120.104 1.32 . . . . 0.0 108.911 173.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 4.1 mt -69.14 -50.42 48.09 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.708 1.203 . . . . 0.0 109.564 175.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 17.9 t60 -55.79 -53.55 55.28 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 122.603 0.361 . . . . 0.0 110.365 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -58.31 -27.29 63.96 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -86.28 -28.36 23.81 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.996 0.816 . . . . 0.0 112.885 176.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 40.9 mttm -86.06 -36.21 19.81 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.017 1.327 . . . . 0.0 112.223 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 49.5 t -60.85 -48.4 82.0 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 127.067 2.147 . . . . 0.0 111.051 177.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -61.12 -34.96 75.8 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.322 -0.861 . . . . 0.0 112.335 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -72.25 -37.86 69.03 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.64 1.176 . . . . 0.0 112.069 177.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.7 -39.77 85.69 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.914 1.285 . . . . 0.0 110.78 176.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -68.68 -35.87 77.77 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 118.388 0.54 . . . . 0.0 111.137 175.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -66.72 -36.48 82.58 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.135 -0.978 . . . . 0.0 111.28 176.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -74.13 -27.25 60.77 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.648 1.179 . . . . 0.0 113.646 177.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 58.8 t-20 -137.54 101.06 4.38 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.538 1.135 . . . . 0.0 112.083 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . -71.82 -7.16 65.14 Favored Glycine 0 CA--C 1.54 1.599 0 N-CA-C 115.515 0.966 . . . . 0.0 115.515 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -81.43 -13.31 58.38 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 119.107 1.454 . . . . 0.0 112.796 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 26.9 m -118.15 162.19 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 126.062 1.745 . . . . 0.0 112.318 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 84.8 mtp180 -121.51 147.75 45.38 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.561 1.545 . . . . 0.0 111.413 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -65.02 165.96 10.15 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.262 1.425 . . . . 0.0 113.665 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 16.4 m -49.31 145.93 4.15 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.224 2.21 . . . . 0.0 116.409 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 67.1 m -93.5 -3.45 52.9 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.339 1.455 . . . . 0.0 111.193 171.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 41.5 tp -64.66 115.04 16.96 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 127.897 2.479 . . . . 0.0 109.238 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -59.74 -32.25 95.36 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.592 2.195 . . . . 0.0 113.841 -176.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -69.4 -37.09 77.33 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.588 -0.695 . . . . 0.0 112.578 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.7 t -67.61 -50.44 58.16 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.3 1.44 . . . . 0.0 109.258 175.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -55.49 -40.83 72.21 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.123 1.369 . . . . 0.0 111.585 174.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.3 m -64.74 -56.53 13.08 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.526 1.13 . . . . 0.0 111.044 177.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.7 mmt -64.25 -36.81 85.31 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.79 -32.08 73.41 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.909 1.686 . . . . 0.0 112.667 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -71.48 -41.4 69.37 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.165 0.586 . . . . 0.0 110.398 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 76.1 t -62.56 -48.06 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.467 0.707 . . . . 0.0 110.839 177.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.71 -44.63 90.44 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.918 0.887 . . . . 0.0 111.635 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -67.74 -17.43 64.55 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 177.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 58.2 t60 -88.75 -49.75 6.65 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.857 0.863 . . . . 0.0 109.512 173.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.2 ttp -56.77 -28.15 60.76 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.273 1.829 . . . . 0.0 113.591 -177.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.9 p -67.77 -27.7 66.99 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.569 1.148 . . . . 0.0 112.783 175.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -105.26 -17.55 14.42 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.775 1.63 . . . . 0.0 113.853 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 30.4 t -62.1 146.97 48.92 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.24 1.416 . . . . 0.0 112.218 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -116.79 -13.72 10.75 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.53 1.532 . . . . 0.0 113.881 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -94.81 -27.24 15.87 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.096 0.959 . . . . 0.0 112.373 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.34 -112.89 2.58 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.619 1.105 . . . . 0.0 113.007 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -61.78 -18.18 58.9 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 121.392 -1.064 . . . . 0.0 113.309 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.26 -0.25 44.35 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.45 1.5 . . . . 0.0 113.644 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 15.4 t -59.69 144.01 49.15 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 122.473 1.13 . . . . 0.0 110.779 179.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 56.4 mm-40 -78.52 -8.39 58.51 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.5 1.12 . . . . 0.0 113.053 -176.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 90.8 t -91.05 115.04 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 173.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.34 -36.88 66.76 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -177.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -67.49 -32.63 73.59 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.374 1.07 . . . . 0.0 112.809 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 47.9 t -74.73 -55.42 5.87 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.357 1.463 . . . . 0.0 109.72 177.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -54.91 -45.81 74.8 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.261 1.025 . . . . 0.0 112.624 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 23.8 p -63.9 -46.33 85.36 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 177.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 62.8 m -63.17 -33.22 75.01 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 118.859 0.754 . . . . 0.0 112.039 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -63.7 -30.8 71.86 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 118.168 -0.92 . . . . 0.0 112.674 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -63.98 -37.98 89.4 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.213 1.37 . . . . 0.0 110.692 173.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.9 mt -66.99 -42.49 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.205 1.002 . . . . 0.0 110.365 178.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 19.4 mm -66.09 -36.74 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 123.599 0.76 . . . . 0.0 110.911 176.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 54.1 m -66.11 -24.08 66.62 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.422 1.089 . . . . 0.0 113.251 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -62.35 -59.03 5.58 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.243 0.928 . . . . 0.0 110.852 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 56.5 m95 -60.61 -26.22 66.84 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 48.1 mttp -72.95 -33.75 66.1 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.869 0.868 . . . . 0.0 113.144 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.7 p30 -100.05 -29.56 12.45 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 6.3 t -79.05 133.92 36.78 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.439 1.096 . . . . 0.0 112.315 -178.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 74.2 p -130.12 2.14 4.74 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.658 1.583 . . . . 0.0 114.311 -178.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -78.31 155.78 29.98 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.203 1.401 . . . . 0.0 113.612 -178.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -88.56 -33.11 17.83 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.875 0.87 . . . . 0.0 110.646 171.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 19.8 t0 -103.03 80.24 1.84 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.851 2.06 . . . . 0.0 111.478 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 42.8 t -132.19 134.97 25.69 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 126.995 2.118 . . . . 0.0 107.958 177.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -59.96 -22.9 70.86 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 122.252 1.968 . . . . 0.0 113.52 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 5.0 t -92.14 -51.49 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 119.409 1.004 . . . . 0.0 111.634 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 19.6 m -65.68 -44.06 87.36 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -177.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.52 -56.4 27.27 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.149 -175.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -63.34 -30.65 73.25 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 121.789 1.675 . . . . 0.0 113.068 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 97.8 mt -69.84 -44.16 70.45 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.47 1.032 . . . . 0.0 111.288 176.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -64.74 -35.06 79.86 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.192 0.997 . . . . 0.0 111.184 175.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 57.4 t30 -68.12 -40.3 82.56 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.458 1.103 . . . . 0.0 111.065 175.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -72.76 -37.47 67.66 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.378 1.071 . . . . 0.0 112.763 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 89.7 p -87.77 31.58 0.76 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.474 1.91 . . . . 0.0 114.34 -179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 26.4 t0 -75.01 55.21 0.7 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.571 1.948 . . . . 0.0 112.669 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -71.61 43.29 0.09 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 128.15 2.58 . . . . 0.0 116.246 -176.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 48.8 mtm105 . . . . . 0 N--CA 1.477 0.917 0 C-N-CA 125.947 1.699 . . . . 0.0 111.941 178.736 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.313 0 CA-C-O 121.179 0.322 . . . . 0.0 113.859 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.7 m -57.11 -19.55 20.42 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -178.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -78.25 -14.31 59.49 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.877 1.271 . . . . 0.0 113.745 178.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 46.9 tpp -84.88 149.38 25.71 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.811 1.244 . . . . 0.0 112.306 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -79.9 169.27 18.13 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.815 1.246 . . . . 0.0 113.283 178.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -127.68 147.53 63.07 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.049 1.339 . . . . 0.0 112.204 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -71.97 152.99 57.98 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.348 2.699 . . . . 0.0 112.88 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -139.07 152.37 47.49 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.887 1.675 . . . . 0.0 110.835 178.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 56.8 m -135.8 153.01 51.65 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.163 1.385 . . . . 0.0 112.352 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 14.7 t70 -74.53 130.71 81.3 Favored Pre-proline 0 CA--C 1.553 1.089 0 C-N-CA 123.949 0.899 . . . . 0.0 111.416 178.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -82.16 -18.15 7.53 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 123.398 2.732 . . . . 0.0 115.279 -177.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 33.9 m -83.93 -31.13 25.79 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -176.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 8.4 p -76.63 147.98 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.269 1.028 . . . . 0.0 111.839 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -133.63 151.92 78.04 Favored Pre-proline 0 CA--C 1.547 0.858 0 C-N-CA 125.282 1.433 . . . . 0.0 111.102 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.32 -48.08 19.3 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.127 2.551 . . . . 0.0 116.447 -178.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -84.2 158.82 13.19 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 122.878 2.385 . . . . 0.0 112.558 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 8.9 tt -80.36 139.27 36.63 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.332 0.653 . . . . 0.0 110.548 175.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 29.2 t -121.75 161.3 22.86 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.419 1.888 . . . . 0.0 109.124 174.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 32.5 tp60 -61.68 -24.02 66.48 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.691 -1.255 . . . . 0.0 112.216 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -89.31 -6.61 56.58 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.206 1.187 . . . . 0.0 114.206 176.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 95.9 m -58.32 -58.06 10.15 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.631 1.105 . . . . 0.0 111.07 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -60.19 -28.48 68.0 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.61 0.764 . . . . 0.0 112.924 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 42.5 m -70.19 -34.2 72.66 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.853 0.861 . . . . 0.0 112.631 178.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -90.1 -26.61 20.14 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.593 1.157 . . . . 0.0 113.365 175.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.2 tt -45.41 -60.04 2.37 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 126.913 2.085 . . . . 0.0 113.498 -176.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 40.0 p-90 -66.72 -10.52 47.71 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -173.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 9.1 ptmm? -112.12 -57.72 2.23 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 47.2 mt -116.05 13.96 15.95 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 -171.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.9 tt -55.06 135.98 67.47 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 125.701 1.6 . . . . 0.0 113.703 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.23 170.59 20.03 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.935 3.09 . . . . 0.0 113.667 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -67.42 2.17 1.87 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 -178.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 15.3 t30 -140.04 134.18 31.04 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.402 1.481 . . . . 0.0 110.444 177.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -149.72 163.56 37.62 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.017 0.927 . . . . 0.0 112.567 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 35.0 m -108.48 -17.29 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 125.481 1.513 . . . . 0.0 114.307 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.45 -1.81 56.25 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.574 1.55 . . . . 0.0 113.428 -178.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 15.4 m -57.88 109.87 2.11 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.391 1.877 . . . . 0.0 114.074 -177.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -67.65 134.87 34.08 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.311 2.674 . . . . 0.0 111.59 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 11.1 mp -77.85 131.13 71.11 Favored Pre-proline 0 CA--C 1.546 0.794 0 CA-C-O 118.216 -0.897 . . . . 0.0 111.661 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -54.78 -33.92 82.73 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 123.483 2.788 . . . . 0.0 114.388 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 52.6 p -71.31 -13.23 61.81 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.259 1.424 . . . . 0.0 113.962 178.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -124.69 10.11 8.36 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.763 2.025 . . . . 0.0 112.027 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.49 156.89 38.56 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -175.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.57 23.8 3.34 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 128.473 2.709 . . . . 0.0 112.949 178.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 35.3 t70 -60.28 -24.73 65.17 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.261 1.424 . . . . 0.0 114.414 -176.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -68.45 -16.4 63.89 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 113.674 0.991 . . . . 0.0 113.674 178.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 24.0 tp -105.45 7.73 33.23 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.939 1.696 . . . . 0.0 112.521 179.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 62.1 mmm -67.3 159.5 29.11 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.732 1.753 . . . . 0.0 115.732 -177.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 96.3 mt -125.06 170.51 11.1 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 127.666 2.386 . . . . 0.0 112.766 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 30.7 t -86.36 146.65 42.67 Favored Pre-proline 0 CA--C 1.543 0.696 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 169.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.8 Cg_exo -54.14 -21.45 22.14 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.89 2.394 . . . . 0.0 115.087 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 32.7 t70 -73.27 -22.07 60.46 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.342 1.057 . . . . 0.0 113.006 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -78.92 -17.44 55.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.062 0.945 . . . . 0.0 112.994 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.65 -34.26 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 125.134 1.374 . . . . 0.0 110.667 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -68.41 -10.03 52.43 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.702 1.201 . . . . 0.0 113.814 178.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 52.6 tp60 -82.35 -39.11 23.24 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.093 -1.004 . . . . 0.0 111.373 177.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.255 3.9 p-90 -90.9 -26.35 19.36 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -117.72 109.73 16.98 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 104.225 -2.509 . . . . 0.0 104.225 169.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.18 147.07 27.08 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -171.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 23.3 mp0 -75.9 168.36 20.17 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.772 1.229 . . . . 0.0 111.386 176.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 13.6 t70 -59.9 136.46 90.38 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 124.082 0.953 . . . . 0.0 112.631 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.01 -20.49 57.33 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.822 3.015 . . . . 0.0 115.364 -178.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 65.06 -143.62 46.68 Favored Glycine 0 CA--C 1.543 1.814 0 O-C-N 121.317 -0.865 . . . . 0.0 112.538 -178.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -78.45 -6.11 15.3 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 123.953 3.102 . . . . 0.0 115.574 -177.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -136.76 -44.65 0.59 Allowed 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -177.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 64.67 20.78 66.47 Favored Glycine 0 CA--C 1.54 1.61 0 CA-C-N 119.338 0.972 . . . . 0.0 115.326 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 20.7 m -50.71 -37.69 42.96 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 -176.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 62.2 m -57.51 -26.41 61.27 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.524 1.53 . . . . 0.0 114.433 -178.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -64.68 -23.34 67.22 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.007 0.821 . . . . 0.0 112.961 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -67.72 -28.65 67.83 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.248 -0.907 . . . . 0.0 111.461 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -73.54 -12.59 80.36 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 125.336 1.446 . . . . 0.0 114.759 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 3.7 t -124.97 4.38 8.0 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.365 1.466 . . . . 0.0 113.197 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -61.82 -21.42 64.61 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.952 1.301 . . . . 0.0 113.877 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 33.0 p -73.05 -15.26 61.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.485 1.514 . . . . 0.0 112.777 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -155.25 81.32 0.17 Allowed Glycine 0 CA--C 1.535 1.335 0 C-N-CA 125.994 1.759 . . . . 0.0 111.159 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.24 155.26 30.33 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 124.117 3.211 . . . . 0.0 113.315 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 33.1 p -49.89 -36.37 27.1 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.883 1.438 . . . . 0.0 114.883 -178.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -76.44 -4.28 41.62 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.498 1.519 . . . . 0.0 114.969 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 13.7 t70 -65.9 138.05 96.25 Favored Pre-proline 0 CA--C 1.549 0.93 0 O-C-N 121.12 -0.987 . . . . 0.0 111.219 178.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 81.3 Cg_exo -49.57 -35.23 36.71 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.546 2.83 . . . . 0.0 115.373 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -67.87 -25.3 65.45 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -90.19 -39.17 12.98 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.29 1.436 . . . . 0.0 111.232 173.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 6.9 mmp_? -58.47 -42.98 88.7 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.957 0.903 . . . . 0.0 111.544 176.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -64.43 -28.65 69.82 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 177.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 98.7 mt -69.92 -37.86 76.06 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.534 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -63.13 -52.75 55.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 174.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -52.51 -55.71 20.22 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.949 0.9 . . . . 0.0 111.412 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -34.26 77.41 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -178.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -69.47 -44.87 70.29 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.485 1.039 . . . . 0.0 110.365 177.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 5.1 tt -60.07 -43.8 95.21 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.603 1.161 . . . . 0.0 110.017 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 85.4 t -58.94 -31.43 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.1 0.864 . . . . 0.0 111.525 175.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 4.4 tp -72.26 -29.61 64.07 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 120.137 1.335 . . . . 0.0 112.816 175.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -60.97 -33.83 73.82 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 120.394 1.452 . . . . 0.0 109.14 174.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 7.0 mt -66.7 -51.84 51.47 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.307 1.043 . . . . 0.0 109.998 175.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 31.4 t60 -57.3 -57.35 13.0 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 119.19 -0.433 . . . . 0.0 110.291 177.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -51.79 -41.21 61.51 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.419 1.088 . . . . 0.0 113.548 -178.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -75.32 -35.99 61.13 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 36.9 mttm -73.31 -46.84 47.2 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.954 0.902 . . . . 0.0 110.844 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 35.3 t -55.79 -45.51 78.19 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 127.123 2.169 . . . . 0.0 111.151 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -52.16 -51.42 58.1 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.782 1.633 . . . . 0.0 112.659 175.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -88.55 -16.47 32.52 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 113.985 1.106 . . . . 0.0 113.985 -174.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -33.6 69.34 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 125.406 1.483 . . . . 0.0 112.161 175.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.09 -29.98 65.97 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.817 -0.552 . . . . 0.0 111.687 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -61.68 -27.6 68.8 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.005 0.922 . . . . 0.0 112.534 179.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -78.39 -9.94 59.49 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.835 1.254 . . . . 0.0 114.112 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -124.74 -50.92 1.71 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.582 1.153 . . . . 0.0 114.075 -177.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 75.16 3.22 68.89 Favored Glycine 0 CA--C 1.54 1.641 0 N-CA-C 117.088 1.595 . . . . 0.0 117.088 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -125.64 -32.49 2.86 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.012 1.906 . . . . 0.0 114.271 -178.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 27.3 m -70.47 153.83 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 O-C-N 121.215 -0.928 . . . . 0.0 112.217 179.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -82.97 158.0 22.75 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.355 1.062 . . . . 0.0 112.212 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -76.95 174.7 10.3 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.784 1.234 . . . . 0.0 113.567 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -62.9 160.81 13.96 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.409 1.884 . . . . 0.0 114.936 -177.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 62.5 m -105.5 -7.05 18.89 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.711 1.604 . . . . 0.0 113.704 178.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 4.4 mp -77.74 130.53 73.21 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 119.046 0.839 . . . . 0.0 112.207 -179.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -68.51 -37.05 13.71 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.563 2.175 . . . . 0.0 111.341 178.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 37.7 m80 -71.23 -31.09 67.14 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.949 0.9 . . . . 0.0 112.745 178.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.5 t -66.42 -51.84 52.7 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.806 1.243 . . . . 0.0 109.019 175.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -55.87 -38.86 70.69 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.806 1.242 . . . . 0.0 111.367 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 33.1 m -66.16 -57.14 8.29 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.959 0.904 . . . . 0.0 111.538 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.2 mmt -64.35 -36.33 83.79 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 -177.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -64.71 -28.9 69.91 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 120.738 1.608 . . . . 0.0 112.773 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -74.06 -39.74 63.27 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.129 0.572 . . . . 0.0 110.449 173.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 92.8 t -63.01 -44.84 99.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 121.753 -0.592 . . . . 0.0 110.744 176.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.54 -44.8 95.71 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.957 0.903 . . . . 0.0 110.576 177.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -63.52 -31.4 72.55 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.127 0.876 . . . . 0.0 113.202 175.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 74.5 t60 -74.73 -50.64 16.74 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.324 -0.86 . . . . 0.0 109.303 175.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.7 ttp -58.65 -30.95 67.71 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.32 1.848 . . . . 0.0 114.127 -177.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 25.0 p -70.22 -27.85 64.81 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 119.958 1.254 . . . . 0.0 112.307 174.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 78.6 t60 -96.83 -24.02 16.1 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.032 1.733 . . . . 0.0 113.556 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 20.0 t -60.06 148.68 34.87 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.373 1.469 . . . . 0.0 113.182 -177.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -113.87 -14.59 12.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.303 1.841 . . . . 0.0 113.503 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -103.9 -31.98 9.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.453 1.101 . . . . 0.0 112.536 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.55 -107.78 0.58 Allowed Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.559 1.076 . . . . 0.0 113.601 177.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 64.6 tttp -59.29 -25.51 64.17 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.034 -1.274 . . . . 0.0 112.48 177.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -94.97 -0.23 54.05 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.453 1.501 . . . . 0.0 113.833 177.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.1 t -61.71 143.64 55.87 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 122.407 1.099 . . . . 0.0 110.581 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.8 mm-40 -80.15 -6.14 57.24 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.513 1.125 . . . . 0.0 113.373 -176.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 16.8 t -92.82 124.53 45.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 124.748 1.219 . . . . 0.0 108.653 175.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.59 -46.25 70.3 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -176.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.56 -31.88 71.4 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 -178.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 51.2 t -67.65 -57.48 6.32 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.914 0.886 . . . . 0.0 109.859 178.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -61.76 -15.53 41.93 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.7 m -89.05 -55.61 3.61 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.341 1.057 . . . . 0.0 112.121 176.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.2 m -61.34 -31.98 71.86 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.478 1.036 . . . . 0.0 111.989 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -61.43 -32.75 72.72 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.548 -0.72 . . . . 0.0 111.987 175.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -66.26 -32.28 73.6 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.503 1.047 . . . . 0.0 111.481 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 12.3 mt -71.18 -46.83 64.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.252 1.021 . . . . 0.0 109.675 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 23.2 mm -60.87 -44.06 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 123.942 0.897 . . . . 0.0 110.687 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 44.9 m -57.56 -22.44 44.69 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 178.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.0 t60 -63.31 -53.06 58.71 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.636 1.107 . . . . 0.0 110.277 176.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 64.6 m95 -65.05 -27.91 69.12 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -68.72 -33.02 73.22 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.579 0.752 . . . . 0.0 112.31 175.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -100.04 -35.64 9.63 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 -177.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.2 t -80.53 137.18 36.4 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.352 1.461 . . . . 0.0 112.555 -176.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 22.1 m -129.99 -19.77 3.19 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.476 1.511 . . . . 0.0 113.274 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -68.39 140.78 55.84 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.514 1.525 . . . . 0.0 112.048 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -77.81 -38.11 47.16 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.222 0.609 . . . . 0.0 112.387 177.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 24.0 t70 -86.98 69.95 10.28 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.055 1.742 . . . . 0.0 111.745 179.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.8 t -124.17 135.22 26.14 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 126.543 1.937 . . . . 0.0 109.763 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -58.89 -25.47 77.11 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.964 2.443 . . . . 0.0 114.405 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.5 t -92.21 -51.16 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 119.748 1.158 . . . . 0.0 111.726 176.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.8 m -69.6 -39.64 77.14 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -175.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.5 tt -56.44 -55.65 40.31 Favored Pre-proline 0 CA--C 1.547 0.852 0 O-C-N 120.893 -1.129 . . . . 0.0 112.76 -178.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -61.44 -28.79 84.24 Favored 'Trans proline' 0 C--N 1.353 0.765 0 CA-C-N 121.609 1.61 . . . . 0.0 113.264 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 91.2 mt -70.15 -45.53 66.59 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.807 1.185 . . . . 0.0 111.401 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -63.84 -33.27 75.32 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.191 0.597 . . . . 0.0 111.229 176.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 59.1 t30 -72.81 -40.63 65.67 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.79 1.236 . . . . 0.0 111.833 176.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -73.68 -27.03 61.01 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.044 1.338 . . . . 0.0 113.892 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 47.8 t -58.53 134.02 56.34 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.113 0.965 . . . . 0.0 112.993 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 24.6 t70 -77.24 -2.76 36.31 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.63 1.172 . . . . 0.0 113.521 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 62.2 mttm -70.93 -0.65 9.7 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.257 1.423 . . . . 0.0 114.756 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 72.2 mtm-85 . . . . . 0 N--CA 1.479 1.006 0 C-N-CA 127.595 2.358 . . . . 0.0 110.973 176.666 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.392 0 N-CA-C 114.804 0.682 . . . . 0.0 114.804 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.1 p -85.54 -5.33 59.29 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.857 1.663 . . . . 0.0 114.223 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -64.06 147.95 50.94 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.729 1.612 . . . . 0.0 113.104 -179.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 56.8 ttm -76.04 145.89 39.85 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.471 1.108 . . . . 0.0 111.718 178.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -73.54 155.43 39.17 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.991 0.916 . . . . 0.0 113.279 178.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -146.67 -43.33 0.01 OUTLIER Pre-proline 0 CA--C 1.551 1.005 0 N-CA-C 114.841 1.423 . . . . 0.0 114.841 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -56.68 143.1 90.64 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 122.95 2.434 . . . . 0.0 114.667 -178.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -115.9 158.59 22.76 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.88 1.672 . . . . 0.0 111.523 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 22.6 p -72.15 -53.96 11.13 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.069 0.947 . . . . 0.0 112.327 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 39.8 t0 -157.63 122.09 2.27 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 125.617 1.567 . . . . 0.0 110.294 177.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.75 -26.35 79.63 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 123.269 2.646 . . . . 0.0 115.177 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 66.4 m -137.2 100.77 4.35 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.563 1.545 . . . . 0.0 110.585 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 24.6 m -80.65 -28.93 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -178.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -137.74 60.87 26.81 Favored Pre-proline 0 CA--C 1.553 1.09 0 C-N-CA 124.658 1.183 . . . . 0.0 112.587 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.31 -29.23 38.82 Favored 'Trans proline' 0 CA--C 1.553 1.451 0 C-N-CA 122.691 2.26 . . . . 0.0 117.501 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -80.48 157.45 22.19 Favored 'Trans proline' 0 C--N 1.358 1.052 0 CA-C-N 123.957 2.449 . . . . 0.0 113.132 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 8.1 tt -83.27 136.01 34.54 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.276 1.03 . . . . 0.0 111.18 177.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 41.9 t -90.38 144.43 25.83 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.465 1.106 . . . . 0.0 110.957 176.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -58.0 -24.4 58.03 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.842 0.857 . . . . 0.0 113.247 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -64.26 -23.13 67.19 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.024 0.93 . . . . 0.0 111.964 176.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 20.9 m -66.75 -60.18 2.91 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.746 0.819 . . . . 0.0 109.909 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -60.26 -31.37 70.15 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.772 0.829 . . . . 0.0 112.738 174.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 54.0 m -69.45 -32.8 71.96 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.1 t70 -90.08 -29.52 18.29 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.74 1.216 . . . . 0.0 113.058 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -45.2 -58.14 3.46 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.843 2.057 . . . . 0.0 113.508 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -69.99 -9.76 56.29 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -112.06 -51.78 2.83 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 116.835 2.161 . . . . 0.0 116.835 -176.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 55.4 mt -117.04 20.19 13.92 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -170.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 7.5 tp -51.6 136.01 34.01 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.911 1.685 . . . . 0.0 115.012 -174.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -69.72 163.92 36.45 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.472 2.781 . . . . 0.0 111.498 175.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -69.77 -11.27 60.73 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.971 1.841 . . . . 0.0 115.971 -177.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 27.4 m120 -128.81 119.09 23.88 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.57 1.148 . . . . 0.0 111.1 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -158.31 150.26 21.61 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.273 1.429 . . . . 0.0 111.096 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 34.0 m -133.54 20.95 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 125.096 1.359 . . . . 0.0 114.334 -178.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 4.3 tt -66.56 -47.33 73.16 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.713 1.205 . . . . 0.0 112.704 -178.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 29.1 p -74.56 152.66 87.5 Favored Pre-proline 0 N--CA 1.473 0.704 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -177.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -70.88 149.25 59.41 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.247 2.631 . . . . 0.0 112.051 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 90.1 mt -79.21 157.12 76.01 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 124.599 1.159 . . . . 0.0 110.688 176.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -53.43 -29.1 47.28 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.543 2.829 . . . . 0.0 115.278 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 51.3 p -72.15 -14.06 61.72 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.329 1.452 . . . . 0.0 114.21 177.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -134.95 15.35 3.57 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.213 1.805 . . . . 0.0 113.447 -179.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.33 160.99 31.46 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.727 1.211 . . . . 0.0 113.149 -179.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 71.7 mtm -90.92 31.85 1.04 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.173 1.389 . . . . 0.0 113.076 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -64.98 -17.62 64.57 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -178.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -66.63 -17.77 65.01 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 121.385 -0.822 . . . . 0.0 112.106 174.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 83.7 mt -111.32 11.43 21.63 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.992 2.117 . . . . 0.0 112.338 178.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 5.6 tpt -62.98 135.41 57.28 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -173.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.5 tt -124.99 144.88 50.15 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.391 2.276 . . . . 0.0 111.379 -177.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 52.2 m -73.24 151.53 90.08 Favored Pre-proline 0 N--CA 1.475 0.811 0 C-N-CA 124.946 1.299 . . . . 0.0 113.141 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -60.78 -23.92 77.65 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.574 2.849 . . . . 0.0 115.252 -177.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -78.71 -23.76 45.33 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.47 -0.769 . . . . 0.0 112.315 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -83.48 -9.86 58.71 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.61 1.564 . . . . 0.0 112.526 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 89.2 mt -57.87 -32.16 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 119.131 0.878 . . . . 0.0 109.46 173.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -69.74 -9.92 56.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.372 1.069 . . . . 0.0 113.476 177.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -77.89 -28.78 49.98 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.109 0.964 . . . . 0.0 111.7 177.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.4 p-90 -102.06 -35.54 8.9 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.068 0.947 . . . . 0.0 112.853 177.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 16.8 m-30 -111.13 109.6 19.74 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 169.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 6.7 t -125.26 168.45 13.47 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.19 1.396 . . . . 0.0 113.583 179.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -97.22 176.54 5.88 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.375 1.87 . . . . 0.0 111.794 176.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 10.3 t70 -65.68 124.57 87.76 Favored Pre-proline 0 CA--C 1.555 1.136 0 O-C-N 120.765 -1.209 . . . . 0.0 110.284 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -77.87 -11.16 16.75 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.327 2.685 . . . . 0.0 115.473 -175.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 55.54 -123.54 30.56 Favored Glycine 0 CA--C 1.543 1.791 0 CA-C-O 118.943 -0.921 . . . . 0.0 112.825 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -68.27 -16.67 44.31 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.37 2.714 . . . . 0.0 113.901 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 29.3 t70 -87.74 4.39 44.38 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.781 1.232 . . . . 0.0 112.978 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -61.14 -12.59 31.23 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 125.383 1.468 . . . . 0.0 116.471 -178.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 25.4 p -62.53 -27.09 68.92 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.183 1.492 . . . . 0.0 113.684 178.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 90.3 m -91.47 -2.99 57.06 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.293 1.437 . . . . 0.0 113.408 177.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -96.85 125.32 41.21 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -176.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 55.5 t-20 -148.42 -103.03 0.08 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.575 1.95 . . . . 0.0 108.441 177.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -66.5 -15.23 63.55 Favored Glycine 0 CA--C 1.542 1.751 0 CA-C-N 119.482 1.037 . . . . 0.0 112.768 173.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 1.8 p -75.38 -10.78 59.76 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 129.292 3.037 . . . . 0.0 113.387 175.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -96.44 150.81 20.18 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.094 1.358 . . . . 0.0 112.007 178.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 29.3 m -74.39 132.92 42.42 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.891 0.877 . . . . 0.0 111.039 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 143.81 -56.34 0.55 Allowed Glycine 0 CA--C 1.539 1.582 0 CA-C-O 118.448 -1.196 . . . . 0.0 115.043 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -56.48 136.47 75.96 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.881 3.054 . . . . 0.0 114.894 -177.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 41.9 p -105.85 -5.85 19.43 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.945 1.698 . . . . 0.0 113.767 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -74.46 -9.48 58.62 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.6 1.334 . . . . 0.0 114.6 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 10.3 t70 -100.6 109.88 58.75 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.944 1.298 . . . . 0.0 111.657 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.75 -28.32 9.76 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.029 2.486 . . . . 0.0 113.685 -179.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -62.91 -47.92 81.18 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.794 0.838 . . . . 0.0 111.142 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -58.13 -47.59 82.82 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.401 -0.812 . . . . 0.0 110.476 176.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 27.3 ttp-105 -57.04 -51.29 69.84 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.535 1.134 . . . . 0.0 112.509 178.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -67.41 -29.69 69.26 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.112 0.869 . . . . 0.0 112.766 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 60.4 mt -66.37 -42.13 88.46 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.941 0.791 . . . . 0.0 111.192 174.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.4 mt -64.22 -51.23 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.527 1.058 . . . . 0.0 109.569 175.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -53.88 -52.13 61.45 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.533 0.733 . . . . 0.0 111.558 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -37.05 85.68 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.176 0.898 . . . . 0.0 113.099 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 16.1 tp60 -69.82 -44.08 70.69 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.794 0.724 . . . . 0.0 111.045 178.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.0 tt -63.45 -41.91 98.64 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.471 0.709 . . . . 0.0 110.231 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 94.5 t -59.8 -32.21 49.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 119.398 0.999 . . . . 0.0 111.15 174.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 1.6 tp -71.2 -26.31 62.9 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.913 -1.117 . . . . 0.0 112.995 175.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.33 -29.13 70.22 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 120.597 1.544 . . . . 0.0 109.612 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.3 mt -73.37 -53.63 10.28 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.734 1.213 . . . . 0.0 108.906 175.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 15.4 t60 -54.98 -56.06 23.95 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 122.887 0.475 . . . . 0.0 110.792 177.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -55.99 -23.49 32.9 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -90.07 -33.6 16.24 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.144 -0.972 . . . . 0.0 113.112 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 42.4 mttm -82.34 -31.13 30.02 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.441 1.497 . . . . 0.0 112.693 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.1 t -68.98 -51.91 34.52 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.227 2.211 . . . . 0.0 111.488 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -54.45 -30.85 54.09 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 121.062 -1.024 . . . . 0.0 113.405 178.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -67.09 -24.02 65.9 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.821 1.248 . . . . 0.0 113.08 177.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -36.42 84.16 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.771 1.169 . . . . 0.0 112.109 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -78.15 -35.01 49.43 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.444 1.098 . . . . 0.0 110.965 177.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 15.6 tp60 -66.73 -36.21 81.92 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.491 -0.755 . . . . 0.0 110.96 175.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -78.91 -24.7 43.91 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.651 1.18 . . . . 0.0 113.443 178.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 60.2 t-20 -144.47 108.13 4.66 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.512 1.125 . . . . 0.0 112.605 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . -72.33 -9.19 72.41 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 115.433 0.933 . . . . 0.0 115.433 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -81.17 -13.24 58.82 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.061 1.431 . . . . 0.0 112.869 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 30.5 m -126.26 165.66 23.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 126.233 1.813 . . . . 0.0 112.006 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -119.29 158.53 25.88 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.966 1.707 . . . . 0.0 111.999 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -80.31 178.01 8.58 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.736 1.214 . . . . 0.0 111.667 176.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 2.2 m -51.91 146.09 8.91 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 116.328 1.973 . . . . 0.0 116.328 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 68.7 p -97.68 -4.63 36.93 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.677 1.991 . . . . 0.0 111.197 170.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 3.4 tt -59.77 115.8 14.27 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 128.393 2.677 . . . . 0.0 108.67 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -51.03 -43.44 47.93 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.678 2.918 . . . . 0.0 116.054 -174.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 75.7 m80 -73.68 -29.36 62.26 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.9 t -68.03 -50.23 56.65 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 174.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -56.06 -37.2 68.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.577 1.551 . . . . 0.0 111.563 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 24.1 m -68.26 -58.18 4.82 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.511 1.124 . . . . 0.0 111.296 176.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -39.14 91.09 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.564 -0.732 . . . . 0.0 112.729 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -63.27 -33.77 76.22 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.483 1.492 . . . . 0.0 112.956 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -70.83 -41.06 72.01 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.118 0.567 . . . . 0.0 110.582 174.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 70.1 t -63.84 -47.28 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.381 0.672 . . . . 0.0 110.989 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.58 -43.99 89.65 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.998 0.919 . . . . 0.0 111.237 179.034 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -68.39 -17.07 64.14 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 176.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 56.6 t60 -89.99 -48.33 7.28 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.916 0.886 . . . . 0.0 109.963 174.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.7 ttp -56.41 -27.77 57.46 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.377 1.871 . . . . 0.0 113.392 -178.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 12.4 p -69.53 -24.27 63.71 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.976 1.31 . . . . 0.0 113.037 175.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 66.0 m80 -108.96 -17.77 13.84 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.261 1.824 . . . . 0.0 114.093 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.9 t -61.19 149.05 38.74 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.542 1.537 . . . . 0.0 112.72 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -118.38 -15.15 9.72 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.891 1.676 . . . . 0.0 113.747 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -98.8 -28.89 13.28 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.325 1.05 . . . . 0.0 112.802 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.13 -111.24 1.89 Allowed Glycine 0 CA--C 1.536 1.376 0 C-N-CA 124.336 0.969 . . . . 0.0 113.112 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.7 mttt -61.28 -20.82 63.32 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 121.22 -1.164 . . . . 0.0 113.226 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.95 -0.6 50.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.637 1.575 . . . . 0.0 113.537 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.5 t -63.95 141.53 58.73 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.114 0.959 . . . . 0.0 109.935 177.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -80.33 -5.14 55.86 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.208 1.003 . . . . 0.0 113.675 -175.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 84.1 t -89.21 112.98 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 172.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.55 -38.76 64.14 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -69.31 -30.98 69.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.481 1.113 . . . . 0.0 113.423 -178.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 41.5 t -73.1 -54.82 7.54 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.135 1.374 . . . . 0.0 108.997 176.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.83 -25.59 65.11 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 90.1 p -82.24 -48.88 10.73 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.386 0.993 . . . . 0.0 112.151 175.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 69.8 m -61.59 -33.59 74.14 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.372 -0.83 . . . . 0.0 112.259 178.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 43.9 tpt85 -61.63 -29.99 70.41 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.486 -0.759 . . . . 0.0 112.934 177.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -71.0 -32.61 69.47 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.019 0.927 . . . . 0.0 111.212 176.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 27.9 mt -70.78 -44.76 75.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 124.156 0.982 . . . . 0.0 109.227 176.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 22.7 mm -61.79 -36.71 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.984 0.914 . . . . 0.0 110.947 174.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 61.0 m -63.02 -23.56 67.51 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.676 0.79 . . . . 0.0 113.121 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 6.8 t60 -63.63 -58.35 7.2 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.331 0.969 . . . . 0.0 110.694 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 56.2 m95 -61.69 -23.19 65.94 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 177.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 94.4 mttt -76.49 -35.57 58.31 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.937 0.895 . . . . 0.0 112.768 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -100.03 -30.31 12.04 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 179.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.6 t -76.14 136.52 39.81 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.099 1.359 . . . . 0.0 111.469 -179.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.8 p -127.72 -6.98 5.64 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -176.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 -81.76 147.22 29.55 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.353 1.061 . . . . 0.0 113.335 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.7 p-80 -81.67 -27.8 33.86 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.738 0.815 . . . . 0.0 110.534 171.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 16.1 p-10 -98.69 69.93 1.88 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.487 2.315 . . . . 0.0 111.94 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 54.0 t -127.14 134.71 26.43 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 126.533 1.933 . . . . 0.0 109.248 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -57.0 -26.97 71.3 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 123.099 2.533 . . . . 0.0 114.551 -178.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 8.1 t -92.14 -52.96 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-N 119.441 1.019 . . . . 0.0 111.59 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.4 m -67.22 -39.11 86.22 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -174.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.1 tt -54.24 -57.79 16.71 Favored Pre-proline 0 CA--C 1.547 0.844 0 CA-C-O 117.804 -1.093 . . . . 0.0 113.209 -177.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.53 -31.25 92.14 Favored 'Trans proline' 0 C--N 1.352 0.736 0 CA-C-N 121.644 1.623 . . . . 0.0 113.041 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.13 -49.87 46.33 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.01 0.924 . . . . 0.0 112.44 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -65.52 -28.92 69.52 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.108 0.867 . . . . 0.0 111.862 176.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 9.4 t30 -71.87 -43.1 66.02 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.71 1.204 . . . . 0.0 111.949 175.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -76.89 -28.08 55.22 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -179.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 47.5 t -58.7 139.93 55.43 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 -175.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 36.9 t70 -76.61 -13.87 60.03 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.849 1.259 . . . . 0.0 111.843 174.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.06 -1.41 57.86 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.508 1.523 . . . . 0.0 112.976 177.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 . . . . . 0 N--CA 1.477 0.899 0 C-N-CA 126.612 1.965 . . . . 0.0 111.862 178.366 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.381 0 N-CA-C 114.709 0.643 . . . . 0.0 114.709 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.0 m -58.28 -19.52 35.12 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.884 1.674 . . . . 0.0 114.848 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 41.1 m80 -80.43 -10.64 59.74 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.085 1.354 . . . . 0.0 113.972 178.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 50.7 tpp -72.78 142.77 48.09 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.341 1.056 . . . . 0.0 112.097 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -148.93 139.07 22.24 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.162 1.385 . . . . 0.0 110.757 178.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -152.8 153.07 29.6 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.575 1.55 . . . . 0.0 110.87 178.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -58.05 129.17 31.79 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.017 2.478 . . . . 0.0 114.168 -178.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -128.22 1.3 5.78 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.797 1.639 . . . . 0.0 114.045 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 61.6 p -97.05 -0.34 47.38 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.976 1.71 . . . . 0.0 114.725 -178.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 15.9 t70 -66.91 126.39 92.36 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 124.319 1.047 . . . . 0.0 112.535 -179.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -86.23 -16.22 4.17 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.542 2.828 . . . . 0.0 114.846 -178.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 27.6 m -83.72 -26.01 30.12 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 -175.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 10.2 p -71.06 145.92 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 124.324 1.05 . . . . 0.0 112.193 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -134.93 153.83 78.85 Favored Pre-proline 0 CA--C 1.549 0.904 0 C-N-CA 125.443 1.497 . . . . 0.0 111.644 179.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -58.5 -44.52 36.81 Favored 'Trans proline' 0 CA--C 1.547 1.162 0 C-N-CA 123.503 2.802 . . . . 0.0 118.193 -177.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -81.11 163.27 20.18 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.897 2.398 . . . . 0.0 114.619 -176.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 8.0 tt -74.91 144.23 43.39 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.76 1.224 . . . . 0.0 111.284 176.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 39.4 t -99.93 146.54 26.56 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.254 1.422 . . . . 0.0 112.247 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 9.1 pm0 -59.43 -24.36 63.43 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -63.06 -27.1 69.17 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.556 -0.715 . . . . 0.0 112.065 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 90.8 m -67.83 -60.0 2.86 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.357 1.063 . . . . 0.0 110.122 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.19 -30.88 69.64 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 175.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 22.9 t -70.13 -33.65 72.09 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.5 t70 -90.15 -26.13 20.33 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.849 -1.157 . . . . 0.0 113.437 174.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -42.63 -58.02 2.47 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.891 2.076 . . . . 0.0 113.106 -179.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 45.3 p-90 -70.52 -11.91 61.23 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -172.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 50.4 pttt -112.03 -60.27 1.88 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -177.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 58.2 mt -120.21 18.59 12.28 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 116.65 2.092 . . . . 0.0 116.65 -172.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 5.4 tt -52.58 133.67 45.12 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 125.266 1.426 . . . . 0.0 113.595 -178.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.26 163.22 38.7 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 124.357 3.371 . . . . 0.0 114.209 -177.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 30.7 mp0 -59.67 -15.99 23.34 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 126.026 1.731 . . . . 0.0 115.203 -177.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 55.2 t30 -134.82 138.19 44.02 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.441 1.496 . . . . 0.0 110.844 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -150.34 151.42 32.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.56 1.544 . . . . 0.0 110.571 178.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 8.8 p -67.98 -29.24 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 55.5 tp -92.0 110.1 21.45 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.324 1.05 . . . . 0.0 111.012 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 22.7 t -115.23 99.82 52.84 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 124.076 0.95 . . . . 0.0 110.103 172.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -83.94 105.02 1.12 Allowed 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.507 2.805 . . . . 0.0 111.06 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 82.4 mt -75.05 152.92 86.54 Favored Pre-proline 0 CA--C 1.546 0.811 0 O-C-N 121.415 -0.803 . . . . 0.0 112.275 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.75 -28.87 68.88 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 123.225 2.617 . . . . 0.0 114.172 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 40.2 p -75.19 -22.06 58.27 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.647 1.579 . . . . 0.0 113.228 176.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -95.01 -29.76 14.45 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.283 1.833 . . . . 0.0 111.538 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -64.95 155.06 35.71 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.333 1.453 . . . . 0.0 112.754 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 65.5 mtm -90.15 28.49 1.4 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.559 1.543 . . . . 0.0 113.744 -178.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 35.1 t70 -56.71 -22.06 32.38 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -178.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.1 t70 -63.77 -18.01 63.63 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 121.126 -0.984 . . . . 0.0 112.88 176.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 22.7 tp -111.07 12.43 22.0 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 127.077 2.151 . . . . 0.0 111.923 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 7.7 tpt -71.95 154.65 41.06 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -176.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 25.7 mt -124.26 169.81 11.39 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.503 2.321 . . . . 0.0 112.546 -176.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.2 m -76.92 151.44 82.06 Favored Pre-proline 0 CA--C 1.544 0.729 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 169.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -60.07 -14.59 29.13 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 123.086 2.524 . . . . 0.0 115.264 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.0 t70 -78.96 -19.17 52.36 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 120.916 -1.115 . . . . 0.0 112.978 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -81.65 -13.31 58.08 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.356 1.062 . . . . 0.0 113.081 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 91.3 mt -54.84 -36.93 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.471 1.509 . . . . 0.0 111.495 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -76.1 -9.91 59.0 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -84.53 -25.09 29.01 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.138 0.975 . . . . 0.0 113.526 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -72.27 -44.19 63.17 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.556 1.071 . . . . 0.0 112.301 -178.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -80.2 109.83 15.04 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 178.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 1.2 m -74.86 137.31 41.71 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.068 0.947 . . . . 0.0 113.053 -174.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -79.4 163.76 24.56 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.048 1.339 . . . . 0.0 112.338 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -68.78 145.89 97.16 Favored Pre-proline 0 CA--C 1.551 0.986 0 O-C-N 121.363 -0.836 . . . . 0.0 112.467 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -72.16 -24.28 20.33 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.116 2.544 . . . . 0.0 114.06 -179.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 70.43 -124.2 12.76 Favored Glycine 0 CA--C 1.544 1.849 0 CA-C-O 118.55 -1.139 . . . . 0.0 111.83 -178.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -72.28 -24.17 20.06 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.152 2.568 . . . . 0.0 115.265 -177.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 4.2 p30 -154.36 147.33 24.54 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.776 1.171 . . . . 0.0 113.416 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -83.99 15.42 38.19 Favored Glycine 0 CA--C 1.532 1.146 0 N-CA-C 116.747 1.459 . . . . 0.0 116.747 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 63.2 m -67.18 111.16 3.78 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 119.756 1.778 . . . . 0.0 109.317 177.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 20.0 p -72.07 160.44 32.48 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.018 1.727 . . . . 0.0 114.252 -175.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 29.5 p90 -147.35 -177.63 5.8 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.959 1.703 . . . . 0.0 112.327 -173.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 9.5 t30 -52.93 125.73 18.05 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 120.868 -1.145 . . . . 0.0 111.648 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . 94.95 -40.97 2.59 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.365 1.459 . . . . 0.0 113.072 -177.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 78.5 p -85.69 -47.25 9.96 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 118.994 1.397 . . . . 0.0 111.408 178.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -64.4 -29.02 70.09 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.603 1.161 . . . . 0.0 110.857 173.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 3.5 m -68.46 -20.67 64.63 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 126.736 2.014 . . . . 0.0 112.374 178.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 175.82 95.32 0.1 OUTLIER Glycine 0 CA--C 1.537 1.426 0 CA-C-O 118.464 -1.187 . . . . 0.0 114.01 178.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -63.62 179.21 1.03 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 124.076 3.184 . . . . 0.0 113.323 176.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 35.1 p -56.33 -26.41 52.3 Favored 'General case' 0 N--CA 1.482 1.172 0 O-C-N 120.768 -1.208 . . . . 0.0 114.171 178.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -90.66 -0.36 57.66 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.417 1.487 . . . . 0.0 114.28 178.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.22 125.01 91.9 Favored Pre-proline 0 CA--C 1.55 0.944 0 O-C-N 120.868 -1.145 . . . . 0.0 112.061 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.02 -34.78 13.08 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.753 2.302 . . . . 0.0 113.779 -177.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -67.53 -37.88 83.38 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 120.933 -1.104 . . . . 0.0 111.337 179.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -59.12 -39.27 81.78 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.256 -0.902 . . . . 0.0 110.697 174.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -42.37 93.79 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.783 0.833 . . . . 0.0 111.136 174.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -58.84 -40.36 83.99 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.037 0.835 . . . . 0.0 111.289 174.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.8 -36.68 83.94 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 118.395 -0.812 . . . . 0.0 111.676 177.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -67.36 -55.14 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 119.216 0.916 . . . . 0.0 109.479 174.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -49.68 -52.33 31.85 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.687 1.195 . . . . 0.0 111.51 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 4.0 pp0? -65.22 -36.77 85.18 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 112.924 0.712 . . . . 0.0 112.924 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -69.69 -46.0 67.03 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.061 0.846 . . . . 0.0 110.139 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.11 -41.44 96.7 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.756 1.222 . . . . 0.0 111.156 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 83.8 t -60.15 -32.45 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-N 119.44 1.018 . . . . 0.0 110.937 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.37 -29.14 62.44 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.17 -0.956 . . . . 0.0 113.18 176.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -62.15 -37.45 85.26 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.445 1.02 . . . . 0.0 108.692 171.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.2 mt -65.59 -49.17 69.78 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.659 0.784 . . . . 0.0 110.077 177.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 28.5 t60 -56.58 -54.58 44.25 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 118.702 -0.666 . . . . 0.0 110.228 177.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.36 -46.27 66.09 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 118.603 0.638 . . . . 0.0 112.035 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -64.51 -45.2 88.26 Favored 'General case' 0 C--N 1.345 0.373 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 58.4 mttm -69.4 -25.34 64.09 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.688 1.195 . . . . 0.0 113.054 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.8 t -80.68 -52.26 7.75 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 127.11 2.164 . . . . 0.0 110.654 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -59.93 -41.06 90.97 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.202 -1.561 . . . . 0.0 112.791 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.25 -32.02 69.67 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 121.47 -0.769 . . . . 0.0 112.33 175.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -66.49 -39.23 88.62 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.85 1.26 . . . . 0.0 110.695 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 7.8 tm-20 -70.96 -46.73 61.87 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 174.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -57.66 -34.39 69.33 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.879 0.871 . . . . 0.0 112.79 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -69.52 -13.93 62.6 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.692 1.197 . . . . 0.0 113.96 177.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -115.9 -47.65 2.78 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.55 1.54 . . . . 0.0 113.196 -178.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 76.26 -0.12 64.52 Favored Glycine 0 CA--C 1.539 1.533 0 N-CA-C 117.206 1.642 . . . . 0.0 117.206 178.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -122.6 -32.58 3.56 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 119.925 1.862 . . . . 0.0 114.284 -178.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 27.1 m -70.92 154.63 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.985 0.914 . . . . 0.0 112.873 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 58.1 ttt85 -85.01 134.76 34.22 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.704 1.202 . . . . 0.0 111.052 178.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -81.84 172.22 13.58 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.297 1.039 . . . . 0.0 112.743 178.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 2.4 m -53.65 138.38 34.97 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.579 1.552 . . . . 0.0 114.542 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 61.7 p -89.05 -9.54 50.82 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.627 1.571 . . . . 0.0 111.689 172.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 30.0 tp -59.68 112.4 5.24 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 128.468 2.707 . . . . 0.0 110.298 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -55.03 -38.37 93.43 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.378 2.719 . . . . 0.0 114.886 -176.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -69.44 -34.41 74.39 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.5 t -68.38 -50.42 53.12 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.906 1.282 . . . . 0.0 109.035 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -55.29 -39.07 69.43 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.028 1.331 . . . . 0.0 111.582 174.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 21.5 m -67.39 -57.43 6.59 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.459 1.104 . . . . 0.0 111.063 176.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.9 mmt -62.03 -37.07 83.54 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -177.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -65.23 -37.14 86.34 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.319 1.418 . . . . 0.0 113.053 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -65.14 -39.06 92.48 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 122.653 0.381 . . . . 0.0 110.539 175.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 96.9 t -65.12 -48.08 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 123.058 0.543 . . . . 0.0 110.459 175.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -39.35 92.23 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.161 0.984 . . . . 0.0 112.449 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 43.9 m-20 -61.31 -39.05 89.06 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.461 0.704 . . . . 0.0 111.501 175.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.2 t60 -78.75 -50.08 11.96 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.197 0.999 . . . . 0.0 111.733 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -56.84 -32.88 66.21 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.832 1.653 . . . . 0.0 114.116 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 6.6 t -72.71 -15.07 61.69 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 119.91 1.232 . . . . 0.0 112.818 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 81.7 t60 -105.27 -28.99 10.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.897 1.679 . . . . 0.0 112.639 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 30.4 t -58.5 144.77 41.32 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.105 1.762 . . . . 0.0 112.836 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -117.9 -12.25 10.18 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.602 1.561 . . . . 0.0 113.726 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -91.21 -27.16 18.65 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.209 1.004 . . . . 0.0 112.175 178.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.48 -112.33 2.32 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.764 1.173 . . . . 0.0 112.75 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.3 mttt -61.49 -19.57 62.21 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 121.588 -0.948 . . . . 0.0 113.417 178.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.85 -2.44 47.43 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.179 1.391 . . . . 0.0 113.625 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 18.1 t -59.93 144.46 48.93 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 122.323 1.058 . . . . 0.0 110.737 178.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -79.03 -8.3 58.83 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.463 1.105 . . . . 0.0 113.17 -176.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 97.6 t -89.99 115.01 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 173.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.66 -38.84 70.14 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -176.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -67.39 -37.99 83.99 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.796 0.838 . . . . 0.0 112.461 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 43.0 t -66.08 -56.63 10.55 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.687 1.595 . . . . 0.0 109.536 176.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -56.84 -31.44 64.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.389 1.076 . . . . 0.0 112.968 177.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.5 m -77.01 -49.89 14.36 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.027 0.931 . . . . 0.0 112.351 177.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 70.8 m -60.08 -36.0 76.42 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 121.529 -0.732 . . . . 0.0 111.6 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -58.87 -33.03 70.01 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.132 0.973 . . . . 0.0 112.782 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -67.09 -32.75 74.12 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 118.876 0.762 . . . . 0.0 111.671 177.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 1.7 mt -76.39 -45.42 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 123.289 0.636 . . . . 0.0 109.816 177.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 35.7 mm -60.57 -37.66 75.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.268 1.027 . . . . 0.0 110.735 176.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 22.7 t -58.14 -29.9 65.91 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.328 1.051 . . . . 0.0 112.252 176.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.3 t60 -63.94 -52.84 57.89 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.161 0.891 . . . . 0.0 109.995 176.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 39.1 m95 -61.74 -30.28 70.67 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 10.7 mtpm? -70.88 -28.61 64.69 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.458 0.703 . . . . 0.0 112.758 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -100.11 -38.12 8.67 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.951 1.464 . . . . 0.0 114.951 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.6 t -78.23 134.64 37.55 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.474 1.51 . . . . 0.0 112.929 -176.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 79.9 p -130.09 -1.67 4.6 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.646 1.578 . . . . 0.0 114.242 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 22.9 ttt-85 -83.07 145.68 29.13 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.193 1.397 . . . . 0.0 112.683 -177.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 41.9 p-80 -78.06 -30.11 49.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.509 0.724 . . . . 0.0 112.35 176.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 20.7 t0 -103.1 84.16 2.31 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.044 1.738 . . . . 0.0 111.316 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 46.8 t -139.67 135.79 17.06 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 126.85 2.06 . . . . 0.0 108.468 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -57.47 -27.48 76.44 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.17 2.58 . . . . 0.0 115.383 -176.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 16.6 t -92.14 -49.86 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 CA-C-N 119.805 1.184 . . . . 0.0 111.387 176.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 4.1 m -69.54 -39.91 77.17 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -174.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.1 tt -55.09 -57.02 21.88 Favored Pre-proline 0 N--CA 1.475 0.804 0 CA-C-O 117.748 -1.12 . . . . 0.0 112.934 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.54 -31.08 91.94 Favored 'Trans proline' 0 C--N 1.354 0.824 0 CA-C-N 121.682 1.636 . . . . 0.0 113.082 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.8 mt -70.55 -45.13 66.04 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.211 0.914 . . . . 0.0 111.601 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 60.1 mttm -60.99 -37.65 83.25 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.423 1.089 . . . . 0.0 110.898 175.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 20.4 t30 -73.3 -41.56 63.42 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.354 1.461 . . . . 0.0 112.745 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -73.06 -34.14 66.07 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.05 0.94 . . . . 0.0 113.453 -179.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 32.1 t -71.26 138.79 49.7 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 118.414 0.552 . . . . 0.0 112.409 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 25.7 t70 -85.84 -6.69 59.05 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.397 0.679 . . . . 0.0 112.155 176.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 28.4 tptp -80.39 52.78 1.68 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.28 2.232 . . . . 0.0 110.701 178.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 11.0 ptm85 . . . . . 0 N--CA 1.476 0.828 0 C-N-CA 126.639 1.976 . . . . 0.0 112.897 -176.953 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.442 0 N-CA-C 114.178 0.431 . . . . 0.0 114.178 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.7 p -153.71 168.05 27.57 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.167 1.387 . . . . 0.0 111.975 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -61.71 -18.54 60.07 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 49.6 ttm -67.32 -21.86 65.64 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.96 1.304 . . . . 0.0 113.44 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -81.61 -15.59 54.19 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.014 -1.054 . . . . 0.0 113.403 178.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -63.45 -55.74 32.68 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-O 117.542 -1.218 . . . . 0.0 113.282 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.54 -24.89 62.91 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 122.065 1.843 . . . . 0.0 112.492 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -77.68 -13.35 59.93 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.538 1.135 . . . . 0.0 112.582 176.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 68.1 m -90.72 -16.97 27.54 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.781 1.232 . . . . 0.0 113.141 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -139.22 45.82 0.99 Allowed Pre-proline 0 CA--C 1.558 1.285 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -68.97 -15.71 40.28 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.406 2.737 . . . . 0.0 114.045 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 17.7 m -76.81 -1.27 27.37 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.593 1.557 . . . . 0.0 114.895 -178.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 13.7 p -138.54 149.45 24.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.275 1.43 . . . . 0.0 111.891 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -125.47 111.39 25.81 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 125.263 1.425 . . . . 0.0 109.934 179.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -56.22 -43.98 50.97 Favored 'Trans proline' 0 CA--C 1.55 1.32 0 C-N-CA 123.747 2.965 . . . . 0.0 117.253 -179.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -77.05 160.02 33.6 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 122.504 2.136 . . . . 0.0 113.68 -178.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 6.9 tt -73.78 137.22 43.76 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.843 1.257 . . . . 0.0 111.58 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 36.9 t -88.22 146.34 25.41 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.672 1.189 . . . . 0.0 111.407 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 12.3 tm0? -53.54 -34.51 58.45 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.691 1.196 . . . . 0.0 113.618 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -71.04 -14.11 62.22 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.117 0.967 . . . . 0.0 113.385 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 19.3 m -61.7 -57.26 12.67 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.925 -1.11 . . . . 0.0 109.871 178.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.6 m-85 -60.28 -29.15 68.63 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.408 0.683 . . . . 0.0 112.277 174.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 35.9 m -68.01 -34.62 76.85 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.231 0.923 . . . . 0.0 112.916 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.4 t70 -90.03 -30.29 17.84 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.218 1.007 . . . . 0.0 113.136 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.1 tt -43.4 -58.38 2.6 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.105 2.162 . . . . 0.0 113.168 -178.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 44.5 p-90 -71.08 -11.45 60.96 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 -173.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -110.1 -60.08 1.84 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 116.312 1.967 . . . . 0.0 116.312 -175.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 77.9 mt -120.28 16.78 12.3 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 116.665 2.098 . . . . 0.0 116.665 -172.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 6.1 tt -54.68 130.6 64.56 Favored Pre-proline 0 CA--C 1.554 1.127 0 C-N-CA 125.243 1.417 . . . . 0.0 113.349 -178.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -79.42 -179.95 5.83 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 125.016 3.81 . . . . 0.0 114.26 -177.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -65.69 -10.04 33.02 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 115.586 1.699 . . . . 0.0 115.586 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 50.1 t30 -136.02 134.0 38.04 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.105 1.362 . . . . 0.0 110.799 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -146.74 158.0 43.81 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.546 1.138 . . . . 0.0 112.219 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 29.2 m -70.46 -25.4 26.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.853 1.261 . . . . 0.0 114.176 179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 1.6 tt -97.6 111.52 23.76 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.879 1.271 . . . . 0.0 109.191 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 66.3 m -115.0 99.97 53.02 Favored Pre-proline 0 N--CA 1.475 0.785 0 C-N-CA 124.236 1.014 . . . . 0.0 112.165 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -79.97 169.11 18.25 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.934 3.089 . . . . 0.0 111.912 177.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 24.4 tp -144.63 136.97 13.3 Favored Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 124.886 1.275 . . . . 0.0 111.064 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -54.59 -35.42 86.24 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.273 2.649 . . . . 0.0 113.963 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 14.7 m -64.79 -13.64 56.2 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.812 1.245 . . . . 0.0 113.803 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -111.98 2.58 16.96 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.219 1.808 . . . . 0.0 112.623 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.56 142.91 48.45 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.217 -0.927 . . . . 0.0 112.312 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 65.2 mtm -87.39 48.75 1.69 Allowed 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.389 1.476 . . . . 0.0 112.774 -179.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 32.6 t70 -59.36 -22.61 61.59 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.446 1.098 . . . . 0.0 113.396 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -64.71 -19.96 66.06 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.176 1.39 . . . . 0.0 113.517 175.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 85.8 mt -115.5 -0.38 13.09 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.199 1.799 . . . . 0.0 113.756 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 68.0 mmm -66.03 148.07 52.37 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -177.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.05 178.18 5.67 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.688 1.995 . . . . 0.0 111.372 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 74.4 m -89.02 152.85 48.82 Favored Pre-proline 0 CA--C 1.546 0.791 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 169.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.74 -18.56 49.14 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 122.546 2.164 . . . . 0.0 115.781 -176.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -76.47 -17.08 59.48 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.04 -1.038 . . . . 0.0 112.596 177.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -82.79 -12.44 57.48 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.313 1.045 . . . . 0.0 112.535 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 96.4 mt -59.07 -35.88 59.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.869 1.268 . . . . 0.0 110.753 178.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -73.32 -9.8 59.08 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.811 1.244 . . . . 0.0 113.265 178.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -79.6 -20.72 46.19 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.964 0.906 . . . . 0.0 111.138 175.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.8 p-90 -109.92 -49.68 3.06 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.437 1.095 . . . . 0.0 113.033 177.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -81.08 109.83 16.02 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 170.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 4.2 m -122.67 138.62 54.55 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.237 1.015 . . . . 0.0 112.9 -171.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -97.82 170.65 8.82 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.578 1.551 . . . . 0.0 111.011 176.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 9.9 t70 -62.5 120.38 58.85 Favored Pre-proline 0 CA--C 1.556 1.191 0 O-C-N 120.93 -1.106 . . . . 0.0 110.39 178.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -83.37 -4.13 10.91 Favored 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 123.461 2.774 . . . . 0.0 115.181 -175.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 58.65 -118.78 14.88 Favored Glycine 0 CA--C 1.541 1.709 0 CA-C-O 118.805 -0.997 . . . . 0.0 112.359 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -75.72 -8.92 19.59 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 123.723 2.949 . . . . 0.0 113.984 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -101.42 -174.75 2.67 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.607 1.563 . . . . 0.0 112.419 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 76.83 -7.47 34.29 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 125.088 1.328 . . . . 0.0 115.948 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 64.4 p -80.14 -0.97 38.23 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.78 1.632 . . . . 0.0 114.479 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 84.7 m -61.09 -23.68 65.66 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.986 1.714 . . . . 0.0 113.61 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -136.67 167.68 20.95 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.176 1.79 . . . . 0.0 110.628 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 26.9 m120 -74.88 -60.39 2.31 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.54 -0.725 . . . . 0.0 111.942 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -55.44 -36.2 63.05 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.16 0.886 . . . . 0.0 115.176 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 39.5 p -69.3 -10.43 57.81 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.271 1.028 . . . . 0.0 113.741 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -119.35 -33.01 4.21 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.369 1.468 . . . . 0.0 113.888 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 74.7 p -84.13 -29.83 26.39 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 168.55 83.78 0.05 OUTLIER Glycine 0 CA--C 1.534 1.233 0 C-N-CA 124.237 0.923 . . . . 0.0 112.108 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -55.5 -38.49 93.99 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.523 2.816 . . . . 0.0 115.215 -176.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 35.5 p -86.33 4.68 38.1 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.58 1.552 . . . . 0.0 115.179 -177.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -70.11 -18.81 63.26 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 15.9 t70 -76.49 129.37 79.93 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 123.935 0.894 . . . . 0.0 112.093 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.7 -38.29 14.28 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.092 2.528 . . . . 0.0 114.465 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -65.56 -35.13 79.94 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.128 -0.983 . . . . 0.0 110.659 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -62.92 -34.89 78.41 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.302 -0.874 . . . . 0.0 111.495 175.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 96.9 mtm-85 -69.12 -33.28 73.22 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.427 -0.796 . . . . 0.0 111.181 174.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -65.36 -33.24 75.5 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 118.826 0.739 . . . . 0.0 111.367 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.44 -36.36 83.49 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 118.872 0.76 . . . . 0.0 111.052 175.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.7 mt -67.01 -52.96 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 118.551 0.614 . . . . 0.0 109.63 175.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -51.94 -56.07 16.44 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.848 0.859 . . . . 0.0 111.443 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -36.05 83.05 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.0 tp60 -70.96 -41.76 70.63 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 119.234 0.925 . . . . 0.0 110.393 178.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.9 tt -62.18 -40.86 97.47 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.578 0.751 . . . . 0.0 109.919 177.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 97.1 t -59.62 -33.37 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.13 0.877 . . . . 0.0 110.942 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.0 tp -73.23 -25.55 60.78 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.875 1.216 . . . . 0.0 113.835 175.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -62.72 -30.19 71.23 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.788 1.176 . . . . 0.0 109.044 172.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.3 mt -72.95 -54.38 8.81 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.118 0.967 . . . . 0.0 108.513 174.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 20.4 t60 -49.4 -55.87 11.55 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.678 0.672 . . . . 0.0 111.273 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -57.65 -22.96 48.75 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -90.04 -24.65 21.12 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -88.0 -41.54 13.05 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 119.843 1.201 . . . . 0.0 112.211 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 25.4 t -59.59 -41.61 90.65 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.107 1.363 . . . . 0.0 111.108 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -61.99 -27.71 69.06 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 120.651 -1.281 . . . . 0.0 113.055 174.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -83.2 -30.07 28.03 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.738 1.215 . . . . 0.0 112.18 178.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -57.52 -38.6 74.92 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.561 1.144 . . . . 0.0 110.026 174.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -69.43 -51.36 37.09 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.381 1.072 . . . . 0.0 111.279 175.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 16.2 tp60 -63.97 -35.08 79.53 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -70.77 -24.6 62.62 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.269 1.028 . . . . 0.0 113.104 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -100.18 -42.55 6.65 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.496 1.518 . . . . 0.0 112.957 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 84.06 -4.83 82.08 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 125.686 1.612 . . . . 0.0 116.879 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -125.23 -36.94 2.45 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 119.943 1.872 . . . . 0.0 114.136 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 32.7 m -73.64 158.08 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.059 0.944 . . . . 0.0 113.307 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -107.1 172.58 6.75 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.142 1.777 . . . . 0.0 112.403 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -68.95 169.55 11.45 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.327 1.451 . . . . 0.0 113.354 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 16.5 p -70.05 176.02 4.08 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 125.589 1.556 . . . . 0.0 113.756 179.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 74.1 p -85.23 -2.59 58.21 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -178.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 41.1 tp -80.42 117.84 69.61 Favored Pre-proline 0 CA--C 1.553 1.076 0 C-N-CA 125.128 1.371 . . . . 0.0 111.521 -178.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.25 -29.27 47.0 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 122.145 1.896 . . . . 0.0 112.823 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 39.0 m80 -64.72 -32.65 74.42 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.291 -0.881 . . . . 0.0 113.053 178.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 30.8 t -64.16 -50.05 69.71 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.643 1.177 . . . . 0.0 109.752 176.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -53.92 -43.58 69.87 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.222 1.409 . . . . 0.0 111.015 174.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 19.4 m -64.02 -55.34 22.99 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.699 0.8 . . . . 0.0 111.787 176.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.7 mmt -65.0 -34.64 78.92 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -67.37 -34.94 78.33 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 121.142 1.792 . . . . 0.0 112.081 178.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -66.19 -37.82 86.54 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.214 0.461 . . . . 0.0 110.46 174.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 78.7 t -64.96 -52.17 57.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 123.49 0.716 . . . . 0.0 110.448 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.11 -44.86 87.91 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.722 1.209 . . . . 0.0 112.666 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 37.7 m-20 -66.41 -20.39 66.05 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.562 0.745 . . . . 0.0 112.653 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 63.7 t60 -90.17 -50.92 5.72 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.362 1.065 . . . . 0.0 109.933 172.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.1 ttp -54.99 -34.53 63.49 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.646 1.978 . . . . 0.0 113.474 -177.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 14.8 t -64.12 -27.33 69.01 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 119.276 0.944 . . . . 0.0 112.403 177.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 41.6 m80 -98.28 -26.25 14.58 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.362 1.465 . . . . 0.0 113.302 177.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 49.6 t -63.38 132.49 51.63 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.509 1.523 . . . . 0.0 112.889 -178.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -106.67 -14.15 15.1 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.38 1.472 . . . . 0.0 113.717 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -84.31 -32.96 24.04 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.283 0.947 . . . . 0.0 111.216 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.55 -106.55 0.32 Allowed Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.066 1.317 . . . . 0.0 113.188 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.74 -21.56 63.11 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.753 -0.851 . . . . 0.0 113.2 177.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -97.86 -2.66 40.31 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.639 1.576 . . . . 0.0 113.571 177.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.8 t -60.13 144.59 49.44 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 122.304 1.049 . . . . 0.0 110.612 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -81.26 -10.06 59.66 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.962 1.305 . . . . 0.0 113.234 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 98.2 t -89.16 115.98 29.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 174.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.32 -41.46 72.44 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -64.08 -42.16 97.05 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.478 0.711 . . . . 0.0 112.389 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.7 t -63.12 -53.37 54.52 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.033 1.333 . . . . 0.0 109.974 176.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -56.06 -38.86 71.21 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.97 0.908 . . . . 0.0 112.375 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 25.5 m -67.06 -53.37 31.68 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.975 0.91 . . . . 0.0 113.135 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.8 m -59.34 -26.95 65.48 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.162 0.892 . . . . 0.0 112.823 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.6 -31.5 71.57 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 118.335 -0.841 . . . . 0.0 112.229 175.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -65.93 -38.67 89.25 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.921 1.237 . . . . 0.0 110.89 174.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 9.4 mt -68.39 -48.15 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.129 0.972 . . . . 0.0 110.323 179.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 16.8 mm -62.13 -36.29 73.49 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 123.918 0.887 . . . . 0.0 111.232 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 71.9 m -61.63 -23.71 66.22 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 176.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.7 t60 -64.58 -56.46 13.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.584 1.084 . . . . 0.0 110.268 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 55.5 m95 -61.21 -29.35 69.77 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -70.28 -30.29 67.27 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.939 0.896 . . . . 0.0 112.782 177.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -100.06 -38.91 8.36 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.2 t -80.07 133.4 36.11 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.483 1.513 . . . . 0.0 112.611 -176.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 71.7 p -130.0 1.61 4.78 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.929 1.692 . . . . 0.0 113.893 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -75.91 154.71 35.79 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.273 1.429 . . . . 0.0 113.299 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 18.8 t60 -88.26 -39.2 14.61 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.588 0.755 . . . . 0.0 110.365 172.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 20.1 t0 -94.96 80.49 3.66 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.915 1.686 . . . . 0.0 111.374 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.5 t -134.97 135.45 23.11 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.736 2.014 . . . . 0.0 109.123 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -59.05 -25.18 76.87 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.751 2.3 . . . . 0.0 114.153 -178.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.7 t -92.16 -52.97 9.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 119.817 1.189 . . . . 0.0 111.618 176.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 9.0 m -68.61 -37.73 80.02 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.235 1.569 . . . . 0.0 115.235 -174.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -56.27 -57.53 22.17 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-O 117.63 -1.176 . . . . 0.0 112.8 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -61.08 -31.62 90.9 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 121.933 1.755 . . . . 0.0 113.411 179.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 93.3 mt -68.13 -48.49 65.25 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.888 0.767 . . . . 0.0 111.175 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -63.95 -35.79 81.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.753 0.821 . . . . 0.0 111.37 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 49.4 t30 -64.51 -46.72 81.72 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.525 1.13 . . . . 0.0 110.894 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -69.01 -31.0 69.51 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.901 0.88 . . . . 0.0 112.515 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 9.9 m -96.25 26.68 4.13 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.555 1.942 . . . . 0.0 113.728 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 27.4 t0 -74.82 77.37 2.11 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.451 1.1 . . . . 0.0 111.178 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 21.2 pttp -58.31 -7.53 0.89 Allowed 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 128.623 2.769 . . . . 0.0 118.218 -175.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 . . . . . 0 N--CA 1.482 1.142 0 CA-C-N 119.952 1.251 . . . . 0.0 113.906 -178.45 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.381 0 N-CA-C 113.95 0.34 . . . . 0.0 113.95 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.5 t -143.29 151.21 40.26 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.949 1.299 . . . . 0.0 112.38 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -63.0 -27.14 69.21 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.508 1.123 . . . . 0.0 112.532 176.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 92.8 mmm -97.5 9.47 42.34 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.653 1.581 . . . . 0.0 113.542 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -70.01 128.95 38.12 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.07 -1.019 . . . . 0.0 112.481 -179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -154.72 152.54 25.95 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 125.52 1.528 . . . . 0.0 111.515 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.96 145.32 67.52 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.014 2.476 . . . . 0.0 111.763 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -75.4 -35.23 61.06 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 55.4 m -144.8 152.48 40.38 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.374 1.47 . . . . 0.0 112.041 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -146.09 142.01 17.21 Favored Pre-proline 0 CA--C 1.546 0.808 0 C-N-CA 125.702 1.601 . . . . 0.0 110.451 177.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 30.9 Cg_exo -64.79 -32.16 56.71 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.624 2.216 . . . . 0.0 114.412 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 41.6 m -84.4 65.4 8.89 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.813 1.645 . . . . 0.0 112.893 -177.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 10.3 p -140.32 139.49 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.662 1.185 . . . . 0.0 111.881 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -120.19 84.31 33.75 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 125.786 1.634 . . . . 0.0 110.093 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -62.67 -36.21 64.85 Favored 'Trans proline' 0 CA--C 1.549 1.238 0 C-N-CA 122.676 2.25 . . . . 0.0 117.411 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -84.51 154.69 12.13 Favored 'Trans proline' 0 C--N 1.355 0.891 0 CA-C-N 123.629 2.332 . . . . 0.0 113.177 -179.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 8.9 tt -71.0 141.0 50.99 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.974 0.909 . . . . 0.0 110.92 176.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 42.3 t -123.02 159.22 28.85 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 126.41 1.884 . . . . 0.0 109.408 175.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -60.52 -26.69 67.04 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 121.358 -0.839 . . . . 0.0 110.886 175.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -84.32 -11.55 56.17 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.064 1.346 . . . . 0.0 113.666 177.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 86.6 m -60.48 -60.04 4.43 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 119.718 1.145 . . . . 0.0 111.25 -178.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -60.11 -29.54 68.67 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.403 0.681 . . . . 0.0 112.602 176.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 70.5 m -71.04 -31.09 67.46 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.888 0.875 . . . . 0.0 113.215 178.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.1 t70 -90.05 -31.14 17.29 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.811 1.244 . . . . 0.0 112.826 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.8 tt -42.59 -60.02 1.69 Allowed 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 127.665 2.386 . . . . 0.0 113.489 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.4 p-90 -70.18 -11.36 60.84 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 115.272 1.582 . . . . 0.0 115.272 -174.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -111.5 -60.03 1.9 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 116.034 1.864 . . . . 0.0 116.034 -175.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 6.6 mp -120.18 20.21 12.07 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -174.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 3.0 tt -52.06 135.25 39.21 Favored Pre-proline 0 N--CA 1.476 0.829 0 C-N-CA 124.979 1.311 . . . . 0.0 114.137 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -66.19 164.62 27.21 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 124.035 3.157 . . . . 0.0 112.779 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -73.03 -2.94 23.15 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -177.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 49.9 t30 -129.36 134.13 47.73 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.567 1.547 . . . . 0.0 109.66 176.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -149.82 160.4 43.59 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.948 0.899 . . . . 0.0 112.664 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 10.0 p -111.67 -16.41 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 125.653 1.581 . . . . 0.0 113.475 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -87.49 33.9 0.7 Allowed 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.821 2.048 . . . . 0.0 112.095 -179.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 24.0 m -94.63 110.5 49.51 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 125.112 1.365 . . . . 0.0 112.626 -176.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -76.3 128.56 10.56 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.73 2.287 . . . . 0.0 111.098 179.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 21.1 tp -76.34 133.22 71.69 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.513 1.125 . . . . 0.0 111.77 -178.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -52.04 -32.75 49.99 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 123.808 3.005 . . . . 0.0 115.18 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 24.7 m -60.88 -19.85 60.96 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 23.3 mp0 -131.47 20.26 4.75 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.702 1.601 . . . . 0.0 111.894 177.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -75.62 156.48 34.85 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.73 17.68 3.24 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 128.49 2.716 . . . . 0.0 113.724 178.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 37.4 t70 -61.71 -22.68 65.57 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.566 1.546 . . . . 0.0 114.663 -176.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.1 t70 -65.57 -16.28 63.55 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 21.3 tp -108.5 14.57 24.55 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 126.139 1.775 . . . . 0.0 113.128 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 76.5 mmm -66.33 155.37 37.48 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 -177.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.07 167.18 15.12 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.071 2.148 . . . . 0.0 114.984 -178.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 88.2 p -91.58 162.26 32.02 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 127.202 2.201 . . . . 0.0 108.749 169.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -62.78 -24.56 74.6 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.023 1.815 . . . . 0.0 113.327 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.0 t70 -63.54 -29.12 70.43 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.756 0.823 . . . . 0.0 112.944 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 11.5 t70 -90.12 -17.58 27.42 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 75.5 mt -59.88 -38.33 75.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 CA-C-N 119.792 1.178 . . . . 0.0 110.942 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . 0.304 0.0 OUTLIER -67.98 -9.82 48.56 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 176.628 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -79.37 -29.84 42.3 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.105 -0.997 . . . . 0.0 111.77 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.27 15.0 p-90 -101.13 -13.0 18.35 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 178.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -134.5 109.84 8.98 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 105.866 -1.901 . . . . 0.0 105.866 169.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 2.7 m -125.18 150.02 47.36 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.003 0.921 . . . . 0.0 113.05 -174.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.67 178.92 7.81 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.923 1.289 . . . . 0.0 111.221 175.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 13.3 t70 -60.42 127.31 86.38 Favored Pre-proline 0 CA--C 1.557 1.23 0 O-C-N 120.854 -1.154 . . . . 0.0 111.427 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -81.47 1.63 9.13 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 124.074 3.183 . . . . 0.0 115.955 -175.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 85.22 170.56 47.31 Favored Glycine 0 CA--C 1.54 1.634 0 C-N-CA 125.449 1.499 . . . . 0.0 113.386 -177.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -64.87 -22.14 63.57 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.725 2.95 . . . . 0.0 113.907 -178.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -95.8 -2.16 48.17 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.451 1.501 . . . . 0.0 113.536 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 63.78 31.37 80.56 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 124.438 1.018 . . . . 0.0 114.312 -179.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 23.2 t -51.2 -54.79 22.25 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.788 1.294 . . . . 0.0 113.531 -176.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 77.6 m -69.87 -29.75 67.05 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.226 0.61 . . . . 0.0 112.537 179.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 58.0 t80 -68.97 -39.85 79.19 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.725 -0.609 . . . . 0.0 111.597 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -59.13 -25.93 64.29 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.422 -0.799 . . . . 0.0 112.046 176.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -79.31 -8.32 87.88 Favored Glycine 0 CA--C 1.54 1.642 0 C-N-CA 124.875 1.226 . . . . 0.0 114.853 175.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 4.7 t -136.1 0.1 2.57 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -178.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -56.18 -21.6 23.95 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.287 1.435 . . . . 0.0 114.821 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 10.7 t -69.87 -20.38 63.4 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.769 1.228 . . . . 0.0 112.696 176.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -160.55 78.95 0.17 Allowed Glycine 0 CA--C 1.537 1.425 0 C-N-CA 125.788 1.661 . . . . 0.0 111.297 178.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -60.03 166.01 9.51 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.356 3.37 . . . . 0.0 115.067 -177.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 44.4 p -52.45 -31.56 35.22 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 125.918 1.687 . . . . 0.0 114.891 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -89.2 -2.05 58.33 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 14.1 t70 -64.45 140.32 97.95 Favored Pre-proline 0 CA--C 1.55 0.962 0 O-C-N 121.22 -0.925 . . . . 0.0 111.88 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -50.77 -36.87 53.2 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 123.515 2.81 . . . . 0.0 115.446 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -67.06 -40.5 87.1 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.193 -0.942 . . . . 0.0 110.772 176.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 14.2 mptt -67.12 -40.13 86.76 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.96 0.904 . . . . 0.0 110.387 177.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -55.79 -43.93 77.3 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 119.615 1.098 . . . . 0.0 111.586 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -60.71 -38.56 85.46 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.699 0.8 . . . . 0.0 111.582 176.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 93.2 mt -66.3 -38.79 88.54 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.36 0.664 . . . . 0.0 111.637 177.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -62.29 -54.57 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 119.027 0.83 . . . . 0.0 109.754 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -53.63 -55.57 24.72 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.818 1.247 . . . . 0.0 111.095 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -33.36 75.65 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -69.75 -46.56 65.59 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.809 1.186 . . . . 0.0 109.781 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 5.9 tp -59.22 -41.95 89.84 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.56 0.744 . . . . 0.0 111.195 177.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 63.4 t -59.08 -31.89 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-N 119.996 1.271 . . . . 0.0 111.485 176.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 5.8 tp -72.49 -31.42 65.38 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.707 -1.245 . . . . 0.0 112.871 175.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.0 mp -60.48 -31.14 70.18 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 120.249 1.386 . . . . 0.0 109.603 172.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.6 mt -71.1 -51.7 23.6 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.546 0.738 . . . . 0.0 109.975 176.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 21.6 t60 -56.29 -55.8 28.93 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.264 0.625 . . . . 0.0 111.071 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -50.39 -41.74 52.5 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.717 1.207 . . . . 0.0 114.004 -175.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -73.93 -44.44 55.04 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.212 0.915 . . . . 0.0 112.569 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 44.4 mttm -65.73 -43.13 89.96 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.364 1.066 . . . . 0.0 111.229 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 42.2 t -62.21 -47.35 84.83 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.196 1.798 . . . . 0.0 110.388 175.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -54.57 -46.39 73.68 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.302 -0.874 . . . . 0.0 112.881 177.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 48.7 mtp180 -82.12 -17.93 44.71 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 -178.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -62.65 -33.06 74.28 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 120.926 1.693 . . . . 0.0 111.777 177.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.62 -46.85 74.52 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.396 1.078 . . . . 0.0 110.337 176.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -64.72 -32.82 74.67 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.328 1.051 . . . . 0.0 112.619 178.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -69.69 -12.97 62.05 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 178.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -127.82 -43.89 1.51 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.649 1.18 . . . . 0.0 114.182 -175.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 77.96 -12.38 17.84 Favored Glycine 0 CA--C 1.541 1.697 0 N-CA-C 117.091 1.597 . . . . 0.0 117.091 178.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -104.13 -37.34 7.36 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.619 1.71 . . . . 0.0 112.133 178.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 22.1 m -76.91 170.85 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 124.513 1.125 . . . . 0.0 111.382 175.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 65.4 ttt-85 -127.39 148.23 50.27 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.461 1.504 . . . . 0.0 111.905 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -77.96 179.86 6.5 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.257 1.423 . . . . 0.0 112.448 177.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 3.7 m -56.26 148.12 19.27 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 67.0 m -95.74 -4.85 43.31 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.718 1.607 . . . . 0.0 110.652 169.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 38.3 tp -63.22 114.72 13.68 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 128.646 2.779 . . . . 0.0 111.175 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -54.98 -40.0 88.05 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.103 2.536 . . . . 0.0 114.961 -177.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 32.6 m80 -66.09 -37.07 84.87 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.005 0.82 . . . . 0.0 112.995 179.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 43.5 t -67.15 -51.45 53.69 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.292 1.437 . . . . 0.0 109.656 177.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -57.11 -34.93 68.85 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.912 1.285 . . . . 0.0 111.6 174.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.5 m -69.21 -60.97 1.99 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.239 1.016 . . . . 0.0 110.908 175.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.1 mmt -59.4 -35.34 73.78 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -177.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -66.56 -34.47 77.98 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 120.659 1.572 . . . . 0.0 112.722 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -69.73 -37.36 76.47 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.914 -0.491 . . . . 0.0 110.311 173.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 59.3 t -64.78 -40.84 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-O 118.966 -0.54 . . . . 0.0 110.264 175.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.94 -43.78 94.78 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.908 1.283 . . . . 0.0 111.014 175.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -63.7 -36.6 84.37 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.222 0.609 . . . . 0.0 112.006 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 63.5 t60 -74.72 -52.55 11.27 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.741 0.816 . . . . 0.0 110.687 177.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.3 ttp -58.24 -33.27 69.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.741 1.616 . . . . 0.0 113.668 -176.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 3.9 t -75.45 -10.06 59.12 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 119.657 1.117 . . . . 0.0 113.275 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 46.6 m80 -117.37 -16.72 10.24 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.761 1.625 . . . . 0.0 113.717 177.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 38.1 t -57.57 144.72 36.2 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.466 1.506 . . . . 0.0 112.946 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -103.77 -15.12 15.82 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.046 1.738 . . . . 0.0 113.564 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -106.94 -34.0 7.34 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.329 1.052 . . . . 0.0 112.448 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.5 -105.73 0.24 Allowed Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.828 1.204 . . . . 0.0 114.096 177.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -60.09 -21.9 62.07 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 121.133 -1.216 . . . . 0.0 112.828 177.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -100.78 0.2 38.32 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.272 1.829 . . . . 0.0 113.522 176.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 12.5 t -63.67 143.28 57.97 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 122.261 1.029 . . . . 0.0 110.375 178.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -84.6 -6.48 59.37 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.761 1.224 . . . . 0.0 113.51 -176.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 88.0 t -83.96 120.91 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 173.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.66 -44.38 69.59 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 72.3 m80 -62.28 -42.3 99.23 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 50.2 t -64.91 -55.95 16.2 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.78 1.232 . . . . 0.0 111.311 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.61 -32.75 70.69 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.371 0.668 . . . . 0.0 112.482 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 74.2 m -73.63 -47.0 43.43 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.543 0.737 . . . . 0.0 111.549 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 69.6 m -62.27 -36.61 82.59 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.584 1.154 . . . . 0.0 112.1 178.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -61.65 -31.77 71.89 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.318 -0.864 . . . . 0.0 113.009 175.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -69.65 -28.53 65.97 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.146 0.884 . . . . 0.0 111.27 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.8 mm -70.83 -50.38 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 123.888 0.875 . . . . 0.0 109.645 174.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 12.9 mm -61.34 -42.22 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 124.949 1.299 . . . . 0.0 111.425 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 50.2 m -60.41 -20.81 61.03 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.431 0.901 . . . . 0.0 113.431 179.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.3 t60 -64.78 -55.9 16.89 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.474 1.034 . . . . 0.0 110.728 176.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 50.1 m95 -62.54 -24.72 67.66 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -74.08 -30.74 62.52 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.539 0.736 . . . . 0.0 112.461 176.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -100.05 -38.12 8.69 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.9 t -78.53 135.23 37.26 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.426 1.49 . . . . 0.0 112.373 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 79.7 p -129.97 2.17 4.81 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.518 1.527 . . . . 0.0 114.175 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -82.23 152.17 26.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.236 1.414 . . . . 0.0 113.499 -178.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 15.0 t60 -86.62 -37.92 17.59 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.862 0.865 . . . . 0.0 109.934 171.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 21.4 t0 -94.3 78.48 3.94 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.017 1.727 . . . . 0.0 111.336 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.8 t -132.67 135.44 26.11 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 126.819 2.047 . . . . 0.0 109.232 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -59.79 -24.24 75.1 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.798 2.332 . . . . 0.0 114.027 -178.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 8.1 t -92.22 -52.99 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-N 119.608 1.095 . . . . 0.0 111.855 176.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 15.2 m -68.97 -40.4 78.86 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -175.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.8 tt -55.92 -56.12 33.85 Favored Pre-proline 0 CA--C 1.545 0.785 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.571 -178.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -61.7 -30.15 84.7 Favored 'Trans proline' 0 C--N 1.355 0.873 0 CA-C-N 121.679 1.635 . . . . 0.0 113.287 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 91.2 mt -69.73 -45.7 67.58 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.873 1.215 . . . . 0.0 111.494 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -63.26 -35.85 81.72 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.917 0.887 . . . . 0.0 110.749 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 22.9 t30 -71.41 -40.12 70.68 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.004 1.322 . . . . 0.0 112.197 175.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -73.16 -27.95 61.95 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.804 1.242 . . . . 0.0 113.251 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 44.1 t -57.53 141.37 48.04 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.735 1.214 . . . . 0.0 113.192 -179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -85.23 -11.56 54.62 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.09 1.356 . . . . 0.0 112.166 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -81.74 63.81 6.17 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.874 1.669 . . . . 0.0 111.852 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 . . . . . 0 N--CA 1.48 1.033 0 C-N-CA 125.588 1.555 . . . . 0.0 112.339 -178.447 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.422 0 CA-C-O 121.854 0.697 . . . . 0.0 114.817 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.4 m -66.83 159.54 27.94 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.081 1.352 . . . . 0.0 113.086 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 27.0 m80 -57.06 -23.7 48.56 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 114.628 1.344 . . . . 0.0 114.628 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 26.5 mmt -77.52 -20.36 54.34 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.138 0.975 . . . . 0.0 112.603 176.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -99.04 -38.16 9.07 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.498 1.519 . . . . 0.0 111.282 177.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -126.21 76.57 72.42 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 125.713 1.605 . . . . 0.0 110.901 178.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -72.25 159.99 48.26 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.633 2.888 . . . . 0.0 112.977 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -143.98 141.83 30.38 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.571 1.548 . . . . 0.0 111.993 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 46.5 m -83.25 63.9 7.46 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.012 1.325 . . . . 0.0 112.245 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -139.26 139.03 21.69 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 124.908 1.283 . . . . 0.0 112.309 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.06 -20.8 16.4 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.024 2.483 . . . . 0.0 112.537 177.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 7.2 m -56.25 -19.59 14.68 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 127.096 2.158 . . . . 0.0 114.997 -178.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 7.8 p -77.1 -18.91 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 125.005 1.322 . . . . 0.0 112.925 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -76.44 124.97 88.09 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 124.194 0.998 . . . . 0.0 111.63 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -55.01 -48.91 18.6 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 122.977 2.451 . . . . 0.0 115.568 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -76.28 137.9 19.48 Favored 'Trans proline' 0 C--N 1.353 0.811 0 CA-C-N 121.997 1.749 . . . . 0.0 111.63 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 16.0 tp -75.66 143.18 42.35 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.377 0.671 . . . . 0.0 111.259 177.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 42.1 t -65.33 139.66 58.61 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.239 0.542 . . . . 0.0 111.127 176.055 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 28.1 mp0 -61.51 -23.42 65.91 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.555 1.142 . . . . 0.0 112.296 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -83.24 -15.49 50.14 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 99.4 m -60.9 -60.01 4.47 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.198 0.908 . . . . 0.0 111.791 -178.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -60.11 -29.3 68.52 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 177.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 69.8 m -70.55 -29.94 66.54 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.781 0.832 . . . . 0.0 112.911 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.9 t70 -90.22 -30.37 17.6 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.615 1.166 . . . . 0.0 113.156 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.5 tt -45.66 -59.96 2.46 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.88 2.072 . . . . 0.0 113.252 -177.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.4 p-90 -67.99 -8.5 37.94 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -174.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -111.99 -58.07 2.18 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 44.1 mt -120.15 19.95 12.13 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 116.061 1.874 . . . . 0.0 116.061 -171.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.1 tt -51.98 136.44 37.48 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.871 1.668 . . . . 0.0 114.999 -178.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -81.16 149.18 17.19 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 124.38 3.386 . . . . 0.0 113.085 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.61 -10.26 34.16 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 115.991 1.849 . . . . 0.0 115.991 -179.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 44.6 p-10 -92.69 -0.15 57.33 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -71.06 146.2 49.45 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 119.337 0.971 . . . . 0.0 111.985 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 28.4 m -113.34 6.95 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 -176.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 55.1 tp -79.32 58.22 2.53 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.107 1.363 . . . . 0.0 111.36 178.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 11.2 t -114.97 101.9 54.68 Favored Pre-proline 0 CA--C 1.54 0.571 0 C-N-CA 124.801 1.24 . . . . 0.0 111.734 -178.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -60.06 125.35 17.37 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 123.39 2.727 . . . . 0.0 110.88 178.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 85.6 mt -80.71 141.61 52.01 Favored Pre-proline 0 CA--C 1.545 0.754 0 CA-C-O 118.661 -0.685 . . . . 0.0 112.64 -177.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -53.9 -27.74 45.63 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.939 3.092 . . . . 0.0 115.043 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 56.0 p -66.0 -17.94 65.02 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.417 1.487 . . . . 0.0 114.029 177.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -133.77 16.35 3.93 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.593 1.957 . . . . 0.0 112.927 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -74.7 164.02 27.04 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.758 1.223 . . . . 0.0 113.858 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -105.8 28.75 7.23 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.212 2.205 . . . . 0.0 112.67 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -58.84 -22.14 58.26 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.048 1.339 . . . . 0.0 113.873 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -70.88 -21.22 62.42 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.072 1.349 . . . . 0.0 113.164 175.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 35.6 tp -105.59 -4.23 21.38 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.808 2.043 . . . . 0.0 112.623 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 47.9 mmm -62.19 153.24 30.95 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 -177.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 94.7 mt -125.21 155.96 39.23 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 127.336 2.254 . . . . 0.0 112.337 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 33.5 p -75.95 160.01 79.5 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 170.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -61.81 -17.43 55.11 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 121.83 1.687 . . . . 0.0 114.139 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 28.8 t70 -77.08 -25.76 52.67 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.216 1.006 . . . . 0.0 112.877 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -77.89 -14.11 59.66 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.859 0.864 . . . . 0.0 112.703 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 77.7 mt -58.41 -37.46 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.892 1.277 . . . . 0.0 110.615 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -68.14 -9.96 50.52 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.068 1.747 . . . . 0.0 113.113 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -86.71 -27.05 23.94 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.666 1.186 . . . . 0.0 112.561 178.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -98.48 -40.36 8.3 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.981 0.912 . . . . 0.0 112.349 174.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -90.37 109.62 20.73 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 104.128 -2.545 . . . . 0.0 104.128 169.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 2.7 m -74.47 123.9 25.58 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -170.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -120.07 174.37 6.52 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.829 2.052 . . . . 0.0 110.417 175.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -61.79 129.26 91.44 Favored Pre-proline 0 CA--C 1.552 1.023 0 O-C-N 120.999 -1.063 . . . . 0.0 112.015 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -78.7 -19.97 10.9 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.237 2.625 . . . . 0.0 115.296 -176.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 65.36 -165.0 36.51 Favored Glycine 0 CA--C 1.543 1.841 0 CA-C-N 118.519 0.6 . . . . 0.0 112.9 -175.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -66.2 -25.16 50.51 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.514 2.809 . . . . 0.0 115.004 -178.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 32.3 t70 -95.51 -29.71 14.23 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -174.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -84.7 15.56 41.22 Favored Glycine 0 CA--C 1.537 1.455 0 C-N-CA 124.621 1.105 . . . . 0.0 115.811 -178.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 78.6 p -65.41 3.67 0.65 Allowed 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 -177.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 95.5 m -58.52 -31.64 68.1 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 126.573 1.949 . . . . 0.0 113.793 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -143.66 -170.79 3.38 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.78 1.632 . . . . 0.0 111.043 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 47.4 t30 -79.75 71.8 6.42 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 172.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . 103.74 -166.92 15.98 Favored Glycine 0 CA--C 1.541 1.677 0 C-N-CA 126.715 2.103 . . . . 0.0 108.477 -169.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 80.0 p -87.59 -4.17 58.96 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 120.492 -1.593 . . . . 0.0 113.842 178.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -66.16 121.27 14.8 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.561 1.144 . . . . 0.0 112.183 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 24.8 p -66.64 -19.63 65.81 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.011 1.324 . . . . 0.0 113.093 177.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -168.4 158.19 30.78 Favored Glycine 0 CA--C 1.539 1.585 0 C-N-CA 127.987 2.708 . . . . 0.0 109.566 177.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -56.5 148.37 63.55 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.134 2.556 . . . . 0.0 114.349 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 12.1 t -61.34 -18.85 60.62 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.662 0.785 . . . . 0.0 113.034 178.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -70.36 -4.9 24.51 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.815 1.246 . . . . 0.0 113.971 176.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 13.0 t70 -77.54 137.52 63.38 Favored Pre-proline 0 CA--C 1.552 1.048 0 O-C-N 120.823 -1.173 . . . . 0.0 111.419 178.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -53.3 -33.54 66.14 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.35 2.7 . . . . 0.0 114.973 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -70.82 -16.87 62.76 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.877 0.871 . . . . 0.0 113.157 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -90.1 -43.58 10.38 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.857 1.263 . . . . 0.0 112.116 176.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -54.35 -43.86 71.65 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 120.039 1.29 . . . . 0.0 112.106 178.228 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -60.7 -31.2 70.48 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 96.4 mt -71.41 -41.16 69.92 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.2 0.909 . . . . 0.0 111.705 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.9 mt -64.22 -51.75 64.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -55.94 -54.64 42.26 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.636 1.174 . . . . 0.0 111.258 177.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -35.6 80.79 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -177.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -66.35 -46.25 77.43 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.765 1.166 . . . . 0.0 109.773 176.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 10.3 tp -59.94 -42.03 93.11 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.118 0.567 . . . . 0.0 111.017 176.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 84.3 t -60.93 -31.01 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.661 1.119 . . . . 0.0 111.285 175.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.6 tp -74.79 -28.18 60.62 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.228 1.376 . . . . 0.0 112.816 174.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 8.6 mp -61.31 -28.13 68.98 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 120.288 1.404 . . . . 0.0 108.934 171.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.9 mt -74.55 -58.7 3.12 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.079 -0.962 . . . . 0.0 108.926 174.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 25.2 t60 -47.6 -55.37 9.43 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.062 0.846 . . . . 0.0 110.438 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -51.0 -36.08 37.35 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.355 1.062 . . . . 0.0 113.74 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -83.62 -37.8 22.41 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 178.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -70.06 -37.32 75.48 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 119.848 1.204 . . . . 0.0 110.578 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 36.5 t -65.95 -43.04 89.12 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.813 2.045 . . . . 0.0 110.899 176.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -48.8 -36.77 17.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.631 1.172 . . . . 0.0 113.135 175.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -62.93 -26.24 68.72 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.123 0.969 . . . . 0.0 113.564 178.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.5 -34.54 75.68 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.715 1.143 . . . . 0.0 112.571 -179.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -82.55 -46.78 12.92 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.959 0.903 . . . . 0.0 110.647 177.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 16.2 tp60 -61.04 -34.05 74.26 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -80.93 -9.88 59.78 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -119.89 -45.12 2.49 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -176.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 77.16 -3.79 56.84 Favored Glycine 0 CA--C 1.542 1.754 0 N-CA-C 117.402 1.721 . . . . 0.0 117.402 178.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -117.61 -37.6 3.44 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.996 1.898 . . . . 0.0 113.211 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 33.7 m -71.24 165.26 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 124.186 0.994 . . . . 0.0 112.468 177.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 30.9 mmt180 -104.38 172.66 6.67 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.307 1.443 . . . . 0.0 112.814 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -73.63 168.65 18.9 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.93 1.292 . . . . 0.0 113.445 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 1.3 t -57.71 144.78 36.77 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.75 2.02 . . . . 0.0 113.445 -178.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 75.3 p -81.73 -11.97 58.81 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.719 1.208 . . . . 0.0 113.488 178.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 3.5 tt -73.74 114.75 35.29 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 126.073 1.749 . . . . 0.0 108.671 178.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -54.07 -41.79 72.5 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.047 2.498 . . . . 0.0 115.007 -175.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 54.2 m80 -69.43 -31.28 69.52 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 24.6 t -68.96 -53.13 22.45 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.532 1.133 . . . . 0.0 108.605 175.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 20.6 ttt85 -55.12 -32.45 62.06 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.517 1.527 . . . . 0.0 111.644 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.2 m -73.36 -59.06 2.89 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.17 1.388 . . . . 0.0 111.336 174.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.7 mmt -62.28 -36.25 81.5 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -65.15 -29.29 70.11 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 120.588 1.54 . . . . 0.0 112.711 178.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -74.9 -38.52 61.82 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.35 0.66 . . . . 0.0 110.447 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 84.1 t -63.17 -44.28 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.729 0.695 . . . . 0.0 110.011 175.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -47.65 84.06 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.189 0.996 . . . . 0.0 110.784 177.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -63.81 -22.96 67.17 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 176.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 71.5 t60 -83.94 -49.78 8.66 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.998 0.817 . . . . 0.0 109.632 174.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 34.8 ttp -57.57 -29.4 64.4 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.418 1.887 . . . . 0.0 113.559 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 20.2 p -69.85 -29.1 66.26 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 121.087 -1.008 . . . . 0.0 112.528 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -95.79 -26.34 15.7 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.894 1.678 . . . . 0.0 112.992 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 18.0 t -60.63 150.26 32.46 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.598 1.559 . . . . 0.0 112.873 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -121.25 -13.18 8.53 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.888 1.675 . . . . 0.0 113.638 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -95.57 -27.64 15.24 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.254 1.022 . . . . 0.0 112.421 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.55 -113.07 2.77 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 124.534 1.064 . . . . 0.0 113.132 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -63.46 -15.58 58.16 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.149 -1.206 . . . . 0.0 113.644 178.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -97.92 -1.71 42.28 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.242 1.417 . . . . 0.0 113.128 175.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 18.5 t -60.33 144.02 51.6 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 122.278 1.037 . . . . 0.0 110.839 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 58.1 mm-40 -78.88 -7.75 58.22 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.562 1.145 . . . . 0.0 113.0 -176.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 93.8 t -90.23 116.57 31.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 173.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.34 -38.6 68.97 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -65.93 -44.74 84.23 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.212 0.605 . . . . 0.0 112.247 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 40.4 t -59.94 -55.9 28.32 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.992 1.317 . . . . 0.0 110.728 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.95 -22.59 64.58 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.7 m -83.4 -51.56 7.29 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.882 0.873 . . . . 0.0 111.368 176.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 57.7 m -58.51 -35.98 73.1 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.269 -0.895 . . . . 0.0 112.354 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 37.3 tpt85 -63.7 -24.76 67.91 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.48 -0.762 . . . . 0.0 112.982 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -72.62 -30.4 64.31 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.015 0.825 . . . . 0.0 111.152 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.0 mm -70.51 -44.73 76.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 175.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 26.7 mm -60.22 -37.91 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.725 1.21 . . . . 0.0 110.645 176.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 67.4 m -61.64 -25.23 67.24 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.047 0.939 . . . . 0.0 113.324 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.2 t60 -62.84 -56.73 14.8 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.87 1.214 . . . . 0.0 110.838 179.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 51.8 m95 -62.85 -21.47 65.98 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 64.0 mttm -82.19 -26.77 33.07 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.331 1.052 . . . . 0.0 112.799 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -100.12 -43.64 6.26 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.955 1.302 . . . . 0.0 113.341 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 9.4 t -84.0 133.53 34.67 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.579 1.952 . . . . 0.0 110.958 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 69.4 p -129.97 -4.69 4.52 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.644 1.35 . . . . 0.0 114.644 -177.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 77.1 mtp85 -66.19 153.39 42.56 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.815 1.646 . . . . 0.0 113.64 -178.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -86.97 -26.45 23.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.444 0.698 . . . . 0.0 111.349 171.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 21.3 t0 -108.06 78.7 1.2 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.865 2.066 . . . . 0.0 111.433 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.0 t -136.48 136.01 21.49 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 127.289 2.236 . . . . 0.0 108.334 178.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -59.01 -24.28 72.62 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.763 2.309 . . . . 0.0 114.068 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.9 t -92.15 -52.01 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.694 1.134 . . . . 0.0 111.288 175.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 10.8 m -68.6 -42.1 78.63 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.974 1.472 . . . . 0.0 114.974 -175.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.2 tt -52.27 -57.48 15.18 Favored Pre-proline 0 CA--C 1.547 0.844 0 CA-C-O 117.802 -1.094 . . . . 0.0 113.316 -177.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -60.46 -31.65 92.79 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.78 1.654 . . . . 0.0 113.54 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.6 mt -73.25 -44.58 59.14 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.659 0.784 . . . . 0.0 112.255 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -58.94 -37.86 77.69 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.842 0.857 . . . . 0.0 110.305 174.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 38.5 t30 -73.37 -36.57 66.11 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.94 1.696 . . . . 0.0 113.385 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -84.87 -20.32 30.99 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -178.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 42.4 t -58.22 149.94 22.86 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -73.36 -11.8 60.61 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 177.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -108.39 20.39 18.67 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.774 1.63 . . . . 0.0 113.262 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 58.1 ttt-85 . . . . . 0 N--CA 1.48 1.028 0 C-N-CA 127.278 2.231 . . . . 0.0 112.429 179.882 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.497 0 N-CA-C 114.779 0.672 . . . . 0.0 114.779 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.3 t -149.35 153.45 37.45 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.942 1.697 . . . . 0.0 111.548 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 27.4 t60 -61.08 -23.36 65.42 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.768 0.827 . . . . 0.0 112.074 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 64.9 mtt -72.8 -21.76 60.93 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.301 1.04 . . . . 0.0 112.352 175.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -98.89 -36.91 9.62 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.404 1.482 . . . . 0.0 111.48 177.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -136.98 91.59 14.88 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.984 1.713 . . . . 0.0 109.808 178.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -77.29 58.31 6.2 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 124.553 3.502 . . . . 0.0 112.884 -177.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.08 169.74 16.9 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.897 1.279 . . . . 0.0 113.409 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 8.6 t -146.83 165.19 30.46 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.344 1.458 . . . . 0.0 111.371 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -138.8 144.22 40.81 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 125.681 1.593 . . . . 0.0 111.734 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -71.65 -27.09 18.86 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.073 2.515 . . . . 0.0 112.79 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 76.2 p -153.98 141.67 19.96 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.193 2.197 . . . . 0.0 110.011 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 9.1 p -142.75 6.42 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 C-N-CA 124.728 1.211 . . . . 0.0 113.578 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -126.55 81.89 67.51 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 125.819 1.648 . . . . 0.0 110.066 178.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.48 -25.94 20.71 Favored 'Trans proline' 0 CA--C 1.55 1.295 0 C-N-CA 123.18 2.586 . . . . 0.0 118.745 -176.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -74.09 150.8 43.51 Favored 'Trans proline' 0 C--N 1.356 0.949 0 CA-C-N 124.587 2.674 . . . . 0.0 113.238 -177.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 14.0 tp -79.11 138.53 37.97 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.059 0.944 . . . . 0.0 110.711 177.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 40.5 t -70.38 134.23 47.66 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.812 -0.555 . . . . 0.0 109.617 175.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 6.2 pm0 -60.63 -24.76 65.78 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -68.48 -15.69 63.63 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.584 0.754 . . . . 0.0 113.034 177.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 91.2 m -59.9 -60.13 4.32 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.764 0.826 . . . . 0.0 110.028 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.35 -29.37 68.85 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.157 0.983 . . . . 0.0 112.956 174.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 18.2 m -69.26 -33.92 73.98 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -90.18 -28.07 19.15 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.062 0.945 . . . . 0.0 112.985 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.8 tt -44.76 -60.13 2.18 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 126.761 2.024 . . . . 0.0 113.932 -176.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -68.03 -10.24 52.16 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -171.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.67 -56.59 2.36 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -176.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 53.2 mt -119.99 11.4 11.74 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 -171.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.0 139.1 34.0 Favored Pre-proline 0 CA--C 1.552 1.03 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -177.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -72.95 164.69 34.87 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 124.663 3.575 . . . . 0.0 114.34 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -69.16 -11.78 61.1 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 178.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -122.78 118.91 29.11 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.19 1.396 . . . . 0.0 111.036 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 5.1 p30 -150.77 170.75 18.48 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 125.855 1.662 . . . . 0.0 110.907 177.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 33.4 m -111.81 11.09 8.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 N-CA-C 115.345 1.609 . . . . 0.0 115.345 -176.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 34.4 tp -110.23 -18.52 13.27 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 -176.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 47.1 m -42.31 105.41 0.41 Allowed Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 125.853 1.661 . . . . 0.0 114.795 -178.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -86.09 145.17 8.54 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 123.418 2.745 . . . . 0.0 111.567 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 83.2 mt -86.87 151.67 52.58 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 123.709 0.804 . . . . 0.0 112.314 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -55.2 -31.5 76.28 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.303 2.669 . . . . 0.0 113.95 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 15.8 m -67.13 -15.15 63.53 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.583 1.153 . . . . 0.0 113.152 176.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -108.05 0.33 21.69 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.557 2.343 . . . . 0.0 111.94 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -69.54 157.13 37.75 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -97.49 25.96 5.31 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 129.506 3.122 . . . . 0.0 112.917 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 38.5 t70 -66.19 -15.09 62.86 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.62 1.568 . . . . 0.0 114.555 -177.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 37.4 t70 -67.0 -14.55 63.01 Favored 'General case' 0 CA--C 1.551 1.003 0 O-C-N 120.764 -1.21 . . . . 0.0 112.566 175.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 27.8 tp -119.3 16.5 13.1 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.48 2.312 . . . . 0.0 112.195 -179.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.85 137.85 56.9 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -174.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -125.03 139.37 53.87 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 128.088 2.555 . . . . 0.0 111.994 -179.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 73.8 p -64.79 146.29 98.62 Favored Pre-proline 0 N--CA 1.473 0.725 0 C-N-CA 124.109 0.963 . . . . 0.0 113.237 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -60.79 -30.26 89.86 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.816 2.344 . . . . 0.0 114.393 -177.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.27 -22.57 66.31 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.526 -0.734 . . . . 0.0 112.623 176.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 13.6 t70 -90.06 -9.85 46.95 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 84.7 mt -55.92 -37.81 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-N 119.638 1.108 . . . . 0.0 111.035 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -64.07 -9.73 18.02 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.133 1.373 . . . . 0.0 113.961 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.4 tp60 -77.43 -37.87 50.8 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.079 -1.013 . . . . 0.0 111.323 174.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -88.18 -49.98 6.66 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.486 0.714 . . . . 0.0 111.979 178.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -92.81 109.76 21.19 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 103.316 -2.846 . . . . 0.0 103.316 169.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -72.77 112.55 8.91 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -171.077 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -78.14 147.31 34.64 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.264 1.026 . . . . 0.0 109.481 175.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -61.08 119.69 47.62 Favored Pre-proline 0 CA--C 1.551 0.989 0 O-C-N 121.144 -0.972 . . . . 0.0 112.196 -177.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -81.71 -6.18 12.46 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.508 2.805 . . . . 0.0 114.373 -178.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 67.07 -137.58 33.74 Favored Glycine 0 CA--C 1.542 1.758 0 O-C-N 121.307 -0.871 . . . . 0.0 111.714 -177.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -71.61 -19.29 28.24 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.251 2.634 . . . . 0.0 113.462 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 26.9 t0 -88.75 48.1 1.59 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.536 1.534 . . . . 0.0 112.121 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -66.27 4.17 2.86 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.967 1.746 . . . . 0.0 117.18 -177.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 33.3 m -54.78 -29.48 54.34 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.464 1.632 . . . . 0.0 113.979 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 82.1 m -60.62 -25.03 65.98 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.788 1.235 . . . . 0.0 113.482 178.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -58.82 -28.5 66.08 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.168 0.895 . . . . 0.0 112.648 177.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -65.52 -28.16 68.98 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 121.344 -0.848 . . . . 0.0 112.139 176.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -92.21 -37.82 5.85 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 125.035 1.302 . . . . 0.0 113.954 178.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 73.7 p -79.81 -17.32 53.62 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -178.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -60.53 -6.34 1.58 Allowed 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.815 1.783 . . . . 0.0 115.815 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 41.0 p -67.25 -22.25 65.68 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.564 1.146 . . . . 0.0 112.846 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 136.15 84.29 0.17 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 125.398 1.475 . . . . 0.0 112.647 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.4 -43.05 49.45 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.785 2.99 . . . . 0.0 113.177 -178.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 69.1 p -121.17 -4.9 9.48 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.599 1.56 . . . . 0.0 113.317 177.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -87.16 -21.57 25.86 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -178.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 9.7 t70 -85.99 128.95 56.05 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 123.735 0.814 . . . . 0.0 111.78 -179.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -54.06 -33.58 74.13 Favored 'Trans proline' 0 C--N 1.351 0.672 0 C-N-CA 123.377 2.718 . . . . 0.0 114.592 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -68.39 -21.62 64.68 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.099 0.959 . . . . 0.0 112.662 178.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -90.04 -43.99 10.15 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.083 1.353 . . . . 0.0 110.465 173.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -53.64 -44.3 69.47 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.092 0.957 . . . . 0.0 112.16 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -63.5 -30.98 72.02 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 177.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 75.9 mt -70.14 -40.93 74.5 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.618 0.767 . . . . 0.0 110.031 175.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.5 mt -60.65 -50.78 79.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.19 -53.18 57.04 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.413 1.085 . . . . 0.0 111.516 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -35.45 79.56 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -69.41 -46.77 66.05 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.951 0.796 . . . . 0.0 110.865 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.7 tt -58.81 -43.1 90.51 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.034 0.934 . . . . 0.0 110.379 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 60.2 t -61.56 -31.81 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.979 0.809 . . . . 0.0 111.515 175.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 33.6 tp -67.02 -37.55 84.34 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.606 -1.309 . . . . 0.0 111.976 174.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.93 -25.57 63.58 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 119.326 0.966 . . . . 0.0 110.955 176.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 7.0 mt -74.07 -55.12 6.49 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.734 0.814 . . . . 0.0 109.737 176.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 14.2 t60 -56.96 -50.48 72.51 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 119.192 -0.432 . . . . 0.0 110.898 178.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -60.01 -22.53 62.71 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -178.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -90.14 -31.06 17.25 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.975 -1.078 . . . . 0.0 112.927 173.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 58.1 mttm -80.09 -40.01 28.45 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.104 1.362 . . . . 0.0 112.6 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.5 t -63.06 -45.79 90.53 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.527 1.931 . . . . 0.0 111.44 177.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -61.19 -37.11 81.76 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.292 -0.88 . . . . 0.0 111.783 175.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.79 -43.55 79.47 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.425 1.09 . . . . 0.0 110.8 176.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -60.0 -42.43 94.24 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.897 1.679 . . . . 0.0 111.249 176.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -66.07 -47.74 73.27 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.777 0.831 . . . . 0.0 110.795 176.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -61.6 -37.49 84.11 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.856 1.262 . . . . 0.0 112.694 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -65.56 -33.09 75.1 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.464 1.105 . . . . 0.0 113.123 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -88.8 -50.3 6.31 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.119 0.967 . . . . 0.0 112.092 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 71.95 -2.03 28.29 Favored Glycine 0 CA--C 1.54 1.633 0 N-CA-C 117.011 1.564 . . . . 0.0 117.011 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -120.21 4.81 10.8 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 119.562 1.681 . . . . 0.0 113.932 -178.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 32.9 m -128.62 161.91 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 125.753 1.621 . . . . 0.0 112.417 179.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 41.1 ptt180 -93.8 170.1 9.81 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.62 1.568 . . . . 0.0 112.072 177.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -70.58 174.84 5.37 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.502 1.121 . . . . 0.0 113.048 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 22.4 p -68.83 174.88 3.98 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.362 1.865 . . . . 0.0 114.583 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 22.2 m -84.75 -1.35 56.17 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 115.113 1.523 . . . . 0.0 115.113 -177.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 62.2 tp -84.89 113.33 49.12 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 125.093 1.357 . . . . 0.0 110.836 -178.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -63.64 -31.73 69.76 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.325 2.017 . . . . 0.0 114.102 -177.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 35.9 m80 -70.56 -23.36 62.59 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 40.4 t -62.32 -46.74 87.35 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.27 1.028 . . . . 0.0 109.91 176.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -54.92 -35.22 63.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.36 1.464 . . . . 0.0 112.146 175.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 49.3 m -72.07 -60.18 2.36 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.614 0.765 . . . . 0.0 110.807 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 15.6 mmt -60.34 -34.03 73.25 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -64.88 -33.58 76.35 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 120.566 1.53 . . . . 0.0 112.675 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -72.14 -37.91 69.34 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.131 0.572 . . . . 0.0 110.197 174.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 66.9 t -62.45 -46.61 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 122.948 0.499 . . . . 0.0 110.696 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.0 -43.7 98.5 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.975 0.91 . . . . 0.0 111.799 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -64.86 -32.89 74.81 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 176.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 61.0 t60 -75.04 -52.07 11.99 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.728 0.811 . . . . 0.0 110.204 175.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 40.6 ttp -56.73 -31.16 64.26 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.524 1.93 . . . . 0.0 114.304 -177.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.7 t -77.98 -9.94 59.35 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 120.059 1.3 . . . . 0.0 112.99 176.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -118.93 -14.0 9.43 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.749 1.619 . . . . 0.0 113.916 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 43.5 t -56.61 144.65 31.16 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.684 1.594 . . . . 0.0 113.045 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -96.71 -13.84 22.45 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.003 1.721 . . . . 0.0 113.588 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -118.7 -30.68 5.05 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.268 1.027 . . . . 0.0 113.558 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.21 -107.58 0.6 Allowed Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.717 1.151 . . . . 0.0 113.436 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -61.62 -20.59 63.52 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 121.053 -1.263 . . . . 0.0 112.945 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -100.51 1.52 41.11 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.062 1.745 . . . . 0.0 113.561 176.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.5 t -63.54 139.86 58.81 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.262 1.025 . . . . 0.0 110.013 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -81.44 0.14 38.98 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -175.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 16.6 t -90.49 125.3 43.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.732 1.213 . . . . 0.0 109.159 176.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.38 -28.1 51.83 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -175.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -90.06 -18.63 25.57 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.686 1.735 . . . . 0.0 115.686 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 52.7 t -83.17 -59.86 2.33 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.126 1.37 . . . . 0.0 111.076 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.02 -29.53 65.38 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 4.7 p -73.57 -54.92 7.06 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 124.958 1.303 . . . . 0.0 111.822 176.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 53.0 m -59.4 -34.68 72.74 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.47 0.708 . . . . 0.0 111.692 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 45.1 tpt85 -62.86 -30.02 71.2 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -67.78 -34.7 77.31 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.307 0.958 . . . . 0.0 110.963 175.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 10.2 mt -67.82 -45.64 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 124.15 0.98 . . . . 0.0 109.731 176.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 15.0 mm -60.76 -36.74 73.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.918 0.887 . . . . 0.0 111.229 176.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.14 -21.17 66.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 177.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.0 t60 -64.11 -59.97 3.8 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.422 1.01 . . . . 0.0 110.726 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 62.4 m95 -60.62 -26.95 67.39 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 63.4 mttm -71.5 -34.76 70.41 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.831 0.852 . . . . 0.0 112.787 178.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.14 -32.31 10.97 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 178.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 9.6 t -78.21 133.78 37.69 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.444 1.498 . . . . 0.0 111.996 -178.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 71.5 p -130.09 -1.04 4.64 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.335 1.454 . . . . 0.0 114.492 -178.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -80.14 150.26 30.27 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.738 1.215 . . . . 0.0 112.685 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 46.1 p-80 -84.37 -36.13 22.69 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.329 0.652 . . . . 0.0 111.569 175.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.8 t0 -94.19 70.05 3.8 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.069 1.748 . . . . 0.0 111.854 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 47.7 t -122.99 134.2 24.94 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 126.329 1.852 . . . . 0.0 109.524 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -58.33 -25.64 73.68 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.927 2.418 . . . . 0.0 114.36 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 39.3 t -92.12 -52.55 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 119.209 0.913 . . . . 0.0 111.65 176.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 7.8 m -69.73 -36.97 76.31 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -175.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -57.36 -57.12 27.26 Favored Pre-proline 0 CA--C 1.546 0.808 0 CA-C-O 117.625 -1.178 . . . . 0.0 112.337 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -59.94 -30.9 92.82 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.778 1.652 . . . . 0.0 113.197 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 94.5 mt -70.28 -47.02 63.1 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.183 0.901 . . . . 0.0 111.869 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -63.64 -37.97 89.36 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.725 0.693 . . . . 0.0 110.635 176.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 34.3 t30 -65.47 -36.55 84.23 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.638 1.175 . . . . 0.0 112.267 176.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -79.32 -29.57 42.4 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.304 1.041 . . . . 0.0 113.325 178.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 28.3 t -67.84 134.37 50.78 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -177.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 34.9 t70 -100.74 1.32 40.25 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.853 1.261 . . . . 0.0 111.657 175.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -76.77 -7.16 54.87 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.649 1.58 . . . . 0.0 113.813 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 . . . . . 0 N--CA 1.477 0.924 0 C-N-CA 126.509 1.924 . . . . 0.0 111.998 178.452 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.375 0 CA-C-O 121.273 0.374 . . . . 0.0 113.994 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.7 p -81.29 155.29 26.12 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.891 1.276 . . . . 0.0 113.067 179.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 65.5 m80 -138.65 161.95 35.86 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.818 1.647 . . . . 0.0 111.865 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 76.9 mtm -133.25 157.02 46.48 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.537 1.535 . . . . 0.0 111.669 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -91.49 -23.32 20.01 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.894 1.278 . . . . 0.0 113.53 178.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -60.36 -46.21 97.56 Favored Pre-proline 0 CA--C 1.552 1.028 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -76.76 2.46 7.45 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 122.797 2.331 . . . . 0.0 114.379 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -86.38 12.66 9.64 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.008 1.323 . . . . 0.0 113.867 -178.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 64.9 p -66.45 158.95 28.16 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.441 1.496 . . . . 0.0 113.934 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -105.13 151.52 39.55 Favored Pre-proline 0 N--CA 1.469 0.508 0 C-N-CA 125.56 1.544 . . . . 0.0 112.997 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -63.47 121.18 8.87 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 122.83 2.354 . . . . 0.0 109.235 177.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 50.2 m -19.92 103.87 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 129.876 3.271 . . . . 0.0 114.865 -175.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 11.8 p -141.58 149.66 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 126.856 2.063 . . . . 0.0 110.78 -177.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -99.36 113.82 65.11 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.373 1.069 . . . . 0.0 111.421 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.42 -45.93 31.14 Favored 'Trans proline' 0 CA--C 1.549 1.251 0 C-N-CA 122.955 2.437 . . . . 0.0 115.185 178.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -85.83 162.58 10.52 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.217 2.611 . . . . 0.0 112.151 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 8.7 tt -98.48 132.3 44.03 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.174 0.99 . . . . 0.0 111.196 177.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 32.7 t -93.64 146.31 23.92 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.606 1.162 . . . . 0.0 110.967 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 9.4 pm0 -55.55 -27.98 52.21 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 -178.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -66.33 -19.3 65.77 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 6.2 m -63.57 -58.29 7.43 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.064 0.946 . . . . 0.0 110.832 -179.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -60.24 -31.14 69.92 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.527 0.731 . . . . 0.0 112.49 176.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 49.0 m -69.86 -29.32 66.52 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.863 0.756 . . . . 0.0 112.871 177.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.0 t70 -90.17 -29.76 18.05 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.776 1.231 . . . . 0.0 113.23 176.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.1 tt -45.49 -60.0 2.41 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.943 2.097 . . . . 0.0 113.42 -177.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.0 p-90 -69.6 -10.49 58.41 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -173.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -109.6 -53.77 2.63 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 115.748 1.759 . . . . 0.0 115.748 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 59.6 mt -119.9 11.61 11.86 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 116.263 1.949 . . . . 0.0 116.263 -172.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 7.0 tt -57.37 127.07 76.46 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 124.249 1.019 . . . . 0.0 111.279 178.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -76.55 171.05 18.76 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 124.056 3.171 . . . . 0.0 112.963 -178.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -69.24 11.21 0.24 Allowed 'General case' 0 CA--C 1.551 1.005 0 N-CA-C 116.784 2.142 . . . . 0.0 116.784 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 48.5 t30 -145.54 129.84 17.69 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.967 1.707 . . . . 0.0 110.019 177.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -150.36 159.65 44.3 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.365 1.066 . . . . 0.0 112.371 179.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 94.5 t -73.27 -35.92 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 124.887 1.275 . . . . 0.0 111.957 178.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 38.8 tp -83.96 109.57 17.73 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.494 0.718 . . . . 0.0 109.451 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 74.8 m -115.06 99.99 53.04 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 125.285 1.434 . . . . 0.0 110.634 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -62.16 150.7 85.77 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 123.74 2.96 . . . . 0.0 113.346 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 88.0 mt -134.83 115.22 12.18 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.96 1.304 . . . . 0.0 111.191 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -53.46 -31.8 59.84 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.928 3.086 . . . . 0.0 115.072 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 16.7 m -61.26 -17.16 52.09 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.074 1.35 . . . . 0.0 114.511 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -133.67 17.17 3.93 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.902 1.681 . . . . 0.0 112.913 179.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -79.83 157.2 27.08 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.598 1.159 . . . . 0.0 113.961 -178.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.24 20.85 3.05 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 127.064 2.145 . . . . 0.0 113.822 178.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -64.32 -18.6 64.77 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 -176.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 35.7 t70 -63.78 -18.05 63.69 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.937 0.895 . . . . 0.0 113.265 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 98.5 mt -99.64 5.31 45.87 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.102 1.761 . . . . 0.0 113.764 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 71.6 mmm -62.39 151.49 36.81 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.09 168.0 14.0 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.874 2.07 . . . . 0.0 110.866 178.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 59.4 m -75.49 145.6 79.51 Favored Pre-proline 0 CA--C 1.546 0.825 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 169.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -57.02 -18.66 29.35 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.755 2.303 . . . . 0.0 115.527 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -77.16 -24.29 51.52 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.531 1.133 . . . . 0.0 112.723 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 18.5 t70 -81.84 -9.91 59.47 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.028 0.931 . . . . 0.0 113.221 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 67.7 mt -55.88 -35.24 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.277 1.431 . . . . 0.0 110.283 175.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -67.06 -9.87 43.87 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.784 1.634 . . . . 0.0 113.643 178.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -82.28 -27.04 32.59 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.034 0.934 . . . . 0.0 111.7 176.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.3 p-90 -98.6 -42.27 7.34 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 118.106 -0.95 . . . . 0.0 112.316 176.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -96.91 109.89 22.52 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 169.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.32 151.01 46.6 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.322 1.049 . . . . 0.0 113.489 -175.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -101.22 153.47 19.59 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.115 1.366 . . . . 0.0 109.645 173.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 9.3 t0 -65.58 123.01 83.39 Favored Pre-proline 0 CA--C 1.554 1.112 0 O-C-N 121.238 -0.914 . . . . 0.0 111.693 -178.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -84.79 -4.03 9.85 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.98 3.12 . . . . 0.0 114.788 -176.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 89.3 -147.13 19.38 Favored Glycine 0 CA--C 1.544 1.855 0 C-N-CA 125.108 1.337 . . . . 0.0 113.045 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.84 -1.42 11.37 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 124.523 3.482 . . . . 0.0 115.173 -177.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 32.4 t70 -132.53 149.83 52.26 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.803 1.641 . . . . 0.0 111.387 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 77.98 -3.26 61.83 Favored Glycine 0 CA--C 1.538 1.503 0 C-N-CA 124.468 1.032 . . . . 0.0 115.503 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 53.5 p -81.42 20.82 0.83 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.524 1.93 . . . . 0.0 113.888 178.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 60.4 m -59.47 -19.55 48.63 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 127.164 2.186 . . . . 0.0 114.898 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -132.37 151.19 51.97 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.99 1.716 . . . . 0.0 110.047 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 45.1 p-10 -59.36 -38.67 81.02 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 120.887 -1.133 . . . . 0.0 112.262 178.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -61.52 -42.06 99.69 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.866 1.222 . . . . 0.0 113.156 177.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 82.8 p -80.15 -29.87 38.87 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 118.467 1.134 . . . . 0.0 112.478 177.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -71.22 -43.73 66.77 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.229 1.412 . . . . 0.0 114.182 -179.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 5.4 t -152.11 -3.33 0.26 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 115.929 1.826 . . . . 0.0 115.929 -177.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 58.81 57.59 19.07 Favored Glycine 0 CA--C 1.543 1.829 0 CA-C-N 119.57 1.077 . . . . 0.0 114.606 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -69.63 143.55 51.83 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 123.359 2.706 . . . . 0.0 112.76 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 74.0 p -95.93 7.64 45.81 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 126.046 1.739 . . . . 0.0 113.896 -179.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -73.23 -21.35 60.66 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.073 1.349 . . . . 0.0 114.414 -178.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 9.5 t70 -85.22 126.6 66.91 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 123.862 0.865 . . . . 0.0 111.432 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -64.36 -30.89 63.0 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.867 2.378 . . . . 0.0 113.927 -178.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -67.84 -23.63 65.18 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.045 0.938 . . . . 0.0 111.905 177.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -90.01 -49.72 6.43 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.095 1.358 . . . . 0.0 109.988 174.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -50.24 -43.76 53.1 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.77 1.628 . . . . 0.0 113.018 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -61.7 -32.61 72.83 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 177.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 83.2 mt -71.72 -39.34 70.18 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.345 1.058 . . . . 0.0 110.985 177.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 3.0 mt -62.79 -52.45 59.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.343 0.657 . . . . 0.0 109.583 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -56.18 -58.26 8.71 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.634 1.174 . . . . 0.0 111.218 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -35.78 81.72 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -177.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -65.62 -43.07 90.7 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.802 1.183 . . . . 0.0 110.332 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 8.0 tp -62.06 -39.89 93.92 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.25 0.62 . . . . 0.0 110.627 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 63.3 t -60.86 -34.3 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.131 0.878 . . . . 0.0 110.802 174.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 3.4 tp -71.48 -27.77 63.48 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 120.286 1.403 . . . . 0.0 112.853 175.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.9 mp -63.51 -29.2 70.51 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 120.523 1.51 . . . . 0.0 109.63 173.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.1 mt -75.55 -51.39 13.02 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.99 0.916 . . . . 0.0 108.739 174.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 30.6 t60 -53.31 -55.9 20.94 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 123.652 0.781 . . . . 0.0 110.827 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.97 -41.97 65.07 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.09 0.956 . . . . 0.0 113.338 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -72.34 -42.65 65.12 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.537 -0.727 . . . . 0.0 112.399 178.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 56.1 mttm -71.01 -36.47 72.43 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.638 1.175 . . . . 0.0 112.229 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 12.0 t -67.69 -41.44 83.61 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.44 1.896 . . . . 0.0 109.834 175.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -58.76 -43.55 90.35 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.357 1.063 . . . . 0.0 110.347 172.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 20.1 mmt180 -67.45 -36.13 80.59 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.356 -0.84 . . . . 0.0 113.02 175.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.35 -35.64 70.18 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.603 1.161 . . . . 0.0 110.914 174.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -77.81 -45.9 23.12 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 122.96 0.504 . . . . 0.0 110.944 175.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 16.4 tp60 -58.36 -33.05 69.13 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.782 0.833 . . . . 0.0 112.907 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -73.01 -10.02 59.35 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.625 1.17 . . . . 0.0 113.898 177.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -118.03 -48.4 2.55 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.561 1.544 . . . . 0.0 113.062 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 76.65 -1.55 61.61 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 117.387 1.715 . . . . 0.0 117.387 177.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -120.22 -32.02 4.25 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 120.046 1.923 . . . . 0.0 114.431 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 28.5 m -71.05 155.47 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -81.79 160.49 23.55 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.094 1.358 . . . . 0.0 111.562 176.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -74.4 175.04 8.07 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -177.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 2.2 t -56.94 155.18 8.37 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 127.256 2.223 . . . . 0.0 114.372 -178.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 11.1 t -76.26 -22.4 55.17 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.837 1.255 . . . . 0.0 112.794 178.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 38.4 mt -77.87 131.08 71.17 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 123.843 0.857 . . . . 0.0 113.005 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.09 -33.25 19.57 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 122.396 2.064 . . . . 0.0 110.551 175.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 41.2 m80 -66.57 -33.11 74.94 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.893 1.277 . . . . 0.0 113.032 178.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 40.7 t -67.55 -51.92 44.95 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.012 1.325 . . . . 0.0 109.678 177.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -57.15 -38.77 74.03 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.7 1.2 . . . . 0.0 111.123 174.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.9 m -65.98 -57.06 8.66 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.465 1.106 . . . . 0.0 111.596 177.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 15.0 mmt -63.41 -37.07 85.86 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 118.235 -0.888 . . . . 0.0 113.147 -177.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -65.34 -32.69 74.46 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 121.143 1.792 . . . . 0.0 112.084 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -69.92 -38.93 76.38 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.911 -0.493 . . . . 0.0 110.777 173.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 89.0 t -64.66 -42.73 95.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 118.791 0.723 . . . . 0.0 110.436 175.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.47 -45.98 84.21 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.344 1.057 . . . . 0.0 110.374 176.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -66.07 -21.54 66.37 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 177.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 60.3 t60 -86.43 -49.56 7.53 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.64 0.776 . . . . 0.0 109.697 174.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -58.31 -27.44 64.1 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.254 1.822 . . . . 0.0 113.532 -177.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 19.4 p -72.34 -26.54 61.96 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.519 1.128 . . . . 0.0 112.618 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 80.3 t60 -102.36 -21.83 14.22 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.06 1.744 . . . . 0.0 113.523 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 25.0 t -57.71 143.06 43.13 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.281 1.432 . . . . 0.0 113.144 -177.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -107.88 -15.7 14.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.999 1.72 . . . . 0.0 113.418 -178.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -103.23 -32.82 9.42 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.561 1.144 . . . . 0.0 112.281 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 51.56 -105.87 0.26 Allowed Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.979 1.276 . . . . 0.0 113.869 177.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -59.15 -22.13 60.45 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.31 -1.112 . . . . 0.0 112.943 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -102.59 1.78 35.24 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.398 1.879 . . . . 0.0 113.828 177.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 19.5 t -62.32 141.49 58.26 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.216 1.006 . . . . 0.0 110.575 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -81.74 -5.46 58.16 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.324 1.05 . . . . 0.0 113.333 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 97.8 t -86.86 115.57 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 172.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.09 -39.59 69.47 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -176.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.34 -40.89 96.78 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.659 0.784 . . . . 0.0 112.552 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.2 t -65.25 -57.16 9.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.469 1.508 . . . . 0.0 110.818 178.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -61.1 -27.65 68.52 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 68.5 m -76.85 -45.27 29.03 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.381 -0.825 . . . . 0.0 111.198 175.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 64.0 m -62.84 -35.98 81.71 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.239 1.016 . . . . 0.0 111.554 176.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 3.3 mmm-85 -61.81 -30.39 70.79 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -68.37 -29.56 68.3 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.363 0.983 . . . . 0.0 111.243 176.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 1.8 mm -73.28 -47.01 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 176.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 24.6 mm -61.15 -37.99 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.947 1.299 . . . . 0.0 111.571 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 49.1 m -62.78 -21.28 65.75 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.961 0.904 . . . . 0.0 113.222 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.6 t60 -66.24 -60.47 2.76 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.334 0.97 . . . . 0.0 110.448 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 67.2 m95 -59.6 -28.99 67.66 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 89.7 mttt -67.79 -36.09 79.83 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.652 0.781 . . . . 0.0 113.03 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.18 -31.82 11.2 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.1 t -79.22 135.19 36.71 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.198 1.399 . . . . 0.0 112.165 -177.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.7 p -130.1 -2.27 4.56 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.248 1.419 . . . . 0.0 114.644 -177.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -81.75 149.83 28.23 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.736 1.214 . . . . 0.0 112.876 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -84.56 -30.99 24.61 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.549 0.739 . . . . 0.0 111.493 174.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.3 t0 -97.33 69.93 2.28 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.228 1.811 . . . . 0.0 111.346 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.9 t -126.14 135.02 26.54 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 126.296 1.839 . . . . 0.0 109.723 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -57.76 -25.64 69.53 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 123.049 2.499 . . . . 0.0 114.606 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 14.7 t -92.23 -50.89 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 119.48 1.036 . . . . 0.0 111.795 176.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 6.9 m -70.44 -40.28 73.87 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -174.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.4 tt -54.43 -55.94 32.07 Favored Pre-proline 0 CA--C 1.547 0.862 0 CA-C-O 117.825 -1.083 . . . . 0.0 112.854 -178.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -60.92 -30.27 89.66 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.761 1.641 . . . . 0.0 113.454 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.88 -44.17 66.87 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.41 1.004 . . . . 0.0 111.645 177.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -64.97 -31.12 72.2 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.7 0.8 . . . . 0.0 111.35 175.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 32.4 t30 -75.98 -37.13 58.87 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.057 1.343 . . . . 0.0 112.074 176.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -74.45 -42.27 59.37 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.565 1.146 . . . . 0.0 113.53 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 10.6 t -85.59 157.6 20.33 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 122.093 0.949 . . . . 0.0 113.368 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 30.6 t70 -134.81 14.62 3.64 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.685 1.994 . . . . 0.0 111.099 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 22.0 pttm -74.02 -13.24 60.83 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 116.114 1.894 . . . . 0.0 116.114 -175.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 . . . . . 0 N--CA 1.476 0.85 0 C-N-CA 126.45 1.9 . . . . 0.0 110.857 177.769 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.611 0 N-CA-C 115.116 0.807 . . . . 0.0 115.116 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.3 t -149.43 149.06 30.2 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.585 1.554 . . . . 0.0 111.73 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -61.4 -24.22 66.36 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.839 0.856 . . . . 0.0 112.208 176.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 14.7 tpt -63.28 -22.54 66.94 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.567 1.147 . . . . 0.0 112.435 176.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -90.82 -3.43 57.39 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.221 1.408 . . . . 0.0 113.236 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -75.74 133.47 73.31 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 124.452 1.101 . . . . 0.0 111.79 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.05 103.15 1.33 Allowed 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.138 2.559 . . . . 0.0 112.084 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 46.2 mm-40 -130.76 4.1 4.54 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.7 1.6 . . . . 0.0 113.331 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 31.5 m -80.71 162.65 24.04 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.272 1.429 . . . . 0.0 112.779 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -137.34 148.69 63.02 Favored Pre-proline 0 CA--C 1.546 0.791 0 C-N-CA 125.521 1.528 . . . . 0.0 111.264 178.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -70.36 -17.05 35.11 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.131 2.554 . . . . 0.0 113.54 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 16.3 m -78.94 -0.2 30.01 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.699 1.6 . . . . 0.0 114.784 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 10.4 p -138.03 148.28 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 124.96 1.304 . . . . 0.0 112.144 -179.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -152.14 158.51 33.68 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 125.717 1.607 . . . . 0.0 111.696 178.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -102.71 77.99 0.03 OUTLIER 'Trans proline' 0 CA--C 1.557 1.636 0 C-N-CA 125.289 3.993 . . . . 0.0 112.327 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -70.29 156.08 62.75 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.764 2.309 . . . . 0.0 113.453 -179.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 42.2 tp -68.83 138.4 54.73 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.788 1.235 . . . . 0.0 110.463 176.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 17.4 t -93.87 150.92 19.96 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.448 0.699 . . . . 0.0 112.041 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -62.26 -25.86 68.07 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -87.87 -10.74 49.82 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 85.9 m -60.49 -58.42 8.56 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.287 0.949 . . . . 0.0 110.684 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -60.01 -27.09 66.59 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.6 0.76 . . . . 0.0 112.71 176.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 45.5 m -74.79 -30.62 61.5 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.931 0.892 . . . . 0.0 113.06 178.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 35.2 t70 -90.12 -29.38 18.34 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.581 1.152 . . . . 0.0 112.878 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -43.31 -60.15 1.81 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 127.515 2.326 . . . . 0.0 113.933 -177.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 51.7 p-90 -68.59 -9.79 51.87 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 -172.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -111.96 -56.83 2.34 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 -177.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 63.9 mt -120.02 14.26 12.3 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -170.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.8 tt -53.76 137.35 54.13 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 125.795 1.638 . . . . 0.0 113.842 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -78.26 165.68 25.38 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 124.197 3.265 . . . . 0.0 114.019 -178.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -65.58 -21.66 66.61 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.876 1.436 . . . . 0.0 114.876 -179.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -87.73 12.71 12.12 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -71.02 143.16 50.85 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 119.51 1.05 . . . . 0.0 112.458 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -130.67 17.09 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 124.9 1.28 . . . . 0.0 113.612 -177.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 8.0 tt -81.8 -15.45 54.12 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 120.405 -1.434 . . . . 0.0 113.741 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 5.9 t -57.58 129.21 80.65 Favored Pre-proline 0 CA--C 1.543 0.679 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -175.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.71 142.5 28.93 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 122.958 2.439 . . . . 0.0 110.066 174.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 88.4 mt -68.86 157.69 88.17 Favored Pre-proline 0 CA--C 1.547 0.836 0 O-C-N 121.636 -0.665 . . . . 0.0 111.792 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -55.29 -28.13 60.86 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 123.066 2.511 . . . . 0.0 114.174 178.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 44.0 p -77.63 -21.43 52.26 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.646 1.578 . . . . 0.0 113.191 175.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -95.4 -26.32 15.91 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.757 2.023 . . . . 0.0 111.961 178.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -59.84 139.29 57.44 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.178 1.391 . . . . 0.0 112.283 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 66.7 mtm -82.51 49.11 1.39 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.514 1.525 . . . . 0.0 113.75 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 38.7 t70 -73.13 -20.59 60.89 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.293 1.037 . . . . 0.0 112.678 178.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 37.4 t70 -68.59 -14.52 63.07 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 121.078 -1.013 . . . . 0.0 112.455 176.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 25.3 tp -119.26 16.67 13.14 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 127.477 2.311 . . . . 0.0 111.626 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.1 141.58 57.4 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -175.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.3 tt -125.16 142.39 51.52 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 128.657 2.783 . . . . 0.0 111.158 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 40.7 t -66.44 142.69 97.85 Favored Pre-proline 0 N--CA 1.477 0.878 0 C-N-CA 124.088 0.955 . . . . 0.0 112.372 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.66 -21.4 47.01 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.76 2.306 . . . . 0.0 115.445 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.7 t70 -75.78 -24.81 56.02 Favored 'General case' 0 CA--C 1.549 0.921 0 O-C-N 121.395 -0.815 . . . . 0.0 112.164 176.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -83.79 -9.72 58.59 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.371 1.869 . . . . 0.0 112.569 177.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 85.2 mt -56.02 -31.15 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.429 1.013 . . . . 0.0 109.678 174.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -67.85 -9.87 48.28 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.011 1.324 . . . . 0.0 113.703 176.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -80.78 -25.14 38.1 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.089 1.356 . . . . 0.0 111.803 177.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 4.5 p-90 -106.95 -28.23 10.19 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.6 1.16 . . . . 0.0 113.455 177.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -114.85 109.79 18.69 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 104.792 -2.299 . . . . 0.0 104.792 169.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.84 140.08 33.12 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -169.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -113.63 179.97 3.81 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.162 2.185 . . . . 0.0 111.0 175.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.32 126.23 90.01 Favored Pre-proline 0 CA--C 1.556 1.192 0 O-C-N 120.641 -1.287 . . . . 0.0 110.602 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -74.81 -19.59 18.2 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.286 2.657 . . . . 0.0 115.298 -176.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 62.11 -160.42 30.99 Favored Glycine 0 CA--C 1.545 1.928 0 CA-C-N 119.24 0.927 . . . . 0.0 113.226 -177.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -78.27 -11.64 16.0 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 123.735 2.957 . . . . 0.0 114.703 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -109.87 -13.63 14.42 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -177.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -73.88 35.83 0.89 Allowed Glycine 0 N--CA 1.475 1.256 0 C-N-CA 125.506 1.527 . . . . 0.0 116.505 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 61.5 m -69.27 109.29 4.04 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.599 1.2 . . . . 0.0 108.686 176.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 28.4 p -72.57 158.66 35.26 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.66 1.355 . . . . 0.0 114.66 -175.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 24.9 p90 -151.87 160.49 43.52 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.629 1.972 . . . . 0.0 110.801 -176.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -56.13 -28.07 56.5 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 -177.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -68.51 -20.17 73.47 Favored Glycine 0 CA--C 1.54 1.598 0 C-N-CA 124.618 1.104 . . . . 0.0 114.499 177.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 11.1 t -110.55 -39.53 4.88 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.925 1.29 . . . . 0.0 110.948 175.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -87.53 51.63 2.28 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.452 1.501 . . . . 0.0 111.124 175.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 37.4 p -64.4 -24.42 67.63 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.843 1.257 . . . . 0.0 112.403 178.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -172.02 148.12 10.59 Favored Glycine 0 CA--C 1.539 1.588 0 C-N-CA 127.746 2.593 . . . . 0.0 109.78 176.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -60.79 165.71 11.38 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 123.275 2.65 . . . . 0.0 113.624 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 48.3 p -56.81 -24.14 48.74 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -85.23 -2.68 58.31 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 125.452 1.501 . . . . 0.0 114.316 177.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 14.1 t70 -73.55 141.45 79.77 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 124.726 1.21 . . . . 0.0 113.276 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -50.84 -34.78 46.48 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.81 3.006 . . . . 0.0 115.152 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.68 -25.07 66.38 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.1 0.96 . . . . 0.0 112.994 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 54.0 mttp -90.11 -38.92 13.2 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.891 1.276 . . . . 0.0 110.958 173.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -54.56 -46.05 73.59 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.22 0.918 . . . . 0.0 111.876 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -62.3 -30.16 70.95 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 177.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.49 -38.82 71.15 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.658 0.783 . . . . 0.0 110.649 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.6 mt -64.32 -53.14 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -53.17 -51.98 60.28 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.399 1.08 . . . . 0.0 111.461 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.53 -34.51 78.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 -179.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -71.0 -49.62 43.19 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.815 0.734 . . . . 0.0 110.136 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 4.5 tt -58.0 -44.8 87.43 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.116 1.366 . . . . 0.0 111.178 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 88.5 t -59.57 -32.94 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 119.457 1.026 . . . . 0.0 111.662 176.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 4.4 tp -74.41 -24.45 59.1 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.847 1.203 . . . . 0.0 113.086 175.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.2 mp -62.77 -31.14 72.05 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 120.546 1.521 . . . . 0.0 109.08 171.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 5.6 mt -70.02 -53.19 18.73 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.123 0.969 . . . . 0.0 109.476 175.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.4 t60 -54.82 -56.04 23.68 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.09 0.556 . . . . 0.0 110.717 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.28 -27.23 54.63 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -86.78 -26.38 24.15 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.467 1.03 . . . . 0.0 113.392 176.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 43.9 mttm -89.94 -36.3 15.08 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.186 1.794 . . . . 0.0 112.683 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.3 t -61.68 -47.96 82.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.957 2.103 . . . . 0.0 111.273 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -56.37 -23.58 38.69 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 177.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -69.59 -28.65 66.13 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.45 1.1 . . . . 0.0 112.503 176.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -36.72 84.79 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.972 0.805 . . . . 0.0 112.291 -178.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -85.42 -37.57 19.66 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.253 1.021 . . . . 0.0 111.24 177.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 15.6 tp60 -64.35 -33.41 75.78 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.298 -0.876 . . . . 0.0 112.076 178.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -88.54 -16.2 33.22 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.878 1.271 . . . . 0.0 114.263 178.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 62.6 t-20 -147.04 113.5 5.96 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.296 1.038 . . . . 0.0 112.458 -177.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . -74.45 -7.72 79.12 Favored Glycine 0 CA--C 1.538 1.52 0 N-CA-C 115.844 1.098 . . . . 0.0 115.844 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -89.54 -0.6 57.62 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 119.176 1.488 . . . . 0.0 113.365 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 24.7 m -131.33 166.44 28.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 126.519 1.928 . . . . 0.0 111.561 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -129.13 153.48 47.64 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.328 1.451 . . . . 0.0 112.24 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -78.14 172.19 13.91 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.798 1.239 . . . . 0.0 112.569 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 10.4 m -52.65 147.16 8.99 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 -178.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 69.1 p -97.55 -7.72 30.67 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.803 2.041 . . . . 0.0 111.428 170.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 30.7 tp -57.73 113.87 7.25 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 128.276 2.63 . . . . 0.0 109.664 177.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -52.21 -40.4 69.5 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.233 2.622 . . . . 0.0 115.245 -176.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 55.4 m80 -70.33 -34.02 72.18 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.7 t -69.18 -50.72 45.03 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.763 1.225 . . . . 0.0 108.967 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 19.0 tpp85 -55.9 -36.15 67.34 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.412 1.485 . . . . 0.0 111.733 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 8.2 m -69.46 -57.59 5.05 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.145 1.378 . . . . 0.0 111.171 176.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.6 mmt -64.33 -35.48 80.99 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -177.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -63.94 -32.35 73.86 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 120.889 1.677 . . . . 0.0 112.359 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -72.32 -42.39 65.47 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.372 0.669 . . . . 0.0 110.46 174.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 76.8 t -60.51 -47.78 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 123.221 0.608 . . . . 0.0 110.797 176.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.18 -45.16 94.08 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.557 1.143 . . . . 0.0 112.377 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 24.4 m-80 -63.31 -33.59 75.85 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 177.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 66.9 t60 -75.24 -49.42 19.38 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.221 0.609 . . . . 0.0 110.827 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.7 ttp -57.37 -31.21 65.55 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.93 1.692 . . . . 0.0 114.286 -176.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 13.1 t -77.85 -14.41 59.57 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.974 1.261 . . . . 0.0 112.535 176.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 84.3 t60 -99.86 -29.39 12.62 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.771 1.628 . . . . 0.0 111.774 175.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 19.0 t -60.78 152.38 27.14 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.548 1.939 . . . . 0.0 112.513 179.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -127.44 -10.46 5.72 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.381 1.472 . . . . 0.0 114.024 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -92.28 -25.23 18.69 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.071 0.948 . . . . 0.0 112.593 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 55.15 -115.64 5.91 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.259 0.933 . . . . 0.0 112.582 179.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 62.7 tttp -60.63 -21.28 62.57 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.356 -1.085 . . . . 0.0 112.998 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.07 -1.66 57.75 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.753 1.221 . . . . 0.0 113.628 177.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.9 t -64.65 141.49 58.75 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.056 0.932 . . . . 0.0 109.83 177.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -80.48 -5.21 56.28 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 90.4 t -89.51 113.69 26.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.64 -40.82 66.14 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -176.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -67.62 -30.46 70.04 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.63 1.172 . . . . 0.0 113.609 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.5 t -74.18 -55.53 5.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.068 1.347 . . . . 0.0 109.257 177.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.34 -25.81 66.1 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 85.1 p -81.72 -49.26 10.66 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 119.34 0.973 . . . . 0.0 111.852 175.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 50.1 m -60.07 -34.49 73.51 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.462 0.705 . . . . 0.0 112.234 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 48.0 tpt85 -61.1 -29.92 70.04 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.464 -0.772 . . . . 0.0 113.028 177.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -69.95 -33.31 71.94 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.712 0.805 . . . . 0.0 110.974 176.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 16.8 mt -69.03 -43.88 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 124.638 1.175 . . . . 0.0 109.373 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 16.9 mm -62.85 -38.12 81.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 123.993 0.917 . . . . 0.0 110.793 174.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 5.6 t -62.44 -27.38 69.06 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.131 0.972 . . . . 0.0 112.65 177.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 8.9 t60 -60.81 -55.95 26.99 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.292 0.951 . . . . 0.0 111.011 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 43.7 m95 -61.96 -28.72 69.75 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 92.3 mttt -73.3 -28.0 61.85 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.143 0.977 . . . . 0.0 112.794 178.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -100.09 -38.58 8.49 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.5 t -76.7 134.6 39.18 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.787 1.635 . . . . 0.0 112.835 -176.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.5 p -130.07 -0.51 4.67 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.535 1.534 . . . . 0.0 114.361 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -82.85 153.52 25.12 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.019 1.327 . . . . 0.0 113.255 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 16.2 t60 -86.45 -40.38 15.38 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.831 0.853 . . . . 0.0 111.13 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.3 t0 -91.48 69.91 5.89 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.604 1.561 . . . . 0.0 111.852 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.4 t -121.32 132.59 24.18 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 126.297 1.839 . . . . 0.0 109.22 178.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -59.9 -24.41 76.07 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.596 2.197 . . . . 0.0 114.378 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.6 t -92.2 -50.87 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 119.525 1.057 . . . . 0.0 111.476 175.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 12.9 m -69.92 -38.64 76.3 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.9 tt -54.19 -56.37 26.94 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-O 117.752 -1.118 . . . . 0.0 113.006 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -61.41 -30.1 86.56 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 121.77 1.647 . . . . 0.0 113.327 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 93.5 mt -70.95 -46.22 62.79 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.341 0.973 . . . . 0.0 111.736 177.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -62.89 -31.75 72.86 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.636 0.774 . . . . 0.0 111.019 176.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 18.8 t30 -74.35 -39.84 62.53 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.332 1.453 . . . . 0.0 112.137 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -80.27 -19.45 46.74 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 30.8 t -57.69 137.81 56.09 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.617 1.167 . . . . 0.0 113.7 -178.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 37.9 t70 -82.29 -11.37 58.66 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.573 1.549 . . . . 0.0 113.173 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -69.29 -32.34 71.44 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -178.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 . . . . . 0 N--CA 1.477 0.879 0 C-N-CA 126.122 1.769 . . . . 0.0 111.807 -179.389 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.317 0 N-CA-C 114.54 0.576 . . . . 0.0 114.54 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.2 t -61.23 -18.14 56.82 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.66 1.184 . . . . 0.0 113.707 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 25.5 p-80 -79.92 -11.21 59.82 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.071 1.748 . . . . 0.0 113.898 177.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 20.8 mmt -74.12 153.76 39.43 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.239 1.016 . . . . 0.0 112.547 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -79.7 -15.03 58.31 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 178.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -93.97 136.29 23.89 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 125.454 1.501 . . . . 0.0 111.08 178.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -53.17 131.9 45.3 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.416 2.744 . . . . 0.0 113.571 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -86.15 54.37 3.12 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.017 1.327 . . . . 0.0 111.915 -179.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 33.8 m -66.74 162.05 22.22 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.855 1.662 . . . . 0.0 113.293 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -63.14 143.5 97.61 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 123.914 0.886 . . . . 0.0 112.581 179.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -73.74 -20.36 20.15 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 123.492 2.795 . . . . 0.0 114.014 -179.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 19.9 m -157.16 140.01 15.15 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.469 1.908 . . . . 0.0 110.299 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 28.6 m -138.27 154.82 28.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 126.317 1.847 . . . . 0.0 111.329 179.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -133.36 80.88 56.93 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 124.801 1.24 . . . . 0.0 110.784 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -56.11 -46.07 33.61 Favored 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 123.573 2.849 . . . . 0.0 116.533 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -75.77 155.53 39.43 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 122.151 1.901 . . . . 0.0 112.531 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.06 143.32 52.32 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.768 1.227 . . . . 0.0 112.003 177.206 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 18.3 m -72.48 127.76 33.54 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.732 1.213 . . . . 0.0 110.538 177.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -58.01 -22.42 49.63 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.708 1.744 . . . . 0.0 115.708 -176.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -62.6 -21.85 65.94 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.587 -0.696 . . . . 0.0 112.137 175.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 15.3 m -67.84 -60.15 2.74 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.228 1.011 . . . . 0.0 110.218 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -60.07 -30.47 69.24 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.497 0.719 . . . . 0.0 112.289 174.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 50.6 m -70.16 -32.73 70.84 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 33.7 t70 -90.18 -29.87 17.97 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.098 0.959 . . . . 0.0 112.857 176.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.3 tt -41.46 -58.31 1.93 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 127.484 2.314 . . . . 0.0 113.497 -178.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 48.4 p-90 -71.77 -9.9 58.98 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -173.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.06 -60.16 1.9 Allowed 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 116.504 2.039 . . . . 0.0 116.504 -179.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 48.2 mt -120.16 19.72 12.17 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -170.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.0 tt -51.86 140.35 29.95 Favored Pre-proline 0 CA--C 1.553 1.069 0 C-N-CA 126.045 1.738 . . . . 0.0 114.487 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -68.94 159.66 53.01 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 124.032 3.154 . . . . 0.0 113.547 -179.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -62.89 -9.77 10.92 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 -177.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 49.9 t30 -128.14 134.7 49.12 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.717 1.607 . . . . 0.0 110.114 178.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -149.46 165.56 31.76 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.196 0.998 . . . . 0.0 112.835 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 28.6 m -122.19 -17.38 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.712 1.605 . . . . 0.0 114.248 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 47.2 tp -74.55 -8.78 57.45 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.019 1.328 . . . . 0.0 113.407 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 12.7 m -48.32 107.47 0.76 Allowed Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 128.021 2.528 . . . . 0.0 114.578 -178.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.52 124.98 15.71 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 123.555 2.837 . . . . 0.0 111.505 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 25.9 tp -73.1 127.9 88.6 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 124.936 1.295 . . . . 0.0 112.571 -176.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -54.36 -34.92 82.58 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 123.591 2.861 . . . . 0.0 114.425 178.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 14.8 m -66.05 -13.23 59.62 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.819 1.248 . . . . 0.0 113.818 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -126.63 21.76 7.03 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.756 2.022 . . . . 0.0 111.581 179.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -66.74 159.83 27.06 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -178.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -111.61 30.37 7.02 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.599 2.36 . . . . 0.0 112.371 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 37.8 t70 -58.81 -22.53 58.7 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.641 1.176 . . . . 0.0 114.013 -178.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.28 -20.09 63.93 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.221 1.008 . . . . 0.0 112.797 175.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 94.6 mt -106.39 -0.77 23.94 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.804 1.642 . . . . 0.0 113.426 178.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 68.4 mmm -65.94 149.73 49.76 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.685 1.13 . . . . 0.0 113.502 -178.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.87 175.72 7.1 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.975 1.71 . . . . 0.0 111.436 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 74.5 p -78.72 151.16 76.68 Favored Pre-proline 0 CA--C 1.544 0.729 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 169.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.58 -12.23 27.2 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.188 2.592 . . . . 0.0 115.136 -179.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -95.55 -18.97 20.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.29 1.036 . . . . 0.0 112.974 177.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.68 -9.97 59.59 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.074 -1.016 . . . . 0.0 112.404 177.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 77.3 mt -54.81 -31.86 25.12 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 125.979 1.712 . . . . 0.0 110.8 175.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -66.09 -10.08 37.13 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.487 1.515 . . . . 0.0 113.544 177.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.1 tm0? -76.75 -33.85 58.09 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.001 -1.062 . . . . 0.0 111.488 177.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -98.69 -36.03 9.98 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 117.918 -1.039 . . . . 0.0 113.124 178.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -100.38 109.77 21.96 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 105.074 -2.195 . . . . 0.0 105.074 169.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.74 138.08 33.01 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -172.27 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -120.03 169.25 10.37 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.05 1.74 . . . . 0.0 110.792 176.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 13.9 t70 -63.58 130.38 94.31 Favored Pre-proline 0 CA--C 1.555 1.149 0 O-C-N 120.989 -1.069 . . . . 0.0 111.543 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -77.44 -5.54 15.66 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.707 2.938 . . . . 0.0 115.373 -176.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 87.69 -150.07 22.16 Favored Glycine 0 CA--C 1.542 1.746 0 C-N-CA 124.801 1.191 . . . . 0.0 113.458 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -75.89 -0.09 9.85 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 124.454 3.436 . . . . 0.0 115.149 -177.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 26.4 t70 -132.36 152.77 51.29 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.552 1.541 . . . . 0.0 112.016 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -76.11 54.04 3.07 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 125.543 1.544 . . . . 0.0 114.255 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 51.0 m -61.32 -28.26 69.08 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.664 1.185 . . . . 0.0 113.082 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 81.3 m -123.46 148.27 46.35 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.816 2.047 . . . . 0.0 110.436 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 7.2 p90 -153.92 174.06 15.12 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.633 1.573 . . . . 0.0 111.447 -177.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 50.9 p-10 -53.32 -28.76 30.11 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.953 1.464 . . . . 0.0 114.953 -178.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -73.43 -24.11 75.74 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 124.956 1.265 . . . . 0.0 114.276 177.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 40.7 p -104.03 -31.55 9.64 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.107 1.363 . . . . 0.0 112.285 177.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -121.77 88.54 2.95 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 127.137 2.175 . . . . 0.0 109.705 178.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 23.6 p -69.16 -69.49 0.33 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.392 1.477 . . . . 0.0 114.482 -176.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 175.84 92.38 0.08 OUTLIER Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.585 1.088 . . . . 0.0 112.429 -178.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.96 -24.97 50.93 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 124.108 3.205 . . . . 0.0 115.91 -176.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 36.3 p -80.89 -13.1 59.23 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.298 1.439 . . . . 0.0 114.481 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -137.26 -24.49 1.08 Allowed 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 -177.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.09 116.93 41.03 Favored Pre-proline 0 CA--C 1.551 1.01 0 CA-C-N 119.55 1.068 . . . . 0.0 111.12 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -62.02 -38.55 56.55 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 122.894 2.396 . . . . 0.0 114.094 -177.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -66.77 -45.4 78.62 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.66 -0.65 . . . . 0.0 110.602 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 81.7 mttt -56.59 -49.55 74.56 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.062 0.846 . . . . 0.0 110.425 175.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -57.16 -45.6 83.49 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.543 0.737 . . . . 0.0 111.889 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -60.02 -41.8 92.97 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 118.842 0.746 . . . . 0.0 111.725 175.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.17 -40.05 90.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.746 0.819 . . . . 0.0 112.152 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.5 mt -64.0 -52.03 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 119.504 1.047 . . . . 0.0 109.714 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -53.51 -56.95 12.67 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.217 1.007 . . . . 0.0 111.171 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.87 -36.56 84.75 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -69.53 -42.99 73.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.724 1.147 . . . . 0.0 110.656 178.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 8.2 tp -61.51 -40.09 93.36 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.545 0.738 . . . . 0.0 110.395 176.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 95.8 t -60.52 -32.43 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 119.204 0.911 . . . . 0.0 110.929 174.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 2.8 tp -72.72 -27.58 62.14 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 120.055 1.298 . . . . 0.0 113.306 174.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 11.0 mp -61.88 -33.73 74.73 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 120.412 1.46 . . . . 0.0 108.815 173.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.3 mt -68.89 -51.12 43.5 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.174 0.99 . . . . 0.0 110.046 175.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 19.6 t60 -56.79 -55.85 29.09 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.392 177.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -50.8 -45.8 59.47 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -70.19 -35.3 73.84 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 43.9 mttm -77.73 -38.45 47.09 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.22 1.008 . . . . 0.0 111.745 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 49.6 t -60.8 -46.65 89.7 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.47 2.308 . . . . 0.0 109.587 175.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -54.14 -53.74 49.16 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.974 1.71 . . . . 0.0 111.062 173.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -66.11 -38.75 88.98 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 178.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.63 -40.1 82.4 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.241 1.416 . . . . 0.0 111.517 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -72.35 -46.86 53.65 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.068 0.394 . . . . 0.0 109.946 176.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 16.2 tp60 -59.16 -31.99 69.48 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.773 0.829 . . . . 0.0 112.945 179.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -71.01 -14.96 62.52 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.012 1.325 . . . . 0.0 113.913 177.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -116.9 -47.19 2.71 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.264 1.426 . . . . 0.0 113.4 -177.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 73.38 -1.01 45.33 Favored Glycine 0 CA--C 1.542 1.741 0 N-CA-C 117.103 1.601 . . . . 0.0 117.103 178.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -115.8 -42.85 3.05 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.675 1.738 . . . . 0.0 112.925 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 34.2 m -66.55 152.21 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.816 0.846 . . . . 0.0 112.427 178.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? -84.3 146.97 27.46 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.067 0.947 . . . . 0.0 110.981 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -78.87 171.39 15.25 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 123.999 0.92 . . . . 0.0 112.497 178.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 1.3 m -53.42 147.19 11.06 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.229 1.812 . . . . 0.0 114.66 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 47.6 m -86.48 -3.47 59.02 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.899 1.279 . . . . 0.0 111.734 173.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 30.1 tp -71.64 113.05 16.53 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 126.689 1.996 . . . . 0.0 110.385 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -62.98 -29.28 75.53 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 121.711 1.608 . . . . 0.0 111.851 179.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 36.3 m80 -69.24 -42.21 75.96 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 117.747 -1.12 . . . . 0.0 113.941 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . 0.322 0.8 OUTLIER -72.81 -35.15 67.28 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 120.326 1.421 . . . . 0.0 111.207 178.1 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -60.21 -40.85 91.6 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.752 1.221 . . . . 0.0 110.611 171.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.9 m -65.11 -55.37 19.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.688 1.195 . . . . 0.0 110.667 176.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.7 mmt -62.78 -39.2 93.46 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.604 0.965 . . . . 0.0 113.604 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -64.7 -29.61 70.6 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 120.794 1.634 . . . . 0.0 113.133 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -72.67 -39.42 67.11 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.01 0.524 . . . . 0.0 110.483 173.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 90.5 t -63.41 -45.83 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.194 0.598 . . . . 0.0 110.188 175.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.92 -42.86 90.69 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.983 1.313 . . . . 0.0 112.104 178.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -63.01 -32.79 74.23 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.224 0.609 . . . . 0.0 112.385 176.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 65.2 t60 -79.61 -49.31 12.36 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.642 0.777 . . . . 0.0 110.768 176.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 31.3 ttp -56.55 -34.04 66.7 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.717 1.607 . . . . 0.0 113.904 -176.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 10.2 t -73.21 -13.06 61.08 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 120.181 1.355 . . . . 0.0 113.085 176.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 58.9 m80 -107.1 -24.79 11.83 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.478 1.511 . . . . 0.0 112.595 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.4 t -61.59 150.06 37.33 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.538 1.535 . . . . 0.0 112.343 178.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -128.89 -8.86 4.93 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.87 1.668 . . . . 0.0 113.641 -179.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.76 -28.22 21.85 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.242 0.928 . . . . 0.0 111.86 178.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.65 -109.66 1.0 Allowed Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.952 1.263 . . . . 0.0 112.761 178.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -60.23 -22.98 63.68 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.155 0.982 . . . . 0.0 113.247 177.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -95.87 -1.46 49.36 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.296 1.438 . . . . 0.0 113.846 178.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 13.9 t -61.0 141.97 56.95 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 122.289 1.042 . . . . 0.0 110.62 178.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.8 mm-40 -78.62 -10.54 59.78 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.721 1.208 . . . . 0.0 113.115 -176.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 64.6 t -90.65 114.85 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 124.874 1.27 . . . . 0.0 107.582 174.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.32 -37.0 66.84 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -64.93 -41.63 95.38 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.445 1.098 . . . . 0.0 112.204 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.5 t -67.04 -56.38 10.31 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.594 1.558 . . . . 0.0 109.994 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.57 -26.94 62.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.28 1.032 . . . . 0.0 113.255 178.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 70.8 m -82.33 -47.27 12.55 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.049 0.94 . . . . 0.0 112.124 175.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 60.2 m -62.17 -34.8 77.11 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 121.56 -0.713 . . . . 0.0 111.873 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -59.07 -31.53 68.97 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.338 1.055 . . . . 0.0 112.503 176.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -67.71 -34.14 76.29 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.873 0.869 . . . . 0.0 111.299 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.4 mt -72.23 -46.04 59.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 124.343 1.057 . . . . 0.0 110.035 177.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 19.2 mm -62.57 -39.69 85.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.142 0.977 . . . . 0.0 111.301 176.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 16.5 t -60.39 -26.16 66.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.085 0.954 . . . . 0.0 112.712 177.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.6 t60 -61.54 -57.28 12.73 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.092 0.86 . . . . 0.0 111.159 177.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 59.5 m95 -62.45 -22.56 66.31 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 178.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -79.66 -29.92 41.03 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.509 1.123 . . . . 0.0 112.614 178.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -99.96 -36.32 9.42 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 179.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.4 t -74.04 139.33 44.64 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.354 1.461 . . . . 0.0 111.289 -178.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 74.2 p -130.12 -2.84 4.52 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 -177.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -96.09 141.51 29.38 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.227 1.411 . . . . 0.0 112.647 -177.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -74.34 -34.4 63.41 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 121.728 -0.607 . . . . 0.0 111.819 176.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 36.7 t0 -90.89 79.34 5.93 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.718 1.607 . . . . 0.0 111.038 178.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 40.4 t -135.13 137.43 26.85 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 127.106 2.162 . . . . 0.0 109.124 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -56.72 -26.54 66.27 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.858 2.372 . . . . 0.0 114.604 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.8 t -92.24 -51.65 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-N 119.783 1.174 . . . . 0.0 111.604 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 6.1 m -69.63 -39.72 76.97 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 -174.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 1.6 tt -56.24 -55.91 37.0 Favored Pre-proline 0 CA--C 1.546 0.823 0 CA-C-O 117.578 -1.201 . . . . 0.0 112.903 -177.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.18 -32.49 94.56 Favored 'Trans proline' 0 C--N 1.354 0.848 0 CA-C-N 121.845 1.695 . . . . 0.0 113.169 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 98.4 mt -69.31 -46.19 67.72 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.001 0.819 . . . . 0.0 111.47 177.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 48.7 mttm -62.63 -41.89 99.28 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.026 0.93 . . . . 0.0 110.472 176.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.0 t30 -63.71 -39.19 93.7 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.274 1.429 . . . . 0.0 112.252 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -77.3 -21.33 53.66 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.325 1.05 . . . . 0.0 113.662 178.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 33.5 p -68.7 146.41 52.99 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -175.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -137.47 12.48 2.99 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 126.026 1.73 . . . . 0.0 113.065 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 57.2 tptt -71.49 -24.72 62.03 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.05 1.74 . . . . 0.0 113.635 -177.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 13.4 mmt85 . . . . . 0 N--CA 1.478 0.955 0 C-N-CA 125.688 1.595 . . . . 0.0 111.309 177.05 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.423 0 N-CA-C 114.132 0.413 . . . . 0.0 114.132 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.2 t -153.01 152.49 31.45 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.337 1.455 . . . . 0.0 111.243 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 22.0 p-80 -58.5 -19.72 39.64 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.282 1.033 . . . . 0.0 113.074 175.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 13.4 tpt -76.67 -18.93 58.27 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.274 1.43 . . . . 0.0 112.89 177.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -124.56 -22.75 4.55 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -74.16 144.27 81.57 Favored Pre-proline 0 CA--C 1.549 0.93 0 O-C-N 121.076 -1.015 . . . . 0.0 112.501 179.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -76.71 -15.44 17.08 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.684 2.923 . . . . 0.0 114.644 -178.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -78.21 92.48 4.47 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.284 1.033 . . . . 0.0 111.56 -178.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 15.0 t -153.04 152.3 31.2 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.825 1.65 . . . . 0.0 111.251 179.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 14.9 t70 -151.29 142.18 15.11 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 125.477 1.511 . . . . 0.0 110.883 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -55.89 -22.81 39.49 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.358 2.705 . . . . 0.0 116.752 -178.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 48.2 m -83.04 0.63 43.98 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -179.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 10.8 p -136.69 155.73 34.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 125.297 1.439 . . . . 0.0 111.48 179.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -134.82 150.28 72.93 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 124.707 1.203 . . . . 0.0 112.533 179.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -59.36 -43.03 43.59 Favored 'Trans proline' 0 CA--C 1.547 1.143 0 C-N-CA 123.472 2.781 . . . . 0.0 117.991 -178.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -79.51 152.17 22.98 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 122.297 1.998 . . . . 0.0 113.734 -177.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 6.9 tt -65.39 143.82 57.48 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.474 1.11 . . . . 0.0 110.944 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 40.9 t -118.58 160.61 21.48 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.314 1.845 . . . . 0.0 109.434 175.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -62.82 -24.67 67.87 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.875 -1.141 . . . . 0.0 111.011 174.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -79.33 -16.84 55.68 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.454 1.102 . . . . 0.0 113.058 176.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 58.2 m -59.23 -60.08 4.44 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 119.368 0.986 . . . . 0.0 110.876 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -60.17 -25.76 65.79 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 175.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 45.3 m -75.05 -31.89 61.4 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.378 -0.826 . . . . 0.0 112.642 177.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -90.06 -25.45 20.78 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.62 1.168 . . . . 0.0 112.902 175.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.9 tt -45.51 -60.01 2.41 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 127.451 2.3 . . . . 0.0 113.87 -178.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.2 p-90 -70.08 -8.36 48.76 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -173.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 10.2 ptmm? -112.15 -56.0 2.45 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 4.2 mp -120.12 16.88 12.44 Favored 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 117.055 2.243 . . . . 0.0 117.055 -176.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.4 137.22 50.8 Favored Pre-proline 0 N--CA 1.48 1.044 0 O-C-N 120.473 -1.392 . . . . 0.0 113.802 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -80.14 162.59 23.01 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 124.104 3.203 . . . . 0.0 113.717 -179.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -67.93 -11.14 58.16 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.007 1.323 . . . . 0.0 113.538 177.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.68 1.95 40.01 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 126.117 1.767 . . . . 0.0 113.683 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -68.81 145.11 54.03 Favored 'General case' 0 CA--C 1.551 0.992 0 O-C-N 120.573 -1.33 . . . . 0.0 112.861 -178.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 34.5 m -127.01 9.3 3.55 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 -177.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.19 -4.75 46.29 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.844 1.258 . . . . 0.0 113.399 -178.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 6.0 m -52.77 113.77 4.94 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 126.598 1.959 . . . . 0.0 114.618 -176.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -75.02 135.4 18.98 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.483 2.122 . . . . 0.0 109.515 176.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 85.5 mt -73.56 135.98 78.16 Favored Pre-proline 0 CA--C 1.545 0.757 0 CA-C-O 118.415 -0.802 . . . . 0.0 112.469 -177.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -54.44 -30.81 65.71 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.666 2.91 . . . . 0.0 114.639 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 46.9 p -69.73 -15.77 63.21 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.178 1.391 . . . . 0.0 113.932 177.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -127.52 15.1 7.1 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.677 1.991 . . . . 0.0 112.096 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.54 159.44 33.92 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -176.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.75 16.8 5.31 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 128.26 2.624 . . . . 0.0 114.119 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -66.92 -14.63 63.0 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.949 1.3 . . . . 0.0 114.482 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 37.2 t70 -69.58 -16.13 63.35 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 121.217 -0.927 . . . . 0.0 112.097 175.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 28.3 tp -110.88 16.16 21.43 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 127.569 2.348 . . . . 0.0 111.881 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.4 tpt -62.75 145.52 54.64 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -175.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -124.89 149.29 47.71 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 128.251 2.621 . . . . 0.0 109.682 177.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 24.2 m -71.51 134.41 84.4 Favored Pre-proline 0 N--CA 1.474 0.737 0 CA-C-O 118.327 -0.844 . . . . 0.0 110.966 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -55.39 -28.8 65.19 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.002 2.468 . . . . 0.0 116.085 -176.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -70.72 -15.25 62.68 Favored 'General case' 0 CA--C 1.55 0.954 0 O-C-N 120.912 -1.118 . . . . 0.0 113.196 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.1 t70 -89.76 -9.83 47.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.243 1.817 . . . . 0.0 113.13 178.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 72.7 mt -52.56 -34.35 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 125.045 1.338 . . . . 0.0 111.33 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -67.44 -9.73 44.64 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.562 1.145 . . . . 0.0 113.697 177.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -75.65 -20.2 58.64 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 120.928 -1.108 . . . . 0.0 111.109 175.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -86.19 -49.98 7.32 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.022 0.828 . . . . 0.0 109.876 178.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -115.4 109.92 18.58 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.556 1.942 . . . . 0.0 106.782 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 1.6 m -123.56 138.17 54.61 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -173.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -72.96 171.36 12.95 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.979 1.312 . . . . 0.0 112.286 176.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 11.1 t70 -60.18 122.91 70.1 Favored Pre-proline 0 CA--C 1.555 1.173 0 O-C-N 121.292 -0.88 . . . . 0.0 111.538 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -82.47 -3.58 11.42 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 123.938 3.092 . . . . 0.0 115.333 -176.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 92.78 -148.65 19.16 Favored Glycine 0 CA--C 1.543 1.826 0 C-N-CA 124.703 1.144 . . . . 0.0 112.85 -177.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -60.2 -21.95 68.35 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 124.485 3.456 . . . . 0.0 116.302 -177.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 24.7 t70 -140.05 137.46 34.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.035 1.334 . . . . 0.0 112.169 -177.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 170.68 55.21 0.04 OUTLIER Glycine 0 CA--C 1.534 1.239 0 C-N-CA 124.316 0.96 . . . . 0.0 112.921 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 20.0 m -67.56 -7.08 23.25 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.664 1.727 . . . . 0.0 115.664 -176.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 59.8 m -50.95 -31.97 19.44 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.026 1.73 . . . . 0.0 113.95 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -55.97 -31.8 63.32 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.825 0.85 . . . . 0.0 113.187 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 26.4 t30 -70.73 -26.23 63.29 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 121.26 -0.9 . . . . 0.0 112.406 177.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -86.44 -37.52 8.83 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 124.906 1.241 . . . . 0.0 112.807 176.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 71.5 p -78.13 -32.25 50.31 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.084 0.954 . . . . 0.0 112.814 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -93.67 76.14 4.33 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.032 1.333 . . . . 0.0 109.587 175.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 43.4 p -64.86 -16.38 63.1 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 125.848 1.659 . . . . 0.0 114.766 -177.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -177.33 -71.04 0.06 OUTLIER Glycine 0 CA--C 1.533 1.203 0 C-N-CA 127.611 2.529 . . . . 0.0 108.217 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -70.59 170.45 17.54 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.383 2.722 . . . . 0.0 110.528 172.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 9.5 m -56.32 -31.96 64.19 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.458 1.103 . . . . 0.0 112.714 179.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -144.67 129.9 18.67 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.139 1.776 . . . . 0.0 109.711 175.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 15.8 t70 -61.12 146.31 88.36 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 125.104 1.362 . . . . 0.0 112.147 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -51.69 -34.27 52.91 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.009 2.473 . . . . 0.0 114.715 178.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -66.61 -22.22 66.12 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.579 1.152 . . . . 0.0 112.494 177.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -89.73 -42.35 11.37 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.59 1.556 . . . . 0.0 110.215 174.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 77.9 mtm-85 -60.68 -39.27 87.82 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.868 0.867 . . . . 0.0 112.619 179.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -63.58 -27.87 69.54 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 86.3 mt -70.26 -37.71 74.96 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.176 0.59 . . . . 0.0 110.593 175.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.5 mt -62.1 -51.81 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 175.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -54.57 -54.01 46.98 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.966 0.906 . . . . 0.0 111.016 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -36.17 83.12 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.164 0.893 . . . . 0.0 113.352 -178.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -71.74 -44.15 64.59 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.888 0.767 . . . . 0.0 110.96 179.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 12.3 tp -63.76 -38.35 90.79 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.569 0.747 . . . . 0.0 110.784 177.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 87.8 t -61.87 -32.27 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 CA-C-N 119.735 1.152 . . . . 0.0 110.619 174.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 15.6 tp -69.53 -34.98 75.02 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 120.762 -1.211 . . . . 0.0 111.608 174.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.4 mp -59.14 -26.14 64.48 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 120.11 1.323 . . . . 0.0 110.271 174.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 4.0 mt -77.5 -53.25 7.84 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.289 -0.882 . . . . 0.0 109.933 176.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.6 t60 -54.93 -52.93 61.42 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.13 0.572 . . . . 0.0 110.226 177.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -58.19 -22.78 53.04 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.79 1.236 . . . . 0.0 113.968 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -90.07 -29.42 18.37 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.157 -0.964 . . . . 0.0 113.417 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 31.9 mttp -86.07 -34.67 20.62 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.682 1.193 . . . . 0.0 112.623 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 20.2 t -63.92 -44.83 91.72 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.277 1.831 . . . . 0.0 110.946 177.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -60.88 -33.47 73.14 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 120.797 -1.19 . . . . 0.0 111.819 174.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -69.26 -34.76 75.27 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.184 0.993 . . . . 0.0 111.067 174.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.53 -37.37 80.97 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.879 1.271 . . . . 0.0 110.871 174.433 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -75.49 -44.87 41.7 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 122.992 0.517 . . . . 0.0 110.506 175.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -55.68 -36.86 67.58 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.826 1.25 . . . . 0.0 112.417 178.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -70.54 -10.01 58.16 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.016 1.326 . . . . 0.0 114.352 178.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -119.02 -48.98 2.43 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.358 1.463 . . . . 0.0 112.94 -179.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 74.44 0.91 59.57 Favored Glycine 0 CA--C 1.541 1.694 0 N-CA-C 117.192 1.637 . . . . 0.0 117.192 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -122.08 -29.65 4.19 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 119.89 1.845 . . . . 0.0 114.617 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 33.4 m -78.17 160.68 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.642 1.177 . . . . 0.0 113.984 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -76.6 165.24 25.05 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.147 1.379 . . . . 0.0 111.705 177.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -75.96 177.53 6.96 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.047 0.939 . . . . 0.0 113.415 179.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 3.5 t -59.66 146.8 39.82 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.431 1.892 . . . . 0.0 113.785 -179.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 50.3 m -80.87 -11.46 59.58 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.732 1.213 . . . . 0.0 113.278 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 58.8 tp -83.6 115.18 58.22 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 125.932 1.693 . . . . 0.0 110.512 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -58.12 -35.47 98.71 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.533 2.155 . . . . 0.0 113.828 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 7.6 m170 -65.48 -37.46 86.91 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.589 0.755 . . . . 0.0 112.533 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 33.6 t -62.44 -49.07 76.91 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.024 1.329 . . . . 0.0 109.716 177.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -55.41 -36.99 67.06 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.933 1.293 . . . . 0.0 111.813 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.6 m -70.67 -56.52 6.26 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.887 0.875 . . . . 0.0 111.772 176.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 14.6 mmt -65.07 -32.71 74.56 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -65.51 -32.21 73.69 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 120.753 1.615 . . . . 0.0 112.303 178.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -72.47 -38.55 68.18 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.534 0.734 . . . . 0.0 110.449 174.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 77.0 t -62.22 -47.24 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.277 0.631 . . . . 0.0 110.327 175.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.57 -45.11 95.15 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.878 0.871 . . . . 0.0 111.708 178.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -67.83 -21.22 65.21 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.2 t60 -83.86 -49.39 9.07 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 118.803 0.729 . . . . 0.0 109.339 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 36.0 ttp -57.55 -27.92 63.07 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.189 1.796 . . . . 0.0 113.778 -177.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 17.2 p -70.75 -30.35 66.83 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 119.507 1.049 . . . . 0.0 112.244 174.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 84.1 t60 -92.39 -27.08 17.73 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.831 1.652 . . . . 0.0 112.835 178.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 14.2 t -63.13 153.02 35.63 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.853 1.661 . . . . 0.0 112.776 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -133.15 -7.24 3.02 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.555 1.542 . . . . 0.0 114.23 -179.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -90.55 -22.85 21.09 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.385 0.993 . . . . 0.0 113.012 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.3 -116.61 5.91 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.448 1.023 . . . . 0.0 112.354 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 58.1 tptt -56.4 -24.3 43.91 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.774 1.23 . . . . 0.0 113.211 176.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.48 -1.86 57.41 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.576 1.151 . . . . 0.0 114.043 178.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 20.0 t -62.66 141.88 58.33 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 122.112 0.958 . . . . 0.0 110.586 178.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.7 mm-40 -78.09 -9.4 59.13 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.592 1.157 . . . . 0.0 113.163 -176.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 99.3 t -91.87 114.56 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 173.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.85 -42.99 72.68 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -64.42 -37.88 89.09 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.866 0.866 . . . . 0.0 112.945 -178.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 29.7 t -65.86 -59.59 3.71 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.508 1.523 . . . . 0.0 110.378 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.13 -30.86 64.77 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.874 0.87 . . . . 0.0 112.58 178.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.3 m -75.52 -50.63 15.08 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.757 0.823 . . . . 0.0 112.486 176.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 63.6 m -60.04 -36.39 77.18 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.663 -0.648 . . . . 0.0 111.801 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 48.2 tpt85 -59.81 -29.54 68.31 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.849 0.86 . . . . 0.0 113.047 177.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -70.29 -30.06 66.97 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.72 0.808 . . . . 0.0 111.245 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 6.6 mt -73.45 -44.63 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.168 0.987 . . . . 0.0 109.221 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 24.0 mm -58.71 -39.18 75.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 123.86 0.864 . . . . 0.0 109.887 174.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 4.1 t -60.72 -28.56 68.76 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.037 0.935 . . . . 0.0 113.054 176.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.1 t60 -61.76 -55.25 32.15 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.404 1.002 . . . . 0.0 110.44 177.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 44.2 m95 -61.69 -30.65 70.88 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 178.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -70.29 -27.95 64.81 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.703 0.801 . . . . 0.0 112.703 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -100.05 -38.98 8.34 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 179.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.8 t -75.62 137.66 40.9 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.796 1.638 . . . . 0.0 112.862 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 68.2 p -129.97 4.11 4.89 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.692 1.597 . . . . 0.0 114.045 -178.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 69.8 mtm180 -82.1 158.5 23.69 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.126 1.37 . . . . 0.0 113.551 -178.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 23.9 t60 -95.88 -40.22 9.42 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.34 1.056 . . . . 0.0 109.84 170.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.6 t0 -92.79 69.99 4.73 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.7 1.6 . . . . 0.0 111.655 178.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 52.7 t -123.27 133.65 24.67 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 126.653 1.981 . . . . 0.0 108.412 177.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -59.01 -25.61 78.44 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.709 2.273 . . . . 0.0 114.425 -176.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 6.3 t -92.13 -50.29 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 119.519 1.054 . . . . 0.0 111.649 176.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.4 m -68.86 -41.32 78.58 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -175.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.9 tt -50.75 -57.18 14.31 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.472 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -61.3 -31.77 89.42 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.021 1.814 . . . . 0.0 113.591 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 89.7 mt -70.87 -46.44 62.63 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.76 0.824 . . . . 0.0 111.676 178.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -62.26 -36.74 82.97 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.155 0.982 . . . . 0.0 110.397 176.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 13.9 t30 -69.92 -38.32 76.19 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.29 1.436 . . . . 0.0 112.448 175.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -77.29 -25.65 51.57 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.777 1.028 . . . . 0.0 113.777 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 32.1 t -63.37 150.75 42.71 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.352 1.061 . . . . 0.0 113.302 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -91.68 -5.96 52.88 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.341 1.457 . . . . 0.0 113.246 178.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -80.91 85.13 6.26 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.056 1.343 . . . . 0.0 111.139 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 25.4 mmt85 . . . . . 0 N--CA 1.479 1.015 0 C-N-CA 126.297 1.839 . . . . 0.0 112.33 -178.613 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.436 0 CA-C-O 121.38 0.433 . . . . 0.0 113.786 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.9 p -65.08 139.53 58.73 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.902 1.281 . . . . 0.0 113.976 -177.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -84.26 162.32 20.17 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.422 1.489 . . . . 0.0 111.606 -179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 62.7 ttp -80.97 90.4 5.95 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.972 0.909 . . . . 0.0 111.643 -179.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.18 -15.08 36.96 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -135.31 142.35 41.21 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 125.059 1.344 . . . . 0.0 111.885 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -82.5 -7.99 11.59 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 123.846 3.031 . . . . 0.0 114.086 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -72.48 142.99 48.57 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.639 1.175 . . . . 0.0 113.266 -177.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 66.1 m -142.21 149.62 39.9 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.176 1.79 . . . . 0.0 111.133 178.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 14.4 t70 -100.91 127.25 32.66 Favored Pre-proline 0 CA--C 1.553 1.079 0 C-N-CA 124.432 1.093 . . . . 0.0 111.066 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -79.84 -13.31 13.08 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.525 2.817 . . . . 0.0 115.032 -177.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 19.9 m -90.12 6.89 40.59 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.425 1.49 . . . . 0.0 114.727 -177.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 8.1 p -137.53 146.13 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.869 1.268 . . . . 0.0 112.004 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -146.01 81.81 9.57 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 125.483 1.513 . . . . 0.0 110.668 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -102.1 83.88 0.03 OUTLIER 'Trans proline' 0 CA--C 1.555 1.526 0 C-N-CA 125.301 4.0 . . . . 0.0 114.092 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -75.93 162.74 34.34 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.192 2.595 . . . . 0.0 111.893 177.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 38.5 tp -79.57 144.26 34.04 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.834 0.854 . . . . 0.0 111.49 176.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 40.3 t -129.06 155.02 46.08 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.429 1.492 . . . . 0.0 110.872 177.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -58.77 -27.87 65.39 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.913 0.885 . . . . 0.0 111.097 174.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -83.07 -14.69 53.27 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 124.651 1.18 . . . . 0.0 113.71 178.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 61.4 m -58.68 -59.36 5.53 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.468 1.031 . . . . 0.0 111.433 -179.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -60.03 -21.94 62.0 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.504 0.928 . . . . 0.0 113.504 178.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 21.3 t -79.0 -33.65 44.77 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.32 1.048 . . . . 0.0 112.646 178.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 36.4 t70 -89.77 -26.5 20.57 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.838 0.855 . . . . 0.0 112.104 175.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.7 tt -45.82 -60.06 2.45 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 127.176 2.191 . . . . 0.0 113.367 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.2 p-90 -68.91 -8.96 49.07 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -172.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -111.89 -58.51 2.12 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 -178.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 58.0 mt -120.05 16.29 12.46 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -171.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.6 tt -54.76 136.49 64.56 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 124.915 1.286 . . . . 0.0 113.046 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -78.19 151.69 26.91 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 124.216 3.278 . . . . 0.0 114.297 -177.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -60.57 -16.02 33.62 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.38 1.472 . . . . 0.0 114.959 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 64.2 t30 -81.44 -1.29 45.21 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.848 1.259 . . . . 0.0 113.805 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -65.71 143.87 57.26 Favored 'General case' 0 CA--C 1.549 0.941 0 O-C-N 120.85 -1.156 . . . . 0.0 112.665 -179.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 7.6 p -134.57 21.07 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 125.087 1.355 . . . . 0.0 113.388 -178.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 7.8 tt -79.6 -12.81 59.82 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 120.633 -1.292 . . . . 0.0 113.791 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 6.0 t -62.4 126.06 87.2 Favored Pre-proline 0 N--CA 1.473 0.688 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -175.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.29 131.77 18.3 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 122.537 2.158 . . . . 0.0 109.962 175.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 81.0 mt -76.8 156.24 82.73 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 123.983 0.913 . . . . 0.0 111.654 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -52.25 -34.27 58.79 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.542 2.828 . . . . 0.0 114.961 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 18.3 m -70.13 -10.92 60.33 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.892 1.277 . . . . 0.0 114.276 178.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -131.71 16.95 4.78 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 127.139 2.175 . . . . 0.0 112.25 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -80.3 163.28 24.06 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.19 1.396 . . . . 0.0 114.229 -178.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -107.83 23.28 14.71 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.222 2.609 . . . . 0.0 113.605 -178.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -66.4 -14.55 62.3 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.04 1.336 . . . . 0.0 113.987 -178.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -64.11 -17.57 63.57 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 120.857 -1.152 . . . . 0.0 113.322 176.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 83.8 mt -108.2 13.46 25.79 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 126.976 2.11 . . . . 0.0 113.537 178.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.24 151.61 46.64 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -175.154 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 95.9 mt -125.19 170.28 11.4 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.778 2.831 . . . . 0.0 113.504 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.7 m -90.8 150.43 42.14 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 169.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -53.72 -25.1 32.75 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.069 2.512 . . . . 0.0 115.651 -178.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 35.8 t70 -69.87 -24.08 63.37 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.891 0.876 . . . . 0.0 112.889 178.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -76.17 -18.04 59.28 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.86 0.864 . . . . 0.0 112.361 178.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 93.3 mt -59.5 -34.02 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.59 0.756 . . . . 0.0 109.322 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -71.18 -9.87 58.8 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -84.15 -29.77 26.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.93 0.892 . . . . 0.0 111.521 176.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -96.58 -28.4 14.38 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 176.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -124.3 109.85 13.87 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 170.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 1.4 t -125.07 159.4 31.47 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 -177.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -97.83 177.11 5.56 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.151 1.78 . . . . 0.0 112.483 178.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 12.5 t70 -63.54 128.19 92.32 Favored Pre-proline 0 CA--C 1.555 1.169 0 O-C-N 120.973 -1.079 . . . . 0.0 110.786 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -78.38 -9.11 16.29 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.75 2.966 . . . . 0.0 115.029 -175.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 97.59 -155.68 20.55 Favored Glycine 0 CA--C 1.543 1.799 0 C-N-CA 125.418 1.485 . . . . 0.0 112.947 -177.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -62.31 -16.61 52.38 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 124.449 3.433 . . . . 0.0 115.704 -178.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 24.5 t0 -140.09 161.41 37.69 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.506 1.922 . . . . 0.0 111.218 -178.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 88.55 17.44 56.9 Favored Glycine 0 CA--C 1.536 1.377 0 N-CA-C 115.202 0.841 . . . . 0.0 115.202 179.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 53.3 p -72.99 -0.73 14.6 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.566 1.546 . . . . 0.0 114.8 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 79.7 m -75.8 58.63 1.14 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.818 2.047 . . . . 0.0 111.227 177.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -53.83 -36.24 62.31 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 -175.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -63.98 -19.54 65.23 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 119.53 1.059 . . . . 0.0 113.248 177.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -80.55 -10.0 85.77 Favored Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.82 1.2 . . . . 0.0 113.962 175.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 11.7 t -126.07 -23.57 3.89 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.443 1.497 . . . . 0.0 113.571 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -126.56 130.42 50.51 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.595 1.958 . . . . 0.0 112.567 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 1.7 m -76.26 -16.71 59.75 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.565 1.146 . . . . 0.0 112.588 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 94.0 109.61 2.1 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 126.357 1.932 . . . . 0.0 111.216 -178.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -63.44 -22.4 71.31 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 122.86 2.373 . . . . 0.0 114.134 -177.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 11.2 t -85.07 -18.09 35.4 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 121.218 -0.926 . . . . 0.0 112.529 176.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -100.67 -29.49 12.27 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.332 1.453 . . . . 0.0 114.074 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 12.8 t70 -104.83 110.78 64.91 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 125.309 1.444 . . . . 0.0 111.78 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -60.3 -33.95 94.07 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 123.424 2.75 . . . . 0.0 114.989 -178.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -73.36 -31.13 63.77 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 121.233 -0.917 . . . . 0.0 112.735 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 80.6 tttt -64.94 -30.92 71.94 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.499 0.72 . . . . 0.0 111.581 177.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 70.2 mtp180 -62.38 -41.49 98.68 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.779 0.832 . . . . 0.0 111.122 174.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 42.0 mtmt -59.59 -33.04 70.96 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.065 0.946 . . . . 0.0 112.103 179.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 83.6 mt -65.67 -40.56 92.52 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.963 0.801 . . . . 0.0 112.018 178.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.1 mt -68.35 -51.19 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-N 118.342 0.519 . . . . 0.0 109.677 176.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -55.13 -54.41 43.58 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.576 1.15 . . . . 0.0 110.889 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -34.99 79.49 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.148 -0.97 . . . . 0.0 113.168 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -68.67 -48.99 62.54 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.092 0.86 . . . . 0.0 109.655 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 16.8 tp -59.82 -43.93 94.28 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.425 0.69 . . . . 0.0 111.413 177.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 61.0 t -61.43 -24.98 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 O-C-N 120.64 -1.288 . . . . 0.0 111.331 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 3.7 tp -79.81 -26.09 40.64 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.289 1.404 . . . . 0.0 112.408 172.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.5 mp -60.84 -45.27 95.15 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 120.596 1.544 . . . . 0.0 107.367 170.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.2 mp -61.41 -50.59 72.22 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.307 1.043 . . . . 0.0 111.102 175.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 31.0 t60 -55.61 -57.3 12.54 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.424 1.011 . . . . 0.0 110.285 177.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.59 -30.93 63.76 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.549 1.14 . . . . 0.0 114.032 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 43.1 t60 -75.48 -38.63 59.44 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.522 -0.736 . . . . 0.0 112.04 176.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 42.7 mttm -79.81 -33.62 40.26 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.521 1.128 . . . . 0.0 111.853 -179.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 13.6 t -63.26 -44.77 94.21 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 127.406 2.283 . . . . 0.0 111.677 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -64.74 -38.18 90.12 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 120.726 -1.234 . . . . 0.0 111.727 174.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -65.15 -41.48 94.7 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.671 1.189 . . . . 0.0 111.047 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -40.49 71.31 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.935 1.694 . . . . 0.0 111.678 176.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -76.3 -47.15 24.66 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.123 0.569 . . . . 0.0 111.801 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -59.12 -28.01 66.14 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.746 0.819 . . . . 0.0 112.922 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -66.39 -13.34 60.53 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.183 1.393 . . . . 0.0 114.657 177.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -137.92 -44.69 0.52 Allowed 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.109 1.151 . . . . 0.0 114.109 -177.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 84.44 -15.06 42.7 Favored Glycine 0 CA--C 1.54 1.654 0 C-N-CA 125.665 1.603 . . . . 0.0 116.351 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -114.13 -11.94 12.61 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 119.559 1.68 . . . . 0.0 114.107 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 30.7 m -68.56 156.65 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.315 1.046 . . . . 0.0 112.51 178.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.48 150.22 46.39 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.437 0.695 . . . . 0.0 112.252 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -97.43 169.06 10.0 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.106 1.362 . . . . 0.0 113.696 -179.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -72.21 161.08 31.36 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.658 1.583 . . . . 0.0 113.214 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 50.1 m -115.0 -3.63 12.62 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.343 1.457 . . . . 0.0 114.458 -179.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 36.7 mt -80.62 131.64 60.48 Favored Pre-proline 0 CA--C 1.545 0.779 0 CA-C-N 119.065 0.848 . . . . 0.0 112.988 -179.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.22 -33.06 19.49 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 122.763 2.309 . . . . 0.0 111.289 176.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 35.3 m80 -70.98 -32.32 69.13 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.493 1.117 . . . . 0.0 112.065 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 53.2 t -68.17 -51.03 50.35 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.813 1.245 . . . . 0.0 108.858 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 43.2 ttp-105 -54.42 -39.65 67.53 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.11 1.364 . . . . 0.0 111.283 173.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 18.2 m -65.43 -56.57 11.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.523 1.129 . . . . 0.0 111.394 176.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 19.9 mmt -66.45 -34.54 78.17 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -177.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -65.44 -32.25 73.77 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 120.88 1.673 . . . . 0.0 112.286 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -70.62 -39.71 73.56 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.034 0.534 . . . . 0.0 110.491 174.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 71.5 t -63.77 -46.9 93.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.261 0.625 . . . . 0.0 111.025 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.5 -43.38 93.37 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.647 0.779 . . . . 0.0 111.259 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -68.32 -18.09 64.42 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 176.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 66.6 t60 -88.03 -49.82 6.8 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.535 0.734 . . . . 0.0 109.432 173.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 27.2 ttp -57.15 -27.86 62.25 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.151 1.781 . . . . 0.0 113.616 -178.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 11.4 p -69.37 -26.52 64.7 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 121.114 -0.991 . . . . 0.0 112.641 175.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 68.8 m80 -104.32 -18.65 14.36 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.111 1.765 . . . . 0.0 113.947 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.0 t -62.84 150.77 40.84 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.282 1.433 . . . . 0.0 112.517 -179.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -121.52 -14.79 8.16 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.846 1.658 . . . . 0.0 113.743 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -97.29 -29.33 13.61 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.339 1.056 . . . . 0.0 112.598 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.92 -110.24 1.22 Allowed Glycine 0 CA--C 1.535 1.308 0 C-N-CA 124.484 1.04 . . . . 0.0 113.41 177.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -60.76 -20.27 60.98 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.095 -1.238 . . . . 0.0 113.3 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.49 -0.49 43.28 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.858 1.663 . . . . 0.0 113.588 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.7 t -63.7 142.46 58.39 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 122.106 0.955 . . . . 0.0 110.284 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -81.87 -3.2 53.52 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 86.2 t -89.75 115.81 30.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 173.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.42 -37.29 67.46 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -71.11 -27.36 63.53 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.125 0.97 . . . . 0.0 113.231 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 43.0 t -78.18 -56.86 4.13 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.6 1.56 . . . . 0.0 110.044 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -59.52 -27.69 66.41 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 179.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 16.2 p -77.18 -50.37 13.1 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.394 -0.816 . . . . 0.0 111.587 175.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 57.9 m -61.65 -36.37 80.59 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.524 -0.735 . . . . 0.0 112.55 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -61.1 -31.72 71.4 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 121.664 -0.647 . . . . 0.0 112.655 177.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -66.22 -29.94 70.29 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.018 0.826 . . . . 0.0 111.465 175.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 5.8 mt -76.29 -46.85 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 124.455 1.102 . . . . 0.0 109.807 176.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 33.3 mm -58.48 -36.91 61.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.157 0.983 . . . . 0.0 110.522 175.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 68.9 m -63.95 -21.38 66.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.358 1.063 . . . . 0.0 113.395 177.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.9 t60 -66.15 -57.45 7.62 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.88 1.218 . . . . 0.0 110.843 178.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 43.9 m95 -61.67 -21.25 64.27 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 177.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 92.8 mttt -79.38 -28.38 41.9 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.5 1.12 . . . . 0.0 112.713 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -100.13 -42.89 6.52 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.883 1.273 . . . . 0.0 113.697 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 12.7 t -81.39 133.2 35.38 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.463 1.905 . . . . 0.0 111.652 -178.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.9 p -130.04 -5.18 4.46 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -179.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 74.7 mtp85 -67.15 156.14 36.97 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.1 1.76 . . . . 0.0 114.18 -178.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -85.19 -34.05 22.15 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.846 0.858 . . . . 0.0 111.394 173.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 18.4 t0 -104.45 86.36 2.5 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.727 2.011 . . . . 0.0 111.278 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.0 t -136.5 137.0 22.89 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 126.572 1.949 . . . . 0.0 109.604 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -56.21 -29.11 74.33 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 123.386 2.724 . . . . 0.0 114.632 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 20.1 t -92.24 -54.86 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 CA-C-N 119.276 0.944 . . . . 0.0 111.934 175.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 9.7 m -66.39 -37.64 85.71 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -173.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.29 -57.98 17.48 Favored Pre-proline 0 CA--C 1.548 0.901 0 CA-C-N 120.046 1.294 . . . . 0.0 112.743 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.0 -29.03 87.18 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 121.806 1.671 . . . . 0.0 113.497 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 92.0 mt -70.44 -44.04 68.65 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.555 1.07 . . . . 0.0 111.482 177.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -62.32 -36.51 82.39 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 118.38 0.536 . . . . 0.0 110.766 175.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.0 t30 -69.21 -36.18 76.99 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 124.706 1.202 . . . . 0.0 112.349 176.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -79.07 -25.57 43.09 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.071 1.349 . . . . 0.0 114.203 178.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 45.9 t -57.53 144.07 38.4 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 125.44 1.496 . . . . 0.0 114.383 -177.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 37.3 t70 -82.48 -4.4 57.42 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.183 1.393 . . . . 0.0 112.388 176.166 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -80.22 47.46 0.91 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 126.353 1.861 . . . . 0.0 110.218 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 20.7 ptt-85 . . . . . 0 N--CA 1.476 0.875 0 C-N-CA 128.384 2.674 . . . . 0.0 113.226 -175.037 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.476 0 CA-C-O 121.309 0.394 . . . . 0.0 113.946 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.7 t -80.61 147.32 30.77 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.094 0.957 . . . . 0.0 112.165 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -139.16 150.45 45.63 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.795 1.638 . . . . 0.0 111.61 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 65.8 mtt -73.76 -25.39 60.14 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.76 0.824 . . . . 0.0 112.683 178.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -147.68 141.13 25.36 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.961 1.704 . . . . 0.0 110.081 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -154.64 -51.22 0.02 OUTLIER Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.046 1.338 . . . . 0.0 113.524 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -74.41 -29.24 9.53 Favored 'Trans proline' 0 C--N 1.356 0.93 0 CA-C-N 122.128 1.796 . . . . 0.0 115.222 -178.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -85.89 -14.22 45.51 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 -176.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 71.1 p -81.01 -11.05 59.62 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 7.3 t0 -77.57 119.83 78.99 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 125.235 1.414 . . . . 0.0 110.759 176.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.18 -25.03 58.17 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.517 2.145 . . . . 0.0 113.422 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 24.5 m -76.51 -0.72 24.1 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 2.2 p -76.0 -16.77 15.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 124.012 0.925 . . . . 0.0 113.454 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -70.15 118.04 59.99 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 124.565 1.146 . . . . 0.0 112.816 -178.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -62.72 -38.8 47.13 Favored 'Trans proline' 0 CA--C 1.551 1.334 0 C-N-CA 123.475 2.783 . . . . 0.0 118.853 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -76.03 170.71 19.53 Favored 'Trans proline' 0 C--N 1.356 0.947 0 C-N-CA 122.83 2.353 . . . . 0.0 115.206 -174.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 41.7 tp -68.92 143.4 54.47 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.015 1.326 . . . . 0.0 111.409 177.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 69.5 m -122.64 158.01 30.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.071 1.348 . . . . 0.0 111.899 178.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -56.88 -36.1 69.72 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.934 0.894 . . . . 0.0 112.177 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -70.13 -19.24 63.24 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.328 1.051 . . . . 0.0 113.731 178.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 22.8 m -65.81 -59.98 3.33 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.554 1.07 . . . . 0.0 111.031 -179.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.24 -30.66 69.56 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.754 0.706 . . . . 0.0 112.299 175.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 43.6 m -71.4 -31.37 67.19 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 31.7 t70 -90.11 -28.06 19.22 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.983 1.313 . . . . 0.0 113.391 176.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.5 tt -42.99 -59.99 1.8 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 127.335 2.254 . . . . 0.0 113.347 -177.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.3 p-90 -69.22 -9.43 52.99 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 -174.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -111.98 -59.88 1.93 Allowed 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -178.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 45.8 mt -120.25 20.25 12.02 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -171.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.7 tt -52.0 138.09 35.58 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 125.764 1.626 . . . . 0.0 114.425 -177.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -72.75 168.27 24.97 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 124.749 3.633 . . . . 0.0 115.023 -176.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 22.1 mp0 -61.44 -18.22 57.9 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.983 1.713 . . . . 0.0 115.093 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 50.0 t30 -138.07 129.56 27.87 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.711 1.204 . . . . 0.0 111.442 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -157.9 149.63 21.77 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.953 1.701 . . . . 0.0 110.264 177.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 46.8 t -98.17 -12.17 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 124.892 1.277 . . . . 0.0 114.168 -176.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.98 35.35 0.13 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 125.804 1.641 . . . . 0.0 114.037 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 50.6 m -97.95 107.5 40.93 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 125.471 1.509 . . . . 0.0 113.013 -176.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -74.77 121.97 7.01 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 122.711 2.274 . . . . 0.0 109.726 177.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 83.6 mt -83.24 147.2 52.92 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.022 0.929 . . . . 0.0 113.363 -176.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 79.4 Cg_exo -52.54 -35.37 66.52 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 124.08 3.187 . . . . 0.0 115.253 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 42.5 m -65.88 -15.4 62.9 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -131.22 20.35 4.85 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.112 1.765 . . . . 0.0 111.699 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.67 155.19 40.25 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.968 1.47 . . . . 0.0 114.968 -176.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.43 15.14 12.84 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 128.588 2.755 . . . . 0.0 113.775 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 35.2 t70 -66.92 -13.79 62.13 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.106 1.362 . . . . 0.0 113.649 -179.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.4 t70 -65.21 -17.48 64.52 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 120.759 -1.213 . . . . 0.0 112.218 174.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 25.3 tp -116.03 19.82 14.79 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 127.392 2.277 . . . . 0.0 111.558 178.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.9 tpt -65.1 141.72 58.62 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 -175.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.5 tt -125.05 148.52 48.47 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.438 2.295 . . . . 0.0 111.75 -176.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 43.3 t -72.63 138.88 80.45 Favored Pre-proline 0 N--CA 1.474 0.755 0 C-N-CA 124.101 0.961 . . . . 0.0 111.383 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -57.15 -26.5 69.69 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 122.659 2.239 . . . . 0.0 114.71 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.6 t70 -69.3 -21.35 63.87 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 121.452 -0.78 . . . . 0.0 112.658 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 19.1 t70 -89.97 -9.89 47.07 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.809 1.644 . . . . 0.0 113.699 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 63.0 mt -51.63 -38.42 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 125.031 1.332 . . . . 0.0 111.244 177.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -67.16 -9.74 43.08 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.233 1.413 . . . . 0.0 113.611 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -78.32 -29.63 47.78 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.032 -1.042 . . . . 0.0 111.661 175.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.2 p-90 -96.25 -42.65 8.07 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 118.247 -0.882 . . . . 0.0 112.186 176.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -95.72 109.68 21.93 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 104.921 -2.251 . . . . 0.0 104.921 169.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.81 144.11 33.82 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -170.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -119.97 -179.9 4.06 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.157 2.183 . . . . 0.0 110.013 176.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -63.03 139.83 97.57 Favored Pre-proline 0 CA--C 1.553 1.088 0 O-C-N 120.804 -1.185 . . . . 0.0 112.233 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.32 -8.28 19.57 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.12 3.213 . . . . 0.0 114.932 -177.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 68.23 -173.14 32.88 Favored Glycine 0 CA--C 1.542 1.747 0 C-N-CA 124.529 1.062 . . . . 0.0 114.486 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.31 -20.65 20.91 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.509 2.806 . . . . 0.0 113.673 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -84.34 -28.35 27.11 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.138 0.975 . . . . 0.0 113.453 -179.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 69.8 9.21 62.12 Favored Glycine 0 CA--C 1.539 1.531 0 C-N-CA 124.447 1.022 . . . . 0.0 115.54 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 19.1 m -54.69 -32.77 59.94 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.21 1.404 . . . . 0.0 114.619 -176.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 74.0 m -58.93 -29.89 67.45 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.491 1.116 . . . . 0.0 113.689 -179.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -61.59 -23.08 65.77 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.33 0.968 . . . . 0.0 113.491 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -79.27 -32.16 43.61 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.54 -0.725 . . . . 0.0 111.237 175.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -82.31 -40.48 10.08 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.078 1.323 . . . . 0.0 114.043 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 46.5 p -64.52 -20.9 66.49 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 118.623 1.211 . . . . 0.0 113.527 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -74.0 -21.32 60.03 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.981 0.912 . . . . 0.0 112.695 176.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 73.2 m -84.02 122.11 28.32 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.669 1.187 . . . . 0.0 109.94 178.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 69.26 78.09 0.37 Allowed Glycine 0 CA--C 1.539 1.532 0 C-N-CA 124.319 0.962 . . . . 0.0 112.486 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -58.36 156.72 29.35 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.676 2.917 . . . . 0.0 113.782 -179.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 25.2 p -59.26 -18.61 38.79 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 179.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -84.13 -9.46 58.57 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.688 1.195 . . . . 0.0 113.42 176.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 14.0 t70 -80.79 133.65 54.89 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.267 1.027 . . . . 0.0 111.913 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -57.58 -39.22 90.05 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.815 2.343 . . . . 0.0 114.577 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -63.52 -36.55 84.15 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.058 -1.026 . . . . 0.0 112.034 -179.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 48.5 tptt -60.73 -25.87 66.77 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.6 1.16 . . . . 0.0 112.35 176.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.96 -41.29 11.83 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.666 1.587 . . . . 0.0 110.668 175.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 61.6 mtpt -59.4 -34.16 72.11 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.243 1.017 . . . . 0.0 112.257 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 54.7 mt -62.46 -37.82 87.41 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.332 0.969 . . . . 0.0 111.932 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.9 mt -67.82 -51.82 46.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.709 0.804 . . . . 0.0 109.552 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -54.75 -55.07 33.86 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.656 1.182 . . . . 0.0 111.032 178.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -34.84 78.85 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -177.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -69.35 -45.41 69.46 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.074 0.852 . . . . 0.0 110.518 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 7.2 tp -62.71 -39.36 93.81 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.365 0.666 . . . . 0.0 111.146 178.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 71.7 t -60.51 -31.99 50.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 119.656 1.116 . . . . 0.0 110.987 175.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 7.9 tp -72.62 -28.55 62.82 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 120.714 -1.241 . . . . 0.0 112.299 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.35 -28.54 70.07 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 120.403 1.456 . . . . 0.0 110.178 174.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 1.9 mt -74.15 -51.34 15.87 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.96 0.904 . . . . 0.0 108.772 175.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 20.4 t60 -55.3 -54.77 39.41 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.512 0.725 . . . . 0.0 111.167 177.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.43 -23.16 36.63 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -178.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -90.06 -38.02 13.87 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.274 -0.891 . . . . 0.0 112.318 174.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 52.1 mttm -78.34 -25.04 46.28 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.607 1.563 . . . . 0.0 113.467 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 50.8 t -77.9 -53.48 7.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.418 2.287 . . . . 0.0 111.9 178.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -54.01 -32.59 54.69 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 121.185 -0.947 . . . . 0.0 112.518 177.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -62.63 -33.48 75.1 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.649 1.979 . . . . 0.0 112.602 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.16 -37.88 84.51 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.285 0.948 . . . . 0.0 111.475 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -71.98 -46.88 55.7 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.32 1.048 . . . . 0.0 110.15 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -62.29 -41.4 98.47 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.406 1.082 . . . . 0.0 113.513 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -75.39 -31.78 60.57 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -179.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -87.25 -43.35 12.26 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.948 0.899 . . . . 0.0 113.267 -179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 79.6 -6.67 57.4 Favored Glycine 0 CA--C 1.54 1.638 0 N-CA-C 116.74 1.456 . . . . 0.0 116.74 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -120.12 -43.3 2.54 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.954 1.877 . . . . 0.0 113.338 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 17.3 m -78.08 147.65 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 118.94 0.791 . . . . 0.0 111.692 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -93.55 155.36 17.36 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.715 1.206 . . . . 0.0 112.768 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -82.02 -177.22 6.52 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.053 1.341 . . . . 0.0 112.01 176.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 6.2 m -52.1 146.01 9.53 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 116.164 1.913 . . . . 0.0 116.164 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 65.0 p -93.65 -6.11 47.11 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.345 1.858 . . . . 0.0 111.18 170.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 3.7 tt -61.3 119.08 42.94 Favored Pre-proline 0 CA--C 1.554 1.119 0 C-N-CA 128.284 2.634 . . . . 0.0 108.472 178.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -60.93 -41.12 47.26 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.973 2.449 . . . . 0.0 114.487 -173.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 70.5 m80 -69.12 -29.46 67.53 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.46 -0.775 . . . . 0.0 113.058 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 51.2 t -69.44 -52.61 25.18 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.023 1.329 . . . . 0.0 108.518 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -54.78 -34.81 63.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.378 1.471 . . . . 0.0 111.602 174.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 21.4 m -71.08 -59.02 3.01 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.779 1.231 . . . . 0.0 111.591 176.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 16.0 mmt -62.97 -33.68 75.9 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -64.99 -32.64 74.46 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 120.81 1.641 . . . . 0.0 112.482 177.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -72.79 -38.15 67.35 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.233 0.613 . . . . 0.0 110.452 174.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 96.0 t -63.47 -46.87 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.491 0.587 . . . . 0.0 110.456 176.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -46.47 85.93 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.04 0.836 . . . . 0.0 111.136 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -66.36 -19.52 65.83 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 177.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 65.3 t60 -86.61 -49.38 7.57 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.089 0.858 . . . . 0.0 109.49 173.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 34.9 ttp -57.01 -28.99 62.97 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.445 1.898 . . . . 0.0 113.59 -177.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 16.3 p -70.29 -27.93 64.79 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.954 0.902 . . . . 0.0 112.738 175.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 73.1 m80 -101.62 -18.24 15.98 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.762 1.625 . . . . 0.0 113.906 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 16.8 t -61.5 155.24 22.48 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.183 1.393 . . . . 0.0 112.562 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -126.7 -12.23 6.04 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.782 1.633 . . . . 0.0 113.702 -178.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -96.52 -27.67 14.75 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.351 1.06 . . . . 0.0 112.051 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.23 -114.41 4.19 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.777 1.18 . . . . 0.0 113.406 177.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -62.13 -16.38 52.2 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 121.325 -1.103 . . . . 0.0 113.444 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -98.24 -0.51 43.93 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.342 1.457 . . . . 0.0 113.382 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.6 t -60.32 142.61 54.51 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 122.403 1.097 . . . . 0.0 110.634 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.0 mm-40 -77.86 -9.44 59.06 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.696 1.198 . . . . 0.0 113.015 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 99.8 t -88.58 115.22 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.6 -41.76 66.97 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -65.76 -41.49 92.03 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.505 0.722 . . . . 0.0 112.884 -179.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 41.1 t -61.35 -56.4 20.82 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.718 1.207 . . . . 0.0 110.665 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.42 -30.97 69.96 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.293 0.637 . . . . 0.0 112.632 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 74.7 m -71.64 -51.05 25.15 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.981 0.912 . . . . 0.0 111.161 176.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 33.6 m -58.38 -36.61 73.77 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.952 0.901 . . . . 0.0 112.146 176.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.24 -30.46 71.12 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 118.092 -0.956 . . . . 0.0 113.179 175.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -69.11 -27.46 65.6 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.664 1.12 . . . . 0.0 110.828 176.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.3 mm -74.29 -48.41 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.772 0.829 . . . . 0.0 109.58 175.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 20.2 mm -59.14 -40.56 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.403 1.081 . . . . 0.0 110.714 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 49.9 m -62.14 -22.25 65.71 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.961 0.904 . . . . 0.0 113.068 177.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.3 t60 -66.52 -56.95 8.47 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.514 1.052 . . . . 0.0 109.966 176.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 42.9 m95 -61.47 -32.66 72.67 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.273 0.942 . . . . 0.0 112.966 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -65.45 -28.55 69.31 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.352 -0.843 . . . . 0.0 112.948 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -100.02 -50.02 4.13 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.776 1.23 . . . . 0.0 114.271 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 11.1 t -79.87 132.21 36.04 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.629 1.972 . . . . 0.0 112.525 -176.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 4.4 t -130.14 -2.36 4.54 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.2 1.4 . . . . 0.0 113.872 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 83.5 mtt-85 -69.51 145.74 52.43 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.94 1.296 . . . . 0.0 113.478 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 85.0 t60 -79.79 -34.72 39.41 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 169.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -86.5 69.95 10.42 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.764 1.625 . . . . 0.0 112.14 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 53.7 t -136.28 133.06 19.24 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 126.055 1.742 . . . . 0.0 109.743 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -58.83 -25.07 75.05 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 122.86 2.373 . . . . 0.0 114.149 -178.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 17.6 t -92.17 -51.66 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 119.28 0.945 . . . . 0.0 111.961 176.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.4 m -71.28 -35.66 71.42 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -174.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.37 -56.56 25.21 Favored Pre-proline 0 N--CA 1.474 0.749 0 CA-C-N 119.773 1.169 . . . . 0.0 113.204 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -60.52 -33.49 93.74 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.032 1.821 . . . . 0.0 113.089 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 94.9 mt -68.4 -45.56 72.34 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.973 0.806 . . . . 0.0 111.565 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 55.4 mttm -61.94 -45.01 95.57 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.911 0.884 . . . . 0.0 109.834 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 19.2 t30 -61.38 -40.9 96.04 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.938 1.295 . . . . 0.0 112.411 176.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -76.43 -19.36 58.16 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.468 1.107 . . . . 0.0 113.935 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 25.1 p -67.42 152.64 45.33 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -177.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -69.11 -27.14 65.32 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.178 0.991 . . . . 0.0 113.615 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -89.06 -18.77 26.62 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.543 1.137 . . . . 0.0 113.058 178.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 . . . . . 0 N--CA 1.476 0.873 0 C-N-CA 125.865 1.666 . . . . 0.0 110.44 179.497 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.494 0 N-CA-C 114.74 0.656 . . . . 0.0 114.74 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.9 p -74.89 -19.0 60.33 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.247 1.419 . . . . 0.0 113.925 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -138.15 159.11 42.88 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.836 2.055 . . . . 0.0 110.888 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 45.3 ttp -80.08 59.02 3.14 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.651 1.18 . . . . 0.0 111.457 178.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -91.46 -3.82 56.22 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.592 1.557 . . . . 0.0 114.071 -178.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -72.82 148.28 89.52 Favored Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 124.927 1.291 . . . . 0.0 112.65 178.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -69.21 150.13 71.18 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 123.172 2.581 . . . . 0.0 112.704 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -132.28 18.97 4.42 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.226 1.411 . . . . 0.0 113.728 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 41.3 p -78.44 -19.6 52.83 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.053 1.341 . . . . 0.0 114.317 -179.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 14.4 t70 -75.2 132.17 76.98 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 124.282 1.033 . . . . 0.0 110.936 178.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.73 -12.4 34.48 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 123.422 2.748 . . . . 0.0 115.376 -177.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 1.6 t -106.47 8.43 31.47 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.895 1.678 . . . . 0.0 113.531 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 6.4 p -67.01 141.12 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 O-C-N 120.754 -1.217 . . . . 0.0 112.405 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -153.44 148.37 19.76 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 124.672 1.189 . . . . 0.0 111.816 177.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -60.07 -44.31 30.38 Favored 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 123.054 2.502 . . . . 0.0 117.26 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -86.24 -179.9 3.34 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 123.503 2.802 . . . . 0.0 113.875 -176.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 7.4 tt -97.18 137.1 36.73 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.765 1.626 . . . . 0.0 110.52 176.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 51.1 m -82.64 141.66 32.33 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.399 1.08 . . . . 0.0 111.683 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 21.0 mm100 -56.13 -33.09 64.83 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -178.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -69.25 -18.12 63.84 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 178.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 87.1 m -61.17 -60.07 4.33 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.284 0.947 . . . . 0.0 110.698 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -60.21 -31.85 70.55 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 49.9 m -68.45 -34.52 76.11 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.76 0.709 . . . . 0.0 112.804 178.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.1 t70 -90.3 -24.32 20.92 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 174.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.6 tt -46.09 -60.08 2.49 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.233 1.813 . . . . 0.0 113.588 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 51.0 p-90 -65.11 -10.24 29.08 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -173.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 58.4 pttt -111.97 -53.46 2.7 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 6.2 mp -120.16 20.03 12.11 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 116.774 2.138 . . . . 0.0 116.774 -175.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.81 140.1 29.91 Favored Pre-proline 0 N--CA 1.483 1.217 0 O-C-N 120.223 -1.548 . . . . 0.0 114.885 -178.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -79.5 159.79 25.55 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 124.04 3.16 . . . . 0.0 113.541 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 12.7 mp0 -66.84 -25.59 66.5 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.899 1.28 . . . . 0.0 112.802 177.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 49.5 t30 -82.16 75.21 9.09 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.252 1.421 . . . . 0.0 112.154 -179.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 8.2 p30 -147.89 153.93 39.74 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.835 1.254 . . . . 0.0 111.645 177.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 34.2 m -136.18 18.98 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 C-N-CA 125.264 1.425 . . . . 0.0 113.733 -178.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 40.2 tp -82.0 -10.3 59.29 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -175.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 2.8 p -63.74 119.47 54.68 Favored Pre-proline 0 CA--C 1.547 0.844 0 O-C-N 120.671 -1.268 . . . . 0.0 113.372 -179.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -76.29 146.75 28.52 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.014 2.476 . . . . 0.0 111.03 177.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 10.3 mp -69.62 138.41 88.46 Favored Pre-proline 0 CA--C 1.547 0.832 0 CA-C-O 118.102 -0.951 . . . . 0.0 110.238 178.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -53.5 -29.95 51.79 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.235 2.623 . . . . 0.0 115.127 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 54.3 p -80.77 -12.31 59.47 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.636 1.575 . . . . 0.0 114.199 177.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -119.0 -16.83 9.15 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.054 1.741 . . . . 0.0 113.59 -178.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -64.08 157.88 24.2 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.614 1.566 . . . . 0.0 114.206 -177.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -73.28 23.99 0.07 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 128.415 2.686 . . . . 0.0 114.668 178.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 31.0 t70 -68.86 -20.36 64.27 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.816 1.246 . . . . 0.0 113.873 -178.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -63.96 -16.34 61.32 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 121.057 -1.027 . . . . 0.0 113.278 178.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 27.4 tp -110.16 7.87 23.53 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 126.853 2.061 . . . . 0.0 111.968 178.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 10.8 tpt -70.95 147.87 48.27 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 14.5 mt -118.81 160.9 21.06 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.852 1.661 . . . . 0.0 113.144 -178.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 43.3 t -71.71 145.0 89.13 Favored Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 169.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -58.19 -14.76 20.65 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 123.095 2.53 . . . . 0.0 116.357 -175.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -72.93 -22.99 60.64 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.32 -0.862 . . . . 0.0 112.886 177.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 14.9 t70 -84.8 -10.08 57.55 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.406 1.082 . . . . 0.0 113.006 178.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 91.7 mt -56.59 -34.94 43.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.569 1.148 . . . . 0.0 110.584 176.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -73.45 -9.89 59.16 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.819 1.248 . . . . 0.0 113.641 178.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -84.33 -24.61 29.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.067 0.947 . . . . 0.0 112.773 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -72.29 -48.71 40.3 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.476 1.034 . . . . 0.0 111.756 -179.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -87.14 109.96 19.8 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 176.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 1.5 m -54.25 134.1 44.77 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 -172.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -105.65 173.71 6.19 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.424 1.889 . . . . 0.0 112.428 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 13.1 t70 -64.93 131.98 95.35 Favored Pre-proline 0 CA--C 1.556 1.181 0 O-C-N 121.122 -0.986 . . . . 0.0 111.743 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -75.25 -11.7 21.04 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 123.725 2.95 . . . . 0.0 115.467 -177.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 69.68 -168.44 46.43 Favored Glycine 0 CA--C 1.543 1.807 0 C-N-CA 124.291 0.948 . . . . 0.0 113.643 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -73.73 -19.17 21.49 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.541 2.827 . . . . 0.0 113.708 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 19.4 t70 -87.77 -56.54 3.3 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.773 1.229 . . . . 0.0 112.829 -179.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 62.67 9.31 25.29 Favored Glycine 0 CA--C 1.533 1.216 0 N-CA-C 118.14 2.016 . . . . 0.0 118.14 177.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 70.8 m -70.45 117.51 12.08 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 120.4 2.1 . . . . 0.0 108.277 175.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 20.9 p -77.97 165.4 24.11 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.571 1.549 . . . . 0.0 113.997 -176.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -133.42 169.85 16.34 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.088 1.355 . . . . 0.0 114.061 -173.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 66.4 m-20 -63.97 144.03 57.4 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 121.486 -0.759 . . . . 0.0 109.333 174.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . 93.38 -12.31 69.92 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.556 1.074 . . . . 0.0 113.051 -175.184 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 11.1 t -130.08 -46.98 1.12 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.389 1.476 . . . . 0.0 110.867 174.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -74.17 -38.35 63.71 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.939 0.896 . . . . 0.0 111.886 175.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 41.4 p -85.16 -10.26 56.91 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.53 1.532 . . . . 0.0 113.465 179.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -154.54 81.21 0.18 Allowed Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.295 1.426 . . . . 0.0 112.302 179.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -63.04 171.68 5.88 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.152 3.234 . . . . 0.0 113.37 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 35.4 p -55.61 -23.46 27.65 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -86.13 -5.72 59.15 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.968 1.307 . . . . 0.0 113.707 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 16.2 t70 -74.1 138.6 75.74 Favored Pre-proline 0 CA--C 1.549 0.915 0 O-C-N 120.736 -1.227 . . . . 0.0 111.575 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.58 -41.16 80.58 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.802 2.335 . . . . 0.0 114.04 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -67.91 -41.91 81.93 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 121.231 -0.918 . . . . 0.0 111.883 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 20.7 tptm -58.68 -35.05 71.98 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.873 0.869 . . . . 0.0 111.501 177.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 78.4 mtm180 -76.76 -43.96 34.92 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.088 1.355 . . . . 0.0 111.311 175.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -56.72 -35.22 68.3 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.252 1.021 . . . . 0.0 112.111 175.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 57.3 mt -59.63 -37.94 80.01 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.202 0.91 . . . . 0.0 112.016 177.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 2.2 mt -67.1 -54.59 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 118.703 0.683 . . . . 0.0 109.245 175.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -52.71 -51.75 59.1 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.462 1.105 . . . . 0.0 112.011 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -35.17 78.63 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.338 -0.851 . . . . 0.0 113.178 -179.087 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -71.41 -42.54 68.17 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.569 1.077 . . . . 0.0 109.693 178.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.5 tt -61.81 -44.44 96.86 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.706 1.602 . . . . 0.0 110.723 178.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 89.1 t -61.81 -26.64 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 O-C-N 120.589 -1.32 . . . . 0.0 110.904 174.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.78 -27.53 58.04 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 120.465 -1.397 . . . . 0.0 111.939 173.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.7 mp -61.14 -41.17 96.24 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.478 1.49 . . . . 0.0 107.878 169.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.84 -48.72 73.31 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.503 -0.76 . . . . 0.0 111.074 176.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 15.3 t60 -55.13 -52.47 63.18 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.033 0.833 . . . . 0.0 109.743 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -60.08 -24.34 64.52 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -178.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -88.26 -29.03 20.72 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.16 0.891 . . . . 0.0 112.467 175.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 59.7 mttm -85.37 -39.56 17.47 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.52 1.528 . . . . 0.0 113.084 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 43.8 t -60.62 -44.6 96.16 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.362 1.865 . . . . 0.0 110.755 176.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -65.45 -38.85 91.04 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 121.415 -0.803 . . . . 0.0 112.069 174.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -69.18 -35.97 76.84 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.665 1.186 . . . . 0.0 111.84 -179.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -56.52 -42.42 78.38 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.147 1.779 . . . . 0.0 111.704 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -74.65 -38.85 62.37 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.002 0.521 . . . . 0.0 111.352 177.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -64.79 -36.32 83.94 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.472 -0.768 . . . . 0.0 111.864 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -81.18 -25.61 36.65 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.493 1.517 . . . . 0.0 113.782 179.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -140.02 109.48 6.23 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.565 1.146 . . . . 0.0 112.544 -177.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . -69.8 -10.92 65.27 Favored Glycine 0 CA--C 1.539 1.576 0 N-CA-C 115.518 0.967 . . . . 0.0 115.518 178.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -82.81 -8.11 59.61 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 119.086 1.443 . . . . 0.0 113.286 179.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 35.8 m -131.46 163.16 37.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 125.934 1.694 . . . . 0.0 112.042 179.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 50.4 ptt85 -124.94 161.9 25.62 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 125.306 1.442 . . . . 0.0 113.208 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -68.16 157.73 34.73 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.04 0.936 . . . . 0.0 109.812 173.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 1.9 p -74.54 175.16 8.06 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -177.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 72.1 p -105.35 9.35 33.82 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.277 1.831 . . . . 0.0 114.394 -178.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 14.7 tp -66.76 130.54 94.01 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 124.557 1.143 . . . . 0.0 111.261 -179.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -64.79 -37.59 34.66 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.769 2.313 . . . . 0.0 113.549 -177.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 44.8 m80 -71.26 -32.89 69.26 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.463 -0.773 . . . . 0.0 112.286 177.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 42.0 t -65.12 -51.16 62.93 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.847 0.748 . . . . 0.0 109.174 174.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -53.6 -34.3 57.93 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.064 1.346 . . . . 0.0 111.972 174.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 52.7 m -73.6 -61.06 1.97 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.162 0.985 . . . . 0.0 111.679 176.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 21.9 mmm -64.28 -30.21 71.27 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 -175.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -65.31 -34.34 78.1 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 120.727 1.603 . . . . 0.0 112.084 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -70.8 -37.27 73.26 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.41 0.684 . . . . 0.0 110.353 175.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 90.3 t -64.6 -48.63 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.578 0.751 . . . . 0.0 110.379 176.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.13 -43.57 91.99 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.976 0.911 . . . . 0.0 111.703 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -68.66 -17.13 64.03 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 177.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 72.0 t60 -90.13 -50.84 5.77 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.727 1.211 . . . . 0.0 109.997 174.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 38.7 ttp -57.31 -26.46 60.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.581 1.953 . . . . 0.0 113.513 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 2.8 p -60.31 -35.45 75.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.803 1.241 . . . . 0.0 112.886 176.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -111.94 -10.2 13.98 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.86 1.264 . . . . 0.0 114.322 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 43.4 t -63.55 129.85 41.91 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 119.105 0.866 . . . . 0.0 111.434 178.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -101.05 -16.12 17.21 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.103 1.361 . . . . 0.0 114.072 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.31 -31.13 20.36 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.024 0.829 . . . . 0.0 111.758 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.36 -110.77 1.48 Allowed Glycine 0 CA--C 1.532 1.114 0 C-N-CA 124.494 1.045 . . . . 0.0 112.94 178.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 97.0 mttt -60.53 -20.39 60.13 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 121.384 -1.068 . . . . 0.0 113.187 177.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -96.54 -2.36 45.21 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.621 1.568 . . . . 0.0 113.567 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.7 t -62.5 142.38 57.96 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.145 0.974 . . . . 0.0 110.011 177.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -81.62 -5.28 57.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.254 1.022 . . . . 0.0 113.565 -176.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.0 t -89.22 115.44 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.91 -43.56 73.37 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -62.63 -38.19 89.27 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.509 0.724 . . . . 0.0 112.872 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 44.6 t -67.13 -57.74 6.21 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.488 1.515 . . . . 0.0 110.165 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -55.21 -36.39 65.91 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.033 0.933 . . . . 0.0 112.439 178.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 13.1 m -69.95 -51.56 31.7 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 124.045 0.938 . . . . 0.0 112.394 175.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 70.2 m -61.09 -37.35 82.43 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.19 -0.944 . . . . 0.0 112.066 -179.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.41 -33.78 68.23 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.141 0.976 . . . . 0.0 112.165 176.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -67.46 -31.02 70.89 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.934 0.893 . . . . 0.0 112.057 177.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.5 mt -77.46 -45.33 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-N 118.514 0.597 . . . . 0.0 110.01 176.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 28.5 mm -58.37 -38.58 70.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.832 0.853 . . . . 0.0 110.011 176.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 67.9 m -62.23 -24.98 67.56 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.17 0.988 . . . . 0.0 113.222 176.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.1 t60 -64.81 -55.88 16.91 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.836 1.198 . . . . 0.0 109.526 176.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 48.4 m95 -59.27 -33.48 71.1 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 178.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -68.41 -30.14 68.99 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 177.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -100.09 -34.86 9.89 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.5 t -75.86 131.58 39.79 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.41 1.484 . . . . 0.0 112.95 -175.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 67.7 p -130.07 0.6 4.72 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 126.022 1.729 . . . . 0.0 113.421 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 47.6 ttt85 -74.73 135.67 41.79 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.79 1.636 . . . . 0.0 111.22 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 43.2 p-80 -75.33 -36.6 61.01 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 121.897 -0.502 . . . . 0.0 112.166 178.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -101.74 69.98 1.23 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.546 1.538 . . . . 0.0 112.462 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 44.7 t -114.62 132.79 22.71 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 126.546 1.938 . . . . 0.0 108.427 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -59.12 -26.17 80.69 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.899 2.4 . . . . 0.0 115.03 -176.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 41.8 t -92.22 -49.59 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-N 119.232 0.923 . . . . 0.0 111.601 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 13.0 m -68.88 -43.99 74.16 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.297 1.221 . . . . 0.0 114.297 -176.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.1 tt -53.21 -56.57 22.77 Favored Pre-proline 0 CA--C 1.548 0.877 0 CA-C-O 117.891 -1.052 . . . . 0.0 113.105 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -60.95 -32.68 92.72 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 121.873 1.716 . . . . 0.0 113.188 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 92.6 mt -70.16 -44.06 69.57 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.215 0.916 . . . . 0.0 111.637 177.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -60.44 -37.71 81.81 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.496 1.119 . . . . 0.0 110.731 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 17.3 t30 -73.43 -41.32 63.41 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.653 1.581 . . . . 0.0 113.087 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -79.33 -31.12 43.04 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -177.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 40.2 t -66.66 143.58 56.89 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -177.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -87.26 -11.42 49.7 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.386 1.074 . . . . 0.0 112.173 175.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -85.57 36.99 0.67 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 126.076 1.75 . . . . 0.0 112.542 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 33.8 ptt-85 . . . . . 0 N--CA 1.475 0.821 0 C-N-CA 127.099 2.16 . . . . 0.0 114.256 -178.108 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.415 0 N-CA-C 114.816 0.686 . . . . 0.0 114.816 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.5 m -69.24 -15.8 63.45 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.272 1.429 . . . . 0.0 114.368 -179.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -145.52 150.29 36.17 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.281 1.832 . . . . 0.0 111.065 179.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 26.3 mmt -129.09 145.52 51.26 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.661 1.584 . . . . 0.0 111.197 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.73 -28.96 62.96 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.958 0.903 . . . . 0.0 113.183 -179.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -136.66 154.23 76.42 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 125.502 1.521 . . . . 0.0 111.831 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -60.56 152.29 69.43 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 123.531 2.82 . . . . 0.0 113.971 179.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -72.03 -28.5 63.4 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.964 0.905 . . . . 0.0 112.556 178.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 79.0 p -150.02 164.71 34.79 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.144 1.778 . . . . 0.0 111.731 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 21.6 t70 -139.74 123.0 10.51 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 124.851 1.261 . . . . 0.0 111.483 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -81.22 -26.07 3.6 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.04 2.493 . . . . 0.0 113.696 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 16.2 m -59.7 -19.74 51.76 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.963 1.705 . . . . 0.0 115.461 -176.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 9.8 p -72.62 -20.83 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.049 0.939 . . . . 0.0 112.544 177.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -91.28 133.02 32.34 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 124.59 1.156 . . . . 0.0 111.788 179.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -56.31 -47.89 22.03 Favored 'Trans proline' 0 CA--C 1.553 1.44 0 C-N-CA 122.954 2.436 . . . . 0.0 115.608 178.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -79.29 165.56 23.35 Favored 'Trans proline' 0 C--N 1.356 0.946 0 C-N-CA 122.859 2.373 . . . . 0.0 112.453 178.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 72.6 mt -63.19 139.56 58.78 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 121.652 -0.655 . . . . 0.0 111.325 175.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 56.2 p -68.04 -24.82 65.13 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 169.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 13.4 mp0 -81.1 -2.11 46.97 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 128.973 2.909 . . . . 0.0 114.081 175.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.21 -11.34 49.25 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 122.042 2.201 . . . . 0.0 111.338 174.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 9.6 t -48.06 -29.08 3.23 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.195 2.198 . . . . 0.0 111.388 170.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -50.73 -31.95 18.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.089 1.356 . . . . 0.0 112.998 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 26.9 m -72.58 -30.84 64.74 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.932 0.893 . . . . 0.0 113.153 178.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 30.8 t70 -90.28 -30.15 17.69 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.53 1.532 . . . . 0.0 113.277 174.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 1.8 tt -45.68 -60.03 2.43 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 128.276 2.63 . . . . 0.0 112.969 -175.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 46.4 p-90 -63.33 -13.85 43.4 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -174.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -112.07 -52.33 2.79 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 117.557 2.428 . . . . 0.0 117.557 -177.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 69.8 mt -120.03 20.46 12.11 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 116.319 1.97 . . . . 0.0 116.319 -169.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 12.9 tp -51.8 135.69 36.23 Favored Pre-proline 0 CA--C 1.549 0.931 0 N-CA-C 115.911 1.819 . . . . 0.0 115.911 -172.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -77.33 162.53 30.95 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 123.321 2.68 . . . . 0.0 110.515 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -77.89 -15.9 58.66 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 120.813 -1.18 . . . . 0.0 113.556 179.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 48.4 t30 -92.85 87.61 5.89 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.958 1.303 . . . . 0.0 111.581 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -151.4 151.24 31.43 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.193 1.397 . . . . 0.0 111.075 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 29.1 m -127.02 13.53 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -178.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 26.9 tp -75.69 -10.6 59.57 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.905 -1.122 . . . . 0.0 113.512 178.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 5.5 m -52.15 114.55 5.57 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 125.941 1.696 . . . . 0.0 113.358 -178.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.04 132.29 21.0 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 122.255 1.97 . . . . 0.0 110.243 178.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 21.3 tp -74.1 130.62 82.4 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 124.274 1.029 . . . . 0.0 111.154 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -51.71 -32.05 43.8 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 123.818 3.012 . . . . 0.0 116.295 -177.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 73.5 p -72.57 -14.3 61.59 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 178.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -128.78 13.9 6.39 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.345 1.858 . . . . 0.0 112.344 179.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -73.16 161.72 30.25 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.064 1.345 . . . . 0.0 114.221 -177.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.58 17.81 3.09 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.673 2.389 . . . . 0.0 113.59 178.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -66.79 -14.12 62.27 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.404 1.482 . . . . 0.0 114.752 -177.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 37.3 t70 -68.42 -16.16 63.81 Favored 'General case' 0 CA--C 1.55 0.954 0 O-C-N 121.127 -0.983 . . . . 0.0 112.447 176.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 21.7 tp -117.81 20.4 13.39 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 127.344 2.258 . . . . 0.0 111.641 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 6.8 tpt -70.25 143.97 51.97 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 116.369 1.988 . . . . 0.0 116.369 -174.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 71.2 mt -125.02 153.15 43.27 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 127.015 2.126 . . . . 0.0 113.63 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 37.0 p -81.61 161.91 59.91 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 123.454 0.702 . . . . 0.0 110.075 171.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -59.67 -21.35 62.5 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.468 2.112 . . . . 0.0 114.869 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -76.66 -22.04 54.58 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.727 0.811 . . . . 0.0 113.099 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -80.18 -19.4 47.19 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.751 0.82 . . . . 0.0 112.664 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 64.7 mt -55.03 -38.07 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.869 1.668 . . . . 0.0 111.57 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -67.82 -9.87 48.11 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -82.88 -26.75 31.26 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.943 0.897 . . . . 0.0 112.36 177.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . 0.273 4.2 p-90 -102.8 -25.45 13.51 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -120.5 109.62 15.51 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 103.709 -2.7 . . . . 0.0 103.709 169.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 4.2 m -125.19 146.31 49.57 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.645 0.778 . . . . 0.0 112.872 -171.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -75.07 162.19 28.76 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.231 1.012 . . . . 0.0 111.939 177.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 11.9 t70 -64.73 125.7 89.39 Favored Pre-proline 0 CA--C 1.555 1.141 0 O-C-N 121.264 -0.897 . . . . 0.0 111.657 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -83.24 0.27 9.61 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 124.104 3.202 . . . . 0.0 115.332 -176.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 89.81 174.08 45.52 Favored Glycine 0 CA--C 1.541 1.675 0 C-N-CA 125.603 1.573 . . . . 0.0 113.474 -177.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -64.77 -23.06 63.22 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 123.773 2.982 . . . . 0.0 114.278 -178.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -91.17 -4.9 55.69 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.689 1.196 . . . . 0.0 113.138 177.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -84.11 92.59 1.71 Allowed Glycine 0 C--N 1.34 0.756 0 C-N-CA 124.939 1.257 . . . . 0.0 114.029 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 69.4 m -68.73 123.78 21.86 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 173.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 27.6 p -91.91 160.19 15.4 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.65 1.18 . . . . 0.0 113.479 -176.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -138.59 167.04 22.8 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.975 1.71 . . . . 0.0 111.325 -176.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 55.3 t30 -56.36 -30.82 63.15 Favored 'General case' 0 CA--C 1.551 0.986 0 O-C-N 121.001 -1.062 . . . . 0.0 112.468 177.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -81.77 -8.53 86.68 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.88 1.228 . . . . 0.0 115.488 177.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 78.5 p -124.99 -25.86 3.8 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 119.747 1.773 . . . . 0.0 114.757 -178.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -74.25 141.42 45.36 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.616 1.166 . . . . 0.0 111.538 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 72.5 p -100.2 -28.03 13.21 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -177.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -87.19 -71.98 1.29 Allowed Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.489 1.519 . . . . 0.0 113.515 -179.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -76.24 24.69 0.44 Allowed 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 124.936 3.757 . . . . 0.0 114.405 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 2.7 m -58.93 117.06 4.22 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.379 1.472 . . . . 0.0 111.33 -179.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -93.45 -21.34 19.55 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.71 1.204 . . . . 0.0 112.225 178.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 14.7 t70 -69.87 122.28 85.47 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 124.697 1.199 . . . . 0.0 111.351 178.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -75.05 -29.98 7.58 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.737 2.291 . . . . 0.0 113.728 -178.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -60.27 -40.89 91.98 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.229 -0.919 . . . . 0.0 111.779 179.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -56.46 -34.0 66.44 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 119.839 1.199 . . . . 0.0 112.43 177.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -76.28 -43.27 42.44 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.794 0.838 . . . . 0.0 111.285 175.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -61.86 -36.07 80.15 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.898 0.879 . . . . 0.0 111.892 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 64.3 mt -68.87 -38.45 79.73 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.659 1.184 . . . . 0.0 111.259 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 48.4 mt -61.76 -50.65 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 118.858 0.754 . . . . 0.0 109.257 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -56.01 -54.73 41.37 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.593 0.757 . . . . 0.0 111.039 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -35.21 80.3 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -177.06 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -68.36 -47.66 66.83 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.259 0.936 . . . . 0.0 109.892 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 10.7 tp -60.37 -39.29 86.7 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.479 0.711 . . . . 0.0 111.296 177.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 90.5 t -62.21 -31.12 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.791 1.178 . . . . 0.0 110.966 175.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.6 tp -73.61 -29.53 62.43 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.658 -1.276 . . . . 0.0 111.984 174.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.71 -29.8 69.57 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 120.219 1.372 . . . . 0.0 109.901 173.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.5 mt -74.19 -51.88 14.16 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.696 0.798 . . . . 0.0 109.302 175.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 24.4 t60 -55.07 -52.99 61.48 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.38 0.672 . . . . 0.0 111.597 178.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -59.12 -23.24 61.96 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -178.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -90.1 -32.88 16.49 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.171 0.896 . . . . 0.0 112.088 173.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 49.5 mttm -74.85 -38.24 62.04 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.842 1.257 . . . . 0.0 112.198 177.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 26.0 t -61.12 -50.0 74.98 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.22 2.208 . . . . 0.0 110.951 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -62.5 -37.34 85.64 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 121.33 -0.856 . . . . 0.0 112.216 175.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -65.23 -43.75 90.42 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.227 1.011 . . . . 0.0 111.229 175.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -59.72 -42.91 94.18 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.773 1.629 . . . . 0.0 111.308 177.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -65.17 -46.46 80.75 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 122.736 0.415 . . . . 0.0 110.877 177.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -63.79 -37.01 85.76 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.031 0.932 . . . . 0.0 112.735 178.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -66.3 -37.61 85.82 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.438 1.095 . . . . 0.0 113.401 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -89.61 -45.57 9.27 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.168 0.987 . . . . 0.0 113.079 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 76.53 -10.69 16.19 Favored Glycine 0 CA--C 1.541 1.691 0 N-CA-C 117.169 1.628 . . . . 0.0 117.169 178.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -108.79 -36.2 6.2 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.982 1.891 . . . . 0.0 113.205 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 34.0 m -74.76 163.66 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.478 1.111 . . . . 0.0 112.296 177.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -112.41 143.85 42.85 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.285 1.434 . . . . 0.0 111.097 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -73.09 174.92 7.24 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.024 1.33 . . . . 0.0 113.32 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 23.8 m -51.24 148.6 4.55 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.119 2.168 . . . . 0.0 116.463 -178.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 64.6 p -92.26 -5.4 52.46 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.245 1.818 . . . . 0.0 111.815 172.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 8.0 mt -58.53 120.99 49.64 Favored Pre-proline 0 CA--C 1.543 0.71 0 C-N-CA 126.056 1.742 . . . . 0.0 111.082 178.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 44.4 Cg_exo -57.74 -38.46 92.95 Favored 'Trans proline' 0 CA--C 1.536 0.58 0 C-N-CA 122.805 2.337 . . . . 0.0 112.002 177.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 59.5 m80 -73.05 -33.56 65.76 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.584 1.154 . . . . 0.0 113.623 179.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 45.3 t -67.4 -50.81 57.98 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.41 1.084 . . . . 0.0 108.389 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -55.82 -37.53 68.8 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.418 1.487 . . . . 0.0 111.433 173.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 16.3 m -67.96 -60.08 2.78 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.289 1.035 . . . . 0.0 111.241 176.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.8 mmt -62.17 -35.13 77.87 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -64.7 -32.52 74.23 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 120.922 1.692 . . . . 0.0 112.567 177.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 31.5 m-80 -72.87 -38.62 66.94 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.173 0.589 . . . . 0.0 110.592 174.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 58.1 t -63.76 -47.17 92.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-N 118.597 0.635 . . . . 0.0 110.558 176.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -44.94 86.22 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.54 0.736 . . . . 0.0 110.864 178.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -66.77 -17.66 64.98 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 176.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 70.7 t60 -90.04 -49.08 6.79 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.021 0.928 . . . . 0.0 109.951 173.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.1 ttp -56.47 -28.45 59.74 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.579 1.951 . . . . 0.0 113.258 -178.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 14.7 p -67.91 -29.4 68.47 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.383 1.073 . . . . 0.0 112.814 175.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -97.85 -28.9 13.64 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.645 1.578 . . . . 0.0 112.532 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 24.6 t -63.77 133.71 53.98 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.94 1.296 . . . . 0.0 112.966 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -109.25 -11.94 14.83 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.42 1.488 . . . . 0.0 113.833 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -87.53 -29.95 20.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.883 0.873 . . . . 0.0 111.409 178.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 54.41 -112.78 2.88 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.507 1.051 . . . . 0.0 112.963 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 59.5 tttm -60.86 -20.48 61.93 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.44 -1.035 . . . . 0.0 112.855 177.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -93.28 -2.64 54.79 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.955 1.302 . . . . 0.0 113.47 176.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 22.7 t -59.87 142.91 52.67 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 122.384 1.088 . . . . 0.0 110.277 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -78.81 -5.74 54.17 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.463 1.105 . . . . 0.0 113.488 -176.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 6.7 t -96.98 123.55 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.821 1.248 . . . . 0.0 108.715 175.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.28 -45.12 72.42 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -176.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -30.6 71.06 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 -178.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 54.0 t -72.27 -56.37 5.63 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.164 0.986 . . . . 0.0 109.738 178.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.73 -26.44 63.95 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 177.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 46.1 m -80.56 -45.31 17.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.819 0.847 . . . . 0.0 111.586 176.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 63.7 m -64.99 -34.55 78.71 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.316 1.046 . . . . 0.0 112.741 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.55 -30.86 70.92 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.332 -0.855 . . . . 0.0 111.879 176.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -68.41 -31.18 70.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.565 0.746 . . . . 0.0 111.764 177.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.3 mm -70.39 -45.6 74.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 30.1 mm -62.49 -39.35 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 124.887 1.275 . . . . 0.0 110.429 177.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 16.5 t -59.66 -29.95 68.41 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.413 1.085 . . . . 0.0 112.717 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.5 t60 -60.06 -51.76 68.24 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.146 0.884 . . . . 0.0 110.486 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 24.8 m95 -64.74 -24.52 67.59 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 14.2 mptt -75.91 -30.4 58.76 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.586 0.754 . . . . 0.0 112.509 176.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -100.04 -34.75 9.95 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -178.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.1 t -79.27 131.29 36.11 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.992 1.317 . . . . 0.0 112.924 -176.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 75.0 p -130.05 -3.88 4.51 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.815 1.646 . . . . 0.0 114.209 -178.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -82.44 141.76 32.47 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.551 1.54 . . . . 0.0 111.842 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 47.7 p-80 -77.45 -40.56 42.82 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.88 -0.513 . . . . 0.0 111.993 177.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 23.2 t70 -87.0 69.98 10.27 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.045 1.738 . . . . 0.0 111.518 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 41.9 t -121.34 133.55 24.24 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.305 1.842 . . . . 0.0 109.347 178.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -59.66 -24.0 73.71 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.608 2.205 . . . . 0.0 113.572 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 15.8 t -92.12 -54.97 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 119.268 0.94 . . . . 0.0 111.637 176.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 17.0 m -69.22 -35.29 76.03 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -174.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 3.2 tt -57.08 -56.89 28.78 Favored Pre-proline 0 CA--C 1.548 0.889 0 CA-C-N 120.01 1.277 . . . . 0.0 112.629 -178.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -60.21 -32.8 94.89 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 121.84 1.693 . . . . 0.0 113.161 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.2 mt -68.7 -47.85 65.38 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 118.798 0.727 . . . . 0.0 111.929 178.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -59.65 -37.1 77.79 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.034 0.533 . . . . 0.0 111.772 176.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 14.0 t30 -70.46 -40.75 73.5 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.611 1.564 . . . . 0.0 112.33 177.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -79.97 -25.98 40.16 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 45.4 t -49.5 142.02 8.49 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.273 1.429 . . . . 0.0 113.969 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -74.73 -6.41 48.66 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.492 -0.755 . . . . 0.0 112.714 176.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -96.34 -2.25 46.14 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.61 1.564 . . . . 0.0 113.049 176.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 12.1 ptp180 . . . . . 0 N--CA 1.48 1.06 0 C-N-CA 127.184 2.194 . . . . 0.0 113.714 -178.998 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.51 0 N-CA-C 114.728 0.651 . . . . 0.0 114.728 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.0 m -73.87 -11.55 60.4 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.178 1.391 . . . . 0.0 114.202 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 28.7 p80 -144.64 169.2 18.44 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.458 1.903 . . . . 0.0 111.751 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 28.6 ptm -64.73 159.09 23.01 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.7 1.2 . . . . 0.0 113.771 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -138.23 156.97 47.18 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.839 1.656 . . . . 0.0 111.313 178.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -137.83 155.53 74.81 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 125.263 1.425 . . . . 0.0 111.799 179.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -58.72 150.04 73.16 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.537 2.824 . . . . 0.0 114.355 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -90.2 -3.97 57.52 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.62 1.168 . . . . 0.0 113.494 178.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 36.4 p -75.97 163.0 27.61 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.751 1.62 . . . . 0.0 112.811 178.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 12.1 t70 -126.74 124.83 24.23 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.922 1.289 . . . . 0.0 110.933 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -82.38 -14.12 9.51 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.971 3.114 . . . . 0.0 115.191 -177.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 18.9 m -79.52 -0.6 34.01 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.861 1.264 . . . . 0.0 113.818 -179.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 14.8 p -143.18 153.49 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 126.986 2.114 . . . . 0.0 109.661 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -128.8 87.32 55.06 Favored Pre-proline 0 N--CA 1.47 0.562 0 C-N-CA 123.845 0.858 . . . . 0.0 111.827 177.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -106.85 63.89 0.02 OUTLIER 'Trans proline' 0 CA--C 1.557 1.644 1 C-N-CA 126.068 4.512 . . . . 0.0 110.229 176.302 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -67.24 163.18 35.35 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.082 2.521 . . . . 0.0 114.723 -175.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.48 145.87 46.82 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.926 1.69 . . . . 0.0 111.515 175.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 52.6 m -66.61 125.69 26.58 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.037 0.935 . . . . 0.0 109.824 176.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -51.01 -33.25 24.19 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.617 1.71 . . . . 0.0 115.617 -173.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -74.1 -9.67 58.85 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 28.9 m -62.4 -57.35 11.59 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.161 -0.962 . . . . 0.0 111.132 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -60.13 -24.92 65.07 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.786 0.835 . . . . 0.0 112.737 176.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 11.2 m -70.19 -35.99 74.33 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.119 0.872 . . . . 0.0 113.104 179.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.8 t70 -90.18 -27.91 19.24 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.69 0.796 . . . . 0.0 112.818 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.8 tt -43.09 -58.4 2.47 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 126.919 2.088 . . . . 0.0 113.685 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 52.9 p-90 -70.18 -10.42 58.79 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -173.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 9.3 ptmm? -112.19 -59.91 1.93 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 116.251 1.945 . . . . 0.0 116.251 -175.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 59.1 mt -119.45 17.31 12.96 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 116.165 1.913 . . . . 0.0 116.165 -171.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 2.1 tt -54.82 138.36 63.39 Favored Pre-proline 0 CA--C 1.554 1.113 0 C-N-CA 126.154 1.781 . . . . 0.0 113.536 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.94 166.26 28.38 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 124.501 3.467 . . . . 0.0 114.186 -178.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.68 -27.13 25.98 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.598 2.073 . . . . 0.0 116.598 -177.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -116.58 137.38 52.22 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.78 1.232 . . . . 0.0 111.626 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -150.43 166.09 31.17 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.321 1.048 . . . . 0.0 112.502 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 27.4 m -116.65 -10.53 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 125.894 1.678 . . . . 0.0 114.919 -178.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 44.7 tp -87.32 -5.57 58.85 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.354 1.462 . . . . 0.0 113.236 -179.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 14.3 m -50.41 108.2 0.97 Allowed Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 127.482 2.313 . . . . 0.0 114.606 -177.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -64.4 119.73 6.84 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.4 2.733 . . . . 0.0 111.409 178.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 26.6 tp -74.48 127.58 87.25 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 124.745 1.218 . . . . 0.0 111.772 -178.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -52.1 -36.0 64.2 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 123.632 2.888 . . . . 0.0 114.641 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 12.9 m -65.63 -14.8 61.93 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.958 1.303 . . . . 0.0 114.149 178.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -129.47 13.7 6.02 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.58 1.952 . . . . 0.0 112.181 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -73.66 159.42 33.06 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 -175.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.45 9.54 20.5 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 128.533 2.733 . . . . 0.0 113.852 179.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -57.75 -15.37 7.82 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 -176.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -63.63 -20.79 65.97 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.234 1.014 . . . . 0.0 112.496 174.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 22.7 tp -113.81 19.15 16.89 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 127.631 2.373 . . . . 0.0 111.701 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 7.8 tpt -64.35 146.22 54.78 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 18.2 tp -125.02 151.5 45.5 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.032 2.133 . . . . 0.0 113.047 -174.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 62.0 m -82.87 145.18 49.42 Favored Pre-proline 0 N--CA 1.476 0.84 0 C-N-CA 123.501 0.72 . . . . 0.0 110.493 174.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.47 -30.58 74.39 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.839 2.359 . . . . 0.0 115.734 -177.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.47 -22.31 66.14 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 178.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -87.98 -10.06 51.58 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.568 1.147 . . . . 0.0 113.673 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 96.6 mt -58.43 -34.49 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 CA-C-N 119.29 0.95 . . . . 0.0 109.776 175.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -66.85 -9.9 42.5 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.432 1.893 . . . . 0.0 114.058 177.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -87.51 -26.84 22.98 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.821 0.848 . . . . 0.0 112.361 178.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -98.31 -33.91 10.89 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.787 0.835 . . . . 0.0 112.336 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -109.85 109.82 20.59 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 169.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 1.7 m -125.05 145.17 50.04 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 -169.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -115.23 161.52 18.34 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.686 1.994 . . . . 0.0 111.2 175.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 26.5 t0 -64.87 118.22 46.56 Favored Pre-proline 0 CA--C 1.552 1.028 0 O-C-N 121.478 -0.764 . . . . 0.0 111.58 -179.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -81.05 -17.33 9.42 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 123.17 2.58 . . . . 0.0 114.352 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 127.06 -152.15 18.55 Favored Glycine 0 CA--C 1.543 1.806 0 C-N-CA 125.748 1.642 . . . . 0.0 112.696 -177.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -59.65 -24.92 77.3 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 123.947 3.098 . . . . 0.0 114.054 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -82.94 9.8 9.26 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 127.213 2.205 . . . . 0.0 114.297 -179.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -72.02 50.47 1.23 Allowed Glycine 0 CA--C 1.535 1.299 0 C-N-CA 126.41 1.957 . . . . 0.0 116.212 -178.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 22.6 p -65.6 -50.63 64.36 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.66 1.23 . . . . 0.0 111.272 177.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 99.2 m -68.57 -30.22 68.94 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.96 0.904 . . . . 0.0 111.543 175.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 54.7 t80 -58.11 -26.83 63.11 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -178.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -64.14 -53.64 46.38 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.334 -0.854 . . . . 0.0 110.092 174.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -62.47 -39.59 98.01 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 123.933 0.778 . . . . 0.0 113.501 178.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 48.1 p -74.78 -0.71 19.18 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -113.71 -37.44 4.56 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.481 1.512 . . . . 0.0 112.386 175.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 68.7 p -79.58 -26.8 41.21 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . -165.05 52.64 0.28 Allowed Glycine 0 CA--C 1.536 1.39 0 N-CA-C 116.793 1.477 . . . . 0.0 116.793 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.23 -27.15 48.74 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.954 2.436 . . . . 0.0 112.919 177.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 6.6 t -72.55 -10.5 59.86 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.061 1.345 . . . . 0.0 114.176 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -73.43 -16.29 61.32 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 12.2 t70 -93.49 118.45 67.56 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 124.383 1.073 . . . . 0.0 111.547 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -73.08 -31.94 9.13 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.833 2.355 . . . . 0.0 113.506 -178.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -64.86 -40.08 94.57 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.269 -0.894 . . . . 0.0 110.979 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 92.8 mttt -58.21 -46.97 84.89 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 118.582 0.628 . . . . 0.0 110.54 174.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -57.96 -46.63 84.83 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.68 0.792 . . . . 0.0 111.534 176.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -60.47 -40.13 90.11 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.548 0.739 . . . . 0.0 111.393 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 71.6 mt -66.15 -40.61 90.69 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 117.916 -1.04 . . . . 0.0 111.961 177.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -62.45 -52.93 53.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 CA-C-N 120.038 1.29 . . . . 0.0 109.267 175.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -54.02 -54.01 45.03 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.014 0.925 . . . . 0.0 111.148 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -65.06 -36.17 83.48 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.379 -0.826 . . . . 0.0 112.58 -179.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -68.04 -45.45 73.9 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.039 0.836 . . . . 0.0 110.599 177.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.6 tt -62.6 -41.29 98.88 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.185 0.994 . . . . 0.0 110.516 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 99.5 t -60.17 -32.16 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 CA-C-N 119.269 0.94 . . . . 0.0 111.031 174.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.8 tp -69.98 -31.21 68.79 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.812 -1.18 . . . . 0.0 112.313 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.41 -28.36 69.2 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 120.325 1.42 . . . . 0.0 110.062 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 5.2 mt -72.89 -50.45 23.69 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.365 1.066 . . . . 0.0 109.579 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.0 t60 -57.25 -55.95 28.07 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 122.768 0.427 . . . . 0.0 110.313 176.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -56.01 -25.24 43.57 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.879 1.272 . . . . 0.0 114.429 -178.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -90.11 -31.35 17.15 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 175.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 41.6 mttm -83.91 -36.16 23.54 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.598 1.159 . . . . 0.0 112.122 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 44.3 t -61.27 -53.75 52.79 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.092 2.157 . . . . 0.0 110.948 177.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -55.75 -29.92 60.38 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.042 -1.036 . . . . 0.0 113.121 176.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 8.2 mpt_? -80.47 -24.68 39.32 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.748 1.619 . . . . 0.0 113.216 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -30.0 71.16 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 119.839 1.199 . . . . 0.0 112.9 179.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -73.25 -23.96 60.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.368 0.667 . . . . 0.0 111.873 175.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -77.31 -35.07 55.24 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.053 -1.029 . . . . 0.0 109.912 174.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -75.12 -33.8 61.61 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.205 1.002 . . . . 0.0 112.625 176.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -135.82 111.79 9.55 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.518 1.527 . . . . 0.0 111.656 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . -76.03 -6.24 82.15 Favored Glycine 0 CA--C 1.539 1.532 0 N-CA-C 115.591 0.997 . . . . 0.0 115.591 179.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -85.89 -9.73 56.47 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.207 1.503 . . . . 0.0 114.216 -178.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 33.4 m -106.31 162.89 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 124.92 1.288 . . . . 0.0 113.062 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -110.13 171.36 7.5 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.185 1.794 . . . . 0.0 111.424 178.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -69.71 162.57 27.48 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.565 1.146 . . . . 0.0 113.414 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.66 147.7 50.9 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.93 1.692 . . . . 0.0 113.932 -178.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 50.4 m -94.49 -7.47 41.2 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.1 1.36 . . . . 0.0 113.382 178.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 49.8 tp -78.24 114.23 40.65 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 126.378 1.871 . . . . 0.0 110.619 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -56.69 -35.83 97.85 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.962 2.441 . . . . 0.0 114.344 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 57.8 m80 -69.55 -34.21 73.86 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 178.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 33.2 t -66.92 -50.17 63.25 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.313 1.045 . . . . 0.0 108.748 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -54.69 -34.39 62.24 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.341 1.456 . . . . 0.0 111.91 174.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 26.2 m -72.82 -58.44 3.34 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.672 1.189 . . . . 0.0 111.607 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -37.58 82.46 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.549 -0.719 . . . . 0.0 112.603 -178.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -62.7 -34.44 77.14 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.424 1.466 . . . . 0.0 113.071 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -71.04 -39.69 72.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.061 0.544 . . . . 0.0 110.421 175.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 94.5 t -64.38 -46.57 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.361 0.664 . . . . 0.0 110.831 176.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.92 -42.29 93.62 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.124 0.969 . . . . 0.0 111.84 178.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -66.59 -30.64 70.98 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 176.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 55.8 t60 -77.78 -48.67 16.02 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.988 0.813 . . . . 0.0 110.213 175.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 35.7 ttp -56.42 -31.86 64.32 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.303 1.841 . . . . 0.0 114.199 -177.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 8.7 t -77.48 -10.13 59.3 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 119.805 1.184 . . . . 0.0 112.999 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 50.8 m80 -114.28 -18.99 11.46 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.797 1.639 . . . . 0.0 113.175 177.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 34.8 t -57.57 145.62 33.04 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.493 1.517 . . . . 0.0 112.879 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -109.41 -14.86 14.35 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.821 1.648 . . . . 0.0 113.648 -179.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -104.55 -30.16 10.19 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.465 1.106 . . . . 0.0 112.666 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 53.99 -110.66 1.59 Allowed Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.61 1.1 . . . . 0.0 113.822 177.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.32 -15.77 60.92 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 120.93 -1.335 . . . . 0.0 113.372 177.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -99.52 -0.21 41.07 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.937 1.695 . . . . 0.0 113.011 174.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 15.4 t -63.71 142.03 58.55 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.326 1.05 . . . . 0.0 110.033 178.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -81.58 -5.25 57.84 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.287 1.035 . . . . 0.0 113.489 -176.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.8 t -87.22 114.49 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 172.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.78 -39.41 65.4 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -176.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -67.78 -41.05 83.83 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.344 0.658 . . . . 0.0 112.585 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 42.9 t -62.12 -54.82 35.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.981 1.312 . . . . 0.0 110.198 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -60.6 -22.96 64.31 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.044 0.938 . . . . 0.0 113.078 177.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 69.4 m -82.01 -52.06 7.42 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.051 0.941 . . . . 0.0 111.939 176.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 41.7 m -61.05 -34.18 74.47 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 119.17 0.895 . . . . 0.0 112.056 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -60.04 -31.31 69.85 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.285 -0.885 . . . . 0.0 112.759 175.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -69.11 -30.7 69.04 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.707 1.14 . . . . 0.0 111.229 176.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 15.0 mt -74.27 -48.42 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.502 1.121 . . . . 0.0 109.929 176.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 25.8 mm -61.86 -37.47 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.939 0.895 . . . . 0.0 111.046 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 73.1 m -61.74 -24.83 67.06 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.395 -0.815 . . . . 0.0 112.869 176.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 10.0 t60 -64.91 -54.85 24.21 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.411 1.005 . . . . 0.0 109.963 176.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 46.3 m95 -62.05 -28.83 69.87 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 177.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -71.03 -29.93 65.99 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.784 0.834 . . . . 0.0 112.709 177.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -100.19 -40.85 7.36 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 7.2 t -77.76 135.45 38.0 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.472 1.509 . . . . 0.0 112.381 -177.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 3.8 t -130.11 2.76 4.77 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.542 1.537 . . . . 0.0 114.008 -179.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -78.25 153.49 31.82 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.207 1.403 . . . . 0.0 114.207 -177.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 80.6 t60 -86.89 -39.26 15.97 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.086 0.955 . . . . 0.0 109.859 170.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.7 t70 -93.71 78.59 4.25 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.654 1.582 . . . . 0.0 111.682 178.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 43.2 t -137.79 135.06 18.52 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 126.882 2.073 . . . . 0.0 108.887 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -58.56 -26.95 80.85 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 122.809 2.339 . . . . 0.0 114.799 -177.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 4.9 t -92.11 -50.68 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 119.653 1.115 . . . . 0.0 111.869 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 11.7 m -69.92 -39.21 76.29 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -175.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.5 tt -53.34 -57.7 15.73 Favored Pre-proline 0 N--CA 1.474 0.746 0 CA-C-O 117.588 -1.196 . . . . 0.0 112.781 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.62 -32.7 93.64 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-N 121.569 1.596 . . . . 0.0 113.424 -179.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.27 -46.8 63.62 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.636 1.107 . . . . 0.0 112.011 178.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -64.49 -30.52 71.55 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.346 1.059 . . . . 0.0 111.416 177.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 37.8 t30 -78.07 -41.58 34.97 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.797 1.639 . . . . 0.0 112.39 176.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -72.8 -29.55 63.35 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.761 1.224 . . . . 0.0 114.192 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 46.7 t -62.75 140.07 58.72 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 35.6 t70 -65.93 -16.63 64.04 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.688 1.195 . . . . 0.0 112.218 176.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -78.56 -6.07 54.51 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.314 1.446 . . . . 0.0 113.469 177.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 73.7 ttt-85 . . . . . 0 N--CA 1.479 0.994 0 C-N-CA 125.239 1.415 . . . . 0.0 111.758 179.711 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.438 0 N-CA-C 114.024 0.37 . . . . 0.0 114.024 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 p -73.69 -24.68 59.98 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.612 1.165 . . . . 0.0 114.049 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -148.58 149.33 31.37 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.152 1.781 . . . . 0.0 111.212 178.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 64.1 mtt -140.59 147.29 39.18 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.726 1.61 . . . . 0.0 110.573 178.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -148.07 147.04 29.12 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.962 1.305 . . . . 0.0 111.226 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -143.54 135.27 12.93 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.203 1.401 . . . . 0.0 110.585 179.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -74.37 6.41 3.13 Favored 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 124.159 3.239 . . . . 0.0 115.367 -178.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 35.5 tp60 -70.89 -22.89 62.22 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.789 1.236 . . . . 0.0 113.611 -179.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 78.5 p -75.82 159.72 30.71 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.527 1.131 . . . . 0.0 113.269 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 16.1 t70 -141.28 129.15 12.08 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 124.926 1.29 . . . . 0.0 111.373 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -85.17 -17.38 4.62 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.529 2.82 . . . . 0.0 114.903 -178.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 26.1 m -81.59 -27.47 34.25 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -176.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 12.2 p -73.42 139.41 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.956 0.902 . . . . 0.0 111.816 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -133.89 86.49 37.97 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.936 1.295 . . . . 0.0 111.098 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -57.57 -42.54 59.69 Favored 'Trans proline' 0 CA--C 1.55 1.294 0 C-N-CA 123.716 2.944 . . . . 0.0 117.267 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -75.46 166.96 27.61 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 122.653 2.235 . . . . 0.0 114.163 -177.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 15.7 tp -70.09 143.66 52.35 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.476 1.11 . . . . 0.0 111.55 177.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 54.7 m -69.15 127.98 35.01 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 174.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -58.5 -24.76 61.28 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -175.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -75.44 -10.87 59.83 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 177.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 76.8 m -58.77 -60.04 4.46 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.931 0.892 . . . . 0.0 111.848 -177.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -60.21 -24.82 65.12 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 9.1 t -75.63 -31.05 59.7 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.897 0.879 . . . . 0.0 112.359 178.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 34.9 t70 -90.02 -28.07 19.32 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.001 0.92 . . . . 0.0 112.319 175.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.9 tt -46.49 -59.02 3.24 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 126.993 2.117 . . . . 0.0 112.847 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.6 p-90 -69.69 -9.24 53.6 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.021 1.489 . . . . 0.0 115.021 -173.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -112.0 -56.25 2.41 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -177.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 50.1 mt -120.14 15.86 12.36 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -172.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 1.2 tt -52.84 137.4 45.03 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 126.07 1.748 . . . . 0.0 114.891 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -71.15 171.99 14.86 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 124.487 3.458 . . . . 0.0 113.344 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -65.68 -4.22 5.98 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 116.693 2.109 . . . . 0.0 116.693 -177.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 53.5 t30 -141.64 146.75 36.54 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.68 1.192 . . . . 0.0 111.616 178.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -150.29 154.68 38.29 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.768 1.227 . . . . 0.0 111.792 177.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 18.1 t -90.27 -26.44 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 124.383 1.073 . . . . 0.0 112.664 -179.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 61.2 tp -89.24 0.82 56.47 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.272 1.429 . . . . 0.0 114.325 -177.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 49.7 m -48.69 109.29 1.14 Allowed Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 125.461 1.505 . . . . 0.0 113.474 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -63.0 123.07 11.59 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 123.48 2.787 . . . . 0.0 112.185 -178.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 87.4 mt -81.57 128.92 67.81 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 124.379 1.072 . . . . 0.0 112.184 -177.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -53.14 -32.75 60.96 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.844 3.029 . . . . 0.0 115.113 179.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 8.2 t -69.24 -18.37 63.87 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.59 1.156 . . . . 0.0 113.56 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -131.37 26.79 4.79 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.14 1.776 . . . . 0.0 111.681 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -77.42 160.64 28.58 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 -176.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.89 18.69 8.63 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 128.287 2.635 . . . . 0.0 113.225 179.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -66.87 -16.37 64.26 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.234 1.414 . . . . 0.0 114.712 -177.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.3 -16.14 64.1 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 121.161 -0.962 . . . . 0.0 112.626 177.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 23.9 tp -116.75 19.23 14.59 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 127.145 2.178 . . . . 0.0 111.756 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 8.0 tpt -71.73 151.77 43.32 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 115.923 1.823 . . . . 0.0 115.923 -175.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 91.3 mt -125.03 162.98 23.36 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.061 2.144 . . . . 0.0 113.709 -179.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 31.2 t -83.67 144.83 46.21 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 169.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -56.86 -20.32 35.49 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.248 1.965 . . . . 0.0 114.718 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -69.04 -25.08 64.3 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.863 0.865 . . . . 0.0 112.76 177.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 21.3 t70 -83.76 -12.76 55.3 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 80.3 mt -56.18 -36.39 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 124.571 1.148 . . . . 0.0 110.465 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -66.01 -10.0 35.68 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.014 1.326 . . . . 0.0 113.863 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 20.8 tp60 -84.64 -29.6 25.59 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.104 -0.998 . . . . 0.0 112.596 177.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 3.2 p-90 -96.17 -35.06 11.44 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.735 0.814 . . . . 0.0 111.907 176.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 13.9 m-30 -110.78 109.57 19.85 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 104.749 -2.315 . . . . 0.0 104.749 169.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 3.7 m -125.06 140.82 52.56 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -172.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -103.67 163.17 12.49 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.687 1.595 . . . . 0.0 111.638 176.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 22.8 t0 -61.16 114.99 12.17 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.074 0.95 . . . . 0.0 112.553 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -87.41 -2.54 7.69 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.775 2.983 . . . . 0.0 113.85 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 79.82 -176.29 54.73 Favored Glycine 0 CA--C 1.544 1.866 0 C-N-CA 124.619 1.104 . . . . 0.0 113.183 -176.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -65.85 -21.45 57.66 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.535 2.823 . . . . 0.0 114.131 -178.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 36.0 t70 -78.0 -19.55 54.24 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.259 1.024 . . . . 0.0 113.149 178.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -80.77 68.09 3.45 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 125.08 1.324 . . . . 0.0 113.161 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 78.9 p -63.69 -1.02 1.14 Allowed 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 116.466 2.025 . . . . 0.0 116.466 -178.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 60.8 m -67.92 13.81 0.07 Allowed 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 127.584 2.354 . . . . 0.0 115.053 178.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -49.57 -32.98 13.79 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.161 1.785 . . . . 0.0 114.907 -177.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 25.7 m120 -61.48 -25.95 67.58 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.201 -0.937 . . . . 0.0 112.934 178.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -97.01 -23.94 13.98 Favored Glycine 0 CA--C 1.538 1.481 0 C-N-CA 124.967 1.27 . . . . 0.0 114.315 177.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 69.3 p -96.43 -19.94 18.8 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -178.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -66.9 159.44 28.34 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.467 1.107 . . . . 0.0 113.572 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 14.5 t -65.58 146.43 54.84 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.02 0.928 . . . . 0.0 112.268 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 139.79 -79.33 0.29 Allowed Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.214 1.387 . . . . 0.0 110.679 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -62.87 -23.06 74.26 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 123.0 2.467 . . . . 0.0 111.753 176.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 28.4 p -60.32 -21.55 62.15 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.466 1.907 . . . . 0.0 113.679 176.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -87.55 -4.69 58.97 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.974 1.31 . . . . 0.0 113.618 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 12.4 t70 -70.13 138.42 87.18 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 124.177 0.991 . . . . 0.0 111.49 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -57.89 -31.02 91.52 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.653 2.235 . . . . 0.0 113.661 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -64.33 -37.19 86.63 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.459 1.027 . . . . 0.0 111.468 176.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -65.36 -41.45 93.84 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.431 -0.793 . . . . 0.0 110.945 175.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -63.3 -42.35 99.04 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.652 0.66 . . . . 0.0 110.474 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -62.07 -33.4 74.33 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.213 1.005 . . . . 0.0 112.497 176.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 71.5 mt -64.27 -41.31 96.99 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 120.1 1.318 . . . . 0.0 111.451 175.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 4.8 mt -64.7 -51.47 66.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.054 0.541 . . . . 0.0 109.736 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -55.35 -55.16 34.69 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.396 1.078 . . . . 0.0 111.299 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -34.42 77.79 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -177.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -68.91 -44.84 72.34 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.103 0.865 . . . . 0.0 110.52 176.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 7.6 tp -62.65 -39.69 94.69 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.609 0.641 . . . . 0.0 110.896 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 58.0 t -60.29 -32.21 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 CA-C-N 119.449 1.022 . . . . 0.0 110.95 175.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 9.3 tp -71.37 -31.71 67.64 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 120.793 -1.192 . . . . 0.0 112.138 175.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.61 -28.91 69.7 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 120.211 1.369 . . . . 0.0 109.938 174.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 3.9 mt -72.55 -52.9 13.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.707 0.803 . . . . 0.0 109.584 175.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 16.0 t60 -55.02 -54.39 43.67 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 122.902 0.481 . . . . 0.0 110.531 177.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -57.22 -25.3 58.86 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -178.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -90.01 -31.42 17.21 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.467 1.031 . . . . 0.0 113.323 175.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 76.9 mttt -80.54 -39.59 27.5 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.4 1.48 . . . . 0.0 112.231 179.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 51.9 t -62.76 -51.25 67.86 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 127.635 2.374 . . . . 0.0 112.048 178.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -55.32 -27.7 48.75 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -80.39 -15.85 55.85 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.36 -37.01 80.05 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 119.978 1.263 . . . . 0.0 112.516 179.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -64.13 -40.88 97.11 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.945 0.898 . . . . 0.0 110.388 177.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -70.12 -39.39 75.49 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.054 0.942 . . . . 0.0 111.865 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -68.07 -41.2 82.29 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.027 0.931 . . . . 0.0 112.963 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -83.55 -42.22 17.05 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.216 1.006 . . . . 0.0 112.985 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 77.07 1.87 75.71 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 116.694 1.438 . . . . 0.0 116.694 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -128.71 -45.11 1.32 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.803 1.801 . . . . 0.0 113.809 -178.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 17.7 m -78.15 148.77 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 CA-C-N 119.12 0.873 . . . . 0.0 113.124 -179.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -76.1 164.77 25.79 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.542 1.137 . . . . 0.0 113.51 178.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -79.76 175.6 10.48 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 124.833 1.253 . . . . 0.0 111.601 174.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -51.3 149.53 3.97 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.967 1.707 . . . . 0.0 115.481 -178.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 76.4 p -100.01 -8.27 24.07 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.251 1.821 . . . . 0.0 112.526 175.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 36.1 tp -69.58 115.41 32.63 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 127.086 2.154 . . . . 0.0 109.578 178.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -59.47 -34.28 97.17 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.737 2.291 . . . . 0.0 114.039 -176.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 45.0 m80 -68.78 -37.06 79.04 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 121.395 -0.816 . . . . 0.0 112.392 177.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 36.0 t -66.09 -50.15 65.07 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.74 1.216 . . . . 0.0 108.948 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -54.99 -34.66 63.6 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.264 1.426 . . . . 0.0 111.824 174.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 22.8 m -71.83 -59.56 2.69 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.526 1.13 . . . . 0.0 111.446 176.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.46 -37.79 79.1 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.771 -0.633 . . . . 0.0 112.522 -178.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -63.83 -34.34 77.71 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 120.505 1.502 . . . . 0.0 113.1 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -71.17 -37.66 72.19 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.011 0.524 . . . . 0.0 110.519 175.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 91.6 t -65.67 -47.04 87.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 122.934 0.493 . . . . 0.0 110.623 176.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.78 -43.38 85.51 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.784 0.833 . . . . 0.0 111.156 178.12 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 33.7 m-80 -68.22 -17.64 64.36 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 176.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 62.7 t60 -90.11 -47.81 7.58 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.815 0.846 . . . . 0.0 109.497 173.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 33.5 ttp -57.28 -28.44 63.01 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.339 1.856 . . . . 0.0 113.293 -178.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 7.5 p -66.88 -27.05 67.2 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.488 1.115 . . . . 0.0 112.542 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 68.8 m80 -102.51 -22.2 14.07 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.059 1.744 . . . . 0.0 113.443 178.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 19.4 t -64.18 142.86 58.26 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.442 1.497 . . . . 0.0 112.692 -179.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -117.72 -12.77 10.22 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.651 1.58 . . . . 0.0 113.814 -179.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -91.44 -27.59 18.2 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.976 0.91 . . . . 0.0 112.058 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 55.69 -114.16 4.58 Favored Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.219 0.914 . . . . 0.0 112.605 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 82.2 tttt -62.18 -20.49 64.2 Favored 'General case' 0 N--CA 1.479 0.994 0 O-C-N 121.316 -1.109 . . . . 0.0 112.803 177.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -91.5 -1.96 57.36 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.917 1.287 . . . . 0.0 113.466 176.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 17.5 t -63.64 141.96 58.57 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 122.058 0.932 . . . . 0.0 109.599 177.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -80.54 -3.9 51.91 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -175.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 96.5 t -91.67 115.01 29.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 172.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -54.89 -39.51 68.81 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -176.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -65.84 -38.89 90.09 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.675 0.79 . . . . 0.0 112.517 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 40.7 t -66.69 -55.06 16.88 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.382 1.473 . . . . 0.0 110.163 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -58.72 -26.12 63.61 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.005 0.922 . . . . 0.0 113.393 177.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 67.4 m -81.93 -46.49 13.97 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 124.214 1.006 . . . . 0.0 111.535 175.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 66.8 m -61.98 -36.05 80.31 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.375 1.07 . . . . 0.0 112.284 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -61.16 -31.98 71.71 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.747 0.819 . . . . 0.0 112.16 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -68.91 -29.68 68.0 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.4 0.68 . . . . 0.0 111.714 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 2.1 mm -71.17 -46.74 64.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 18.9 mm -60.99 -38.45 79.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 124.96 1.304 . . . . 0.0 110.974 177.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 70.5 m -62.15 -21.91 65.44 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.283 1.033 . . . . 0.0 113.271 177.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 7.2 t60 -65.28 -60.21 3.23 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.474 1.034 . . . . 0.0 110.683 178.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 52.6 m95 -60.15 -24.13 64.46 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 177.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 61.8 mtpt -74.53 -35.95 63.15 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.95 0.9 . . . . 0.0 112.748 178.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.2 p30 -100.03 -32.72 10.81 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 8.9 t -82.29 132.92 35.22 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.522 1.529 . . . . 0.0 110.979 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 73.2 p -129.98 0.47 4.76 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.352 1.461 . . . . 0.0 114.427 -177.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -80.09 151.95 29.58 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.831 1.252 . . . . 0.0 113.093 -178.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 40.6 p-80 -86.41 -29.22 23.04 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.694 0.798 . . . . 0.0 111.444 173.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 22.8 t0 -100.27 70.05 1.5 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.46 1.904 . . . . 0.0 111.511 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 41.7 t -127.88 135.18 27.1 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 126.615 1.966 . . . . 0.0 109.22 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -58.56 -25.08 72.98 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 122.814 2.343 . . . . 0.0 114.204 -178.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 11.2 t -92.19 -52.49 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 119.682 1.128 . . . . 0.0 111.732 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 10.4 m -68.76 -40.25 79.85 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -175.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -53.42 -57.95 14.83 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-O 117.414 -1.279 . . . . 0.0 112.866 -178.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -59.93 -34.11 95.4 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 121.918 1.745 . . . . 0.0 113.565 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.5 mt -70.24 -47.13 62.74 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.977 0.808 . . . . 0.0 111.924 178.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -64.6 -34.75 79.0 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.982 0.913 . . . . 0.0 110.886 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 24.8 t30 -70.12 -43.15 71.6 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.254 1.421 . . . . 0.0 111.77 176.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -69.29 -32.27 71.31 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.939 0.896 . . . . 0.0 112.46 178.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 23.2 t -67.76 112.35 4.79 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.439 1.096 . . . . 0.0 112.458 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 36.1 t70 -73.58 -8.29 55.36 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.83 0.852 . . . . 0.0 112.4 177.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -77.72 -7.17 56.14 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 126.674 1.99 . . . . 0.0 112.889 179.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 9.7 ptm85 . . . . . 0 N--CA 1.477 0.884 0 C-N-CA 126.582 1.953 . . . . 0.0 114.021 -179.923 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.37 0 N-CA-C 114.622 0.609 . . . . 0.0 114.622 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.0 p -57.06 -28.92 63.0 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.486 1.514 . . . . 0.0 114.03 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 29.9 p80 -97.69 2.33 49.58 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.405 1.882 . . . . 0.0 113.687 177.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 89.3 mtp -114.99 -34.72 4.98 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.684 1.594 . . . . 0.0 112.769 -178.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -72.35 143.88 48.47 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.565 1.146 . . . . 0.0 111.963 179.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -143.81 135.7 13.03 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 124.915 1.286 . . . . 0.0 111.067 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -71.32 164.19 36.56 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.401 2.734 . . . . 0.0 113.146 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -125.01 153.43 42.83 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.335 1.454 . . . . 0.0 112.074 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 34.0 m -71.18 159.51 34.52 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.104 1.361 . . . . 0.0 113.317 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 15.6 t70 -132.71 129.54 21.32 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.468 1.507 . . . . 0.0 111.279 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -84.51 -14.19 6.84 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.599 2.866 . . . . 0.0 115.324 -177.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 11.7 t -78.5 -38.38 40.91 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.113 0.965 . . . . 0.0 113.072 -178.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 7.6 p -75.93 146.49 9.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 124.33 1.052 . . . . 0.0 111.734 178.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -134.28 147.09 62.25 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.061 1.344 . . . . 0.0 110.887 179.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -55.42 -48.5 20.22 Favored 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 123.121 2.547 . . . . 0.0 116.478 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -72.88 150.91 50.19 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.263 1.975 . . . . 0.0 112.608 -179.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 4.9 tt -64.19 139.83 58.81 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.78 1.232 . . . . 0.0 111.796 177.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 47.1 t -77.28 148.57 35.66 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.229 1.012 . . . . 0.0 112.042 178.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -59.24 -26.92 65.31 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.47 0.708 . . . . 0.0 112.477 177.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -88.4 -7.99 55.73 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 90.5 m -62.27 -54.52 39.46 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.569 1.077 . . . . 0.0 110.832 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -60.08 -27.49 67.04 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.619 0.767 . . . . 0.0 112.967 176.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 24.2 m -68.01 -34.72 77.05 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.611 0.764 . . . . 0.0 112.663 178.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.31 -28.73 18.56 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 174.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 2.6 tt -43.24 -60.06 1.83 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.4 1.88 . . . . 0.0 113.318 -177.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 50.1 p-90 -63.0 -12.49 26.25 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -173.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 16.1 pttp -111.94 -50.25 2.93 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -177.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 66.2 mt -120.08 20.44 12.09 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 117.203 2.297 . . . . 0.0 117.203 -169.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 12.4 tp -51.74 138.96 31.61 Favored Pre-proline 0 CA--C 1.551 1.019 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -173.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -76.57 155.06 35.66 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.394 2.729 . . . . 0.0 111.468 176.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -68.42 -14.99 63.39 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.691 1.737 . . . . 0.0 115.691 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 1.1 t30 -81.13 66.85 6.83 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.83 1.252 . . . . 0.0 110.856 178.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -131.83 132.95 44.15 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.061 1.344 . . . . 0.0 112.883 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 35.7 m -138.81 9.76 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 125.895 1.678 . . . . 0.0 114.042 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 7.9 tt -77.42 -11.02 59.8 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -177.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 1.8 p -54.84 124.92 53.51 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 124.459 1.103 . . . . 0.0 112.366 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -67.28 146.81 76.88 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.987 2.458 . . . . 0.0 111.748 179.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 30.2 tp -66.32 127.25 93.17 Favored Pre-proline 0 CA--C 1.546 0.823 0 CA-C-O 117.923 -1.037 . . . . 0.0 110.714 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -51.62 -35.05 55.48 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.603 2.868 . . . . 0.0 114.784 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 15.0 m -65.23 -16.2 63.28 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.846 1.258 . . . . 0.0 113.959 178.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -129.58 14.7 5.99 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.645 1.978 . . . . 0.0 112.375 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -72.03 162.35 29.58 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 122.666 1.222 . . . . 0.0 113.9 -178.052 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.84 17.05 1.61 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.324 2.249 . . . . 0.0 113.721 178.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -64.24 -11.15 28.6 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.504 1.522 . . . . 0.0 114.836 -178.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 36.2 t70 -65.0 -19.2 65.88 Favored 'General case' 0 CA--C 1.548 0.896 0 O-C-N 121.075 -1.015 . . . . 0.0 112.081 174.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 93.0 mt -108.64 13.47 25.16 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.716 2.006 . . . . 0.0 112.904 178.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.39 149.51 44.25 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.844 -1.16 . . . . 0.0 113.356 -177.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.14 179.66 4.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.31 1.844 . . . . 0.0 114.242 -175.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 6.1 p -79.92 160.13 69.55 Favored Pre-proline 0 CA--C 1.545 0.769 0 O-C-N 121.464 -0.773 . . . . 0.0 109.452 169.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.37 -15.16 47.1 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 121.725 1.617 . . . . 0.0 113.009 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -85.61 -28.86 24.53 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.346 1.058 . . . . 0.0 111.452 176.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -67.71 -21.0 65.33 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.674 0.79 . . . . 0.0 112.243 177.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 97.2 mt -57.43 -35.84 50.99 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.993 0.917 . . . . 0.0 109.678 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -72.86 -10.0 59.31 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 179.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -78.24 -30.46 48.73 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.052 -1.03 . . . . 0.0 111.336 175.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 7.4 p-90 -99.54 -20.06 16.58 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 177.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -129.69 109.82 11.29 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 169.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 6.0 t -125.21 175.47 7.39 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.407 1.083 . . . . 0.0 113.62 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -116.44 -179.95 3.82 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.993 2.517 . . . . 0.0 109.969 176.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 9.8 t70 -59.22 120.93 52.01 Favored Pre-proline 0 CA--C 1.556 1.201 0 O-C-N 120.601 -1.312 . . . . 0.0 110.536 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -81.2 -13.4 11.25 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.448 2.765 . . . . 0.0 115.709 -175.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 62.51 -162.24 29.66 Favored Glycine 0 CA--C 1.544 1.895 0 CA-C-N 118.983 0.811 . . . . 0.0 113.14 -176.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -76.05 -19.44 15.72 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 123.337 2.691 . . . . 0.0 113.836 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -88.68 -33.75 17.45 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 -177.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . -85.75 27.91 5.16 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 124.968 1.271 . . . . 0.0 114.916 -179.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 65.1 p -50.28 -29.82 10.51 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 -176.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 76.6 m -54.9 -26.06 33.32 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.14 1.376 . . . . 0.0 113.711 177.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -60.62 -25.99 66.68 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.357 -0.84 . . . . 0.0 113.13 178.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 26.3 p30 -66.02 -15.57 63.15 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 119.507 1.049 . . . . 0.0 113.448 177.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -94.45 0.68 65.92 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.873 1.702 . . . . 0.0 114.438 177.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 6.2 t -139.78 -37.92 0.48 Allowed 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 118.855 1.328 . . . . 0.0 114.091 -178.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -79.85 34.33 0.28 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.146 1.378 . . . . 0.0 114.134 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 5.9 m -62.1 -34.08 75.65 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.573 1.549 . . . . 0.0 112.829 -178.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 170.17 74.9 0.04 OUTLIER Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.745 1.164 . . . . 0.0 112.644 178.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -54.13 -27.74 47.85 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.16 3.24 . . . . 0.0 116.476 -177.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 21.9 p -86.88 -32.0 20.46 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.44 1.096 . . . . 0.0 112.652 178.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -80.58 -30.66 36.94 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.346 1.458 . . . . 0.0 112.581 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 16.8 t70 -76.34 121.28 84.62 Favored Pre-proline 0 CA--C 1.549 0.904 0 C-N-CA 124.963 1.305 . . . . 0.0 109.884 176.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -59.1 -40.97 65.3 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.395 2.063 . . . . 0.0 114.852 -176.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -66.69 -46.32 76.01 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 121.361 -0.837 . . . . 0.0 111.517 -179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 81.0 mttt -63.77 -39.85 95.26 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 117.792 -1.099 . . . . 0.0 112.021 177.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 10.5 ptt-85 -64.52 -35.97 82.69 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.641 1.564 . . . . 0.0 111.655 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -63.07 -38.39 91.01 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.171 0.896 . . . . 0.0 111.267 173.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 97.6 mt -63.69 -38.88 92.79 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.714 0.688 . . . . 0.0 111.198 176.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -68.05 -51.96 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 118.928 0.785 . . . . 0.0 109.851 175.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -52.89 -53.64 46.19 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.226 1.01 . . . . 0.0 111.373 179.108 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -38.06 88.14 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 119.282 0.946 . . . . 0.0 112.503 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -70.13 -45.91 65.85 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.681 0.673 . . . . 0.0 111.119 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 3.0 tt -63.05 -43.05 99.71 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.587 0.755 . . . . 0.0 109.948 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 61.9 t -63.94 -24.34 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 120.737 -1.227 . . . . 0.0 111.131 174.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.44 -31.25 57.74 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.292 -1.505 . . . . 0.0 111.612 173.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.7 mp -59.86 -41.65 91.93 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 169.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 6.3 mp -67.26 -47.46 70.65 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 117.704 -1.141 . . . . 0.0 111.997 176.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 30.2 t60 -55.06 -55.01 35.84 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.746 1.157 . . . . 0.0 108.719 176.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -52.38 -45.92 66.0 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.147 0.979 . . . . 0.0 113.27 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -69.43 -39.26 77.94 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.513 -0.742 . . . . 0.0 112.817 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 49.1 mttp -74.9 -32.8 61.92 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.007 -1.058 . . . . 0.0 111.736 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 8.3 t -68.52 -42.14 78.93 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.253 1.821 . . . . 0.0 109.424 173.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -58.39 -43.89 88.7 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.232 1.413 . . . . 0.0 110.056 172.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 3.4 mmp_? -66.89 -36.05 81.41 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.312 -0.868 . . . . 0.0 112.549 175.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -35.6 72.81 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.706 1.203 . . . . 0.0 110.861 174.094 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -75.83 -44.31 41.66 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.111 0.564 . . . . 0.0 110.865 176.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -58.28 -34.13 70.19 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.659 0.784 . . . . 0.0 112.356 177.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -69.71 -10.02 56.68 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.664 1.186 . . . . 0.0 114.109 177.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -120.15 -47.25 2.38 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.517 1.527 . . . . 0.0 113.148 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 76.78 3.88 80.69 Favored Glycine 0 CA--C 1.539 1.537 0 N-CA-C 117.369 1.708 . . . . 0.0 117.369 177.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -127.27 -37.67 2.02 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 119.843 1.821 . . . . 0.0 114.038 -178.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 27.2 m -65.52 154.46 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 113.531 0.938 . . . . 0.0 113.531 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 79.0 mmt-85 -82.57 163.55 21.41 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.075 1.35 . . . . 0.0 111.018 176.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -74.16 173.14 10.53 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -178.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 1.9 t -54.3 150.98 7.93 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 127.807 2.443 . . . . 0.0 115.042 -177.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 50.1 m -81.03 -14.2 58.1 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.955 1.302 . . . . 0.0 112.856 177.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 67.0 tp -82.95 114.5 52.98 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.809 1.644 . . . . 0.0 110.354 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -57.99 -35.77 98.53 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.556 2.171 . . . . 0.0 113.735 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 19.7 m170 -63.81 -38.18 90.14 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 5.1 t -64.94 -51.84 59.6 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.091 1.357 . . . . 0.0 109.228 175.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -52.02 -41.87 62.58 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.179 1.792 . . . . 0.0 111.774 175.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 5.1 m -66.99 -58.63 4.58 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.934 1.294 . . . . 0.0 111.252 176.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 17.2 mmt -62.67 -33.1 74.38 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -177.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -67.09 -30.39 70.4 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 121.138 1.79 . . . . 0.0 112.51 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -72.07 -36.81 69.65 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 122.875 0.47 . . . . 0.0 110.264 172.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 71.2 t -62.61 -46.94 95.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 123.076 0.55 . . . . 0.0 110.13 175.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.23 -41.29 92.8 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.253 1.021 . . . . 0.0 112.002 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -63.6 -39.55 94.66 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.013 0.525 . . . . 0.0 111.762 175.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 71.7 t60 -71.8 -50.75 27.03 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.268 0.627 . . . . 0.0 111.15 176.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 30.1 ttp -57.54 -34.9 69.64 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.318 1.847 . . . . 0.0 114.378 -175.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 13.0 t -74.35 -16.1 60.92 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 120.06 1.3 . . . . 0.0 112.544 175.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -98.84 -30.64 12.29 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.53 1.532 . . . . 0.0 112.039 176.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 36.4 t -61.95 145.15 53.79 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.418 1.887 . . . . 0.0 112.279 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -121.33 -5.39 9.37 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.406 1.482 . . . . 0.0 114.718 -177.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -88.95 -15.5 34.12 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.486 1.039 . . . . 0.0 113.211 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 58.69 -126.9 43.9 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 121.38 -0.825 . . . . 0.0 112.007 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -66.48 -10.06 40.64 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -94.26 0.35 55.59 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.573 1.149 . . . . 0.0 113.445 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 21.1 t -59.17 140.77 55.57 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 122.331 1.062 . . . . 0.0 110.383 177.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 55.1 mm-40 -77.94 -9.0 58.87 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.853 1.261 . . . . 0.0 113.319 -176.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 10.9 t -93.94 124.13 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.491 1.116 . . . . 0.0 108.652 175.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -53.63 -50.36 65.88 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -176.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -62.4 -32.85 73.73 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -178.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 49.7 t -68.61 -59.37 3.17 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.937 0.789 . . . . 0.0 109.992 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.73 68.67 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.647 0.779 . . . . 0.0 112.419 178.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 19.8 m -69.32 -51.9 32.57 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.314 -0.866 . . . . 0.0 112.08 176.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 36.7 m -62.9 -33.64 75.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.853 1.206 . . . . 0.0 112.066 178.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -59.65 -34.15 72.45 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.474 -0.766 . . . . 0.0 111.872 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -65.93 -27.83 68.47 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 118.924 0.784 . . . . 0.0 111.697 175.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 11.6 mt -76.73 -48.02 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.171 0.989 . . . . 0.0 109.886 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 20.4 mm -59.25 -38.02 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 124.191 0.996 . . . . 0.0 110.741 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 22.3 t -58.46 -29.34 66.1 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.799 1.239 . . . . 0.0 112.8 176.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 10.8 t60 -61.53 -55.89 26.07 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.295 -0.878 . . . . 0.0 110.453 176.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 51.7 m95 -61.3 -31.96 71.8 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 178.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -67.23 -34.76 78.15 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 118.606 -0.711 . . . . 0.0 112.824 178.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 1.6 p30 -100.1 -30.76 11.77 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 11.1 t -78.58 125.7 29.73 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.775 1.23 . . . . 0.0 112.095 -178.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 54.4 p -111.32 1.66 17.23 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.858 1.663 . . . . 0.0 113.941 -178.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 64.7 mtm180 -85.35 162.07 19.22 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.346 1.458 . . . . 0.0 114.084 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 15.3 t-160 -106.67 -37.96 6.27 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.656 1.582 . . . . 0.0 108.425 170.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -85.75 69.88 10.64 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.094 1.758 . . . . 0.0 111.097 175.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 44.3 t -131.62 136.79 29.07 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 126.898 2.079 . . . . 0.0 109.224 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -55.29 -28.38 62.15 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.903 2.402 . . . . 0.0 114.566 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 10.9 t -92.14 -52.14 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 119.461 1.028 . . . . 0.0 111.941 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 4.9 m -68.39 -34.89 76.83 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 115.203 1.556 . . . . 0.0 115.203 -174.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 4.0 tt -54.8 -58.9 12.22 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-O 117.678 -1.153 . . . . 0.0 113.083 -178.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.23 -31.83 93.56 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.983 1.789 . . . . 0.0 113.402 179.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.72 -48.09 60.78 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.706 0.802 . . . . 0.0 111.988 178.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -67.22 -25.19 65.99 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.115 0.966 . . . . 0.0 111.993 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 18.9 t30 -77.46 -40.37 43.43 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.112 1.365 . . . . 0.0 111.699 175.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -79.74 -41.86 25.77 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -179.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 73.8 m -97.79 128.31 44.35 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.71 1.204 . . . . 0.0 112.007 -179.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -131.74 43.1 3.09 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.918 1.687 . . . . 0.0 113.091 -177.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -59.32 -19.92 50.35 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -177.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 26.9 ttp180 . . . . . 0 N--CA 1.476 0.873 0 C-N-CA 125.472 1.509 . . . . 0.0 111.365 179.711 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.383 0 CA-C-O 121.324 0.402 . . . . 0.0 113.874 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.2 m -77.37 50.54 0.79 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.823 1.649 . . . . 0.0 113.36 -179.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -72.04 154.21 41.27 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.381 1.472 . . . . 0.0 112.822 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1001 ' ' MET . . . . . . . . . . . . . 14.4 tpt -72.41 148.51 45.13 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.159 0.983 . . . . 0.0 111.823 178.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1002 ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -71.94 -30.51 65.39 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 -177.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -147.36 158.14 44.32 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 125.167 1.387 . . . . 0.0 112.674 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1004 ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.72 136.45 75.62 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 123.135 2.557 . . . . 0.0 113.449 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1005 ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -95.1 157.71 15.78 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.792 1.237 . . . . 0.0 111.33 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1006 ' ' SER . . . . . . . . . . . . . 20.1 m -74.13 44.52 0.19 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.767 1.627 . . . . 0.0 114.942 -177.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 12.6 t70 -73.69 140.99 78.7 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.127 1.371 . . . . 0.0 110.178 176.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1008 ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -49.61 -20.56 4.42 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 124.233 3.289 . . . . 0.0 117.92 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1009 ' ' SER . . . . . . . . . . . . . 89.0 p -82.78 -7.1 59.68 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 178.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1010 ' ' VAL . . . . . . . . . . . . . 13.6 p -141.5 158.92 21.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 125.464 1.506 . . . . 0.0 112.569 -177.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1011 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -127.1 82.52 67.98 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.0 1.32 . . . . 0.0 110.89 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1012 ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -57.52 -47.29 22.34 Favored 'Trans proline' 0 CA--C 1.549 1.264 0 C-N-CA 123.089 2.526 . . . . 0.0 115.282 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1013 ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -80.64 169.2 17.1 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 122.861 2.374 . . . . 0.0 112.032 179.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1014 ' ' LEU . . . . . . . . . . . . . 7.8 tt -78.5 122.91 26.47 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.364 -0.835 . . . . 0.0 110.437 177.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1015 ' ' SER . . . . . . . . . . . . . 19.4 t -90.43 157.26 17.68 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.7 1.2 . . . . 0.0 113.246 -178.116 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1016 ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -59.13 -29.5 67.45 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.778 1.231 . . . . 0.0 112.838 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.15 -19.45 61.12 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 179.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1018 ' ' THR . . . . . . . . . . . . . 86.2 m -64.96 -60.01 3.53 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.232 0.924 . . . . 0.0 111.069 -178.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -60.29 -27.31 67.19 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.661 -0.649 . . . . 0.0 112.462 174.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1020 ' ' SER . . . . . . . . . . . . . 53.7 m -71.54 -31.23 66.8 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.43 0.692 . . . . 0.0 112.802 178.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1021 ' ' ASP . . . . . . . . . . . . . 37.1 t70 -90.15 -28.62 18.81 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.438 1.095 . . . . 0.0 112.966 175.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 4.1 tt -44.39 -60.1 2.1 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.926 2.09 . . . . 0.0 113.314 -178.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1023 ' ' TRP . . . . . . . . . . . . . 43.8 p-90 -70.94 -4.81 26.57 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1024 ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -112.02 -59.97 1.92 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.736 1.754 . . . . 0.0 115.736 -177.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1025 ' ' LEU . . . . . . . . . . . . . 7.0 mp -120.23 14.27 12.12 Favored 'General case' 0 CA--C 1.554 1.135 0 N-CA-C 116.372 1.99 . . . . 0.0 116.372 -174.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1026 ' ' LEU . . . . . . . . . . . . . 4.4 tt -54.21 134.55 60.14 Favored Pre-proline 0 CA--C 1.552 1.048 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -178.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1027 ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -84.82 170.11 10.17 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 124.656 3.571 . . . . 0.0 113.548 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1028 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.5 -5.72 21.08 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 178.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.67 56.75 2.31 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.297 1.439 . . . . 0.0 111.361 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1030 ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -139.49 139.65 37.03 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.546 1.538 . . . . 0.0 112.299 -178.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1031 ' ' VAL . . . . . . . . . . . . . 35.8 m -132.23 12.43 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 C-N-CA 125.851 1.66 . . . . 0.0 113.182 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1032 ' ' LEU . . . . . . . . . . . . . 42.3 tp -69.64 -24.29 63.61 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.601 1.16 . . . . 0.0 113.919 -177.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1033 ' ' SER . . . . . . . . . . . . . 29.2 m -53.94 115.46 8.2 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.754 1.622 . . . . 0.0 114.316 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1034 ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -71.78 153.92 58.97 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 122.687 2.258 . . . . 0.0 111.09 176.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . . . . . . . . . 87.0 mt -74.02 148.26 86.64 Favored Pre-proline 0 CA--C 1.544 0.729 0 CA-C-O 118.44 -0.791 . . . . 0.0 111.208 178.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1036 ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -53.77 -29.68 53.39 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 123.453 2.768 . . . . 0.0 115.069 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 56.0 p -82.75 -10.82 58.71 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.839 1.656 . . . . 0.0 114.256 177.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1038 ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -117.6 -21.41 8.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.134 1.774 . . . . 0.0 113.514 -178.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -66.02 158.06 29.3 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.589 1.555 . . . . 0.0 114.403 -177.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1040 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.85 21.29 0.16 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 128.215 2.606 . . . . 0.0 114.265 178.024 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1041 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.39 -16.8 64.44 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.702 1.201 . . . . 0.0 113.286 -179.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1042 ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -63.04 -21.07 65.91 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.739 1.216 . . . . 0.0 113.487 176.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1043 ' ' LEU . . . . . . . . . . . . . 29.5 tp -110.42 9.96 23.36 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 127.001 2.12 . . . . 0.0 112.114 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1044 ' ' MET . . . . . . . . . . . . . 13.3 tpt -76.81 150.88 36.1 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -175.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 1.9 mp -125.04 159.91 30.25 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 125.602 1.561 . . . . 0.0 111.992 177.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 67.3 m -66.63 152.16 95.5 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 170.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1047 ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -64.02 -11.49 27.57 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 122.25 1.967 . . . . 0.0 115.788 -174.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1048 ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -80.08 -18.02 51.1 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.406 -0.809 . . . . 0.0 112.236 177.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1049 ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -84.85 -9.97 57.61 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.481 1.112 . . . . 0.0 112.232 177.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1050 ' ' ILE . . . . . . . . . . . . . 95.8 mt -58.55 -35.25 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.658 1.183 . . . . 0.0 109.711 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1051 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -65.58 -11.24 42.38 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.077 1.351 . . . . 0.0 113.167 177.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1052 ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -82.94 -25.37 32.44 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.604 1.162 . . . . 0.0 112.286 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1053 ' ' TRP . . . . . . . . . . . . . 2.3 p-90 -109.69 -26.07 10.06 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.517 1.127 . . . . 0.0 113.677 178.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1054 ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -113.6 109.93 19.41 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 169.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1055 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.07 144.54 50.36 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -174.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1056 ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -91.01 178.22 6.06 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.169 1.387 . . . . 0.0 110.561 172.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1057 ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -65.79 120.2 66.94 Favored Pre-proline 0 CA--C 1.552 1.023 0 O-C-N 120.668 -1.27 . . . . 0.0 110.618 177.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1058 ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -82.8 -12.11 9.94 Favored 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 123.211 2.608 . . . . 0.0 114.497 -176.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1059 ' ' GLY . . . . . . . . . . . . . . . 96.35 -146.53 18.3 Favored Glycine 0 CA--C 1.543 1.816 0 C-N-CA 125.232 1.396 . . . . 0.0 112.951 -178.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1060 ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -74.92 -10.26 21.27 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 124.128 3.219 . . . . 0.0 114.672 -177.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1061 ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -140.0 166.15 25.43 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.459 1.903 . . . . 0.0 110.997 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 2001 ' ' GLY . . . . . . . . . . . . . . . 80.59 19.05 69.32 Favored Glycine 0 CA--C 1.538 1.501 0 N-CA-C 115.221 0.848 . . . . 0.0 115.221 178.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 2002 ' ' SER . . . . . . . . . . . . . 18.1 m -76.56 13.55 0.96 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.68 1.592 . . . . 0.0 114.695 -179.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 2003 ' ' CYS . . . . . . . . . . . . . 57.0 m -50.14 -27.98 6.62 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.221 2.209 . . . . 0.0 114.722 -178.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 2004 ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -56.13 -25.45 46.2 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.29 1.436 . . . . 0.0 113.987 179.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 2005 ' ' ASN . . . . . . . . . . . . . 32.1 t30 -78.05 -25.1 47.58 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.714 0.806 . . . . 0.0 111.957 175.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 2006 ' ' GLY . . . . . . . . . . . . . . . -91.92 -30.27 10.58 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 125.826 1.679 . . . . 0.0 113.707 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 2007 ' ' THR . . . . . . . . . . . . . 72.2 p -73.01 -25.31 60.92 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 118.62 1.21 . . . . 0.0 112.266 177.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3340 ' ' ALA . . . . . . . . . . . . . . . -84.47 142.83 29.79 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.718 1.207 . . . . 0.0 111.275 176.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3341 ' ' THR . . . . . . . . . . . . . 63.0 m -123.96 140.69 52.73 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.019 1.327 . . . . 0.0 110.696 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3342 ' ' GLY . . . . . . . . . . . . . . . 73.47 -113.94 4.46 Favored Glycine 0 CA--C 1.542 1.736 0 CA-C-O 118.328 -1.262 . . . . 0.0 112.72 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3343 ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -63.09 171.57 6.09 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 124.287 3.325 . . . . 0.0 114.13 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3344 ' ' THR . . . . . . . . . . . . . 7.2 m -48.22 -36.33 13.64 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 126.966 2.106 . . . . 0.0 113.958 -179.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3345 ' ' ALA . . . . . . . . . . . . . . . -130.7 128.83 41.66 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.315 1.846 . . . . 0.0 108.005 175.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3346 ' ' ASP . . . . . . . . . . . . . 13.0 t70 -61.87 137.53 95.34 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 123.32 0.648 . . . . 0.0 112.447 -177.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3347 ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -53.23 -40.64 76.81 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.022 2.482 . . . . 0.0 114.291 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3348 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -69.55 -35.26 75.24 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.34 -0.85 . . . . 0.0 111.59 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3349 ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -68.04 -38.53 82.61 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 118.601 0.637 . . . . 0.0 110.365 175.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3350 ' ' ARG . . . . . . . . . . . . . 42.3 mtm105 -63.73 -38.16 90.07 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 118.617 -0.706 . . . . 0.0 111.665 175.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3351 ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -58.08 -36.72 73.25 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 119.082 0.855 . . . . 0.0 111.492 173.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3352 ' ' LEU . . . . . . . . . . . . . 55.6 mt -64.17 -45.0 90.34 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.646 0.657 . . . . 0.0 110.937 176.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3353 ' ' ILE . . . . . . . . . . . . . 1.8 mt -58.23 -51.11 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-N 118.142 0.428 . . . . 0.0 110.102 177.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3354 ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -57.34 -53.08 62.23 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.531 1.133 . . . . 0.0 111.414 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3355 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.98 -33.29 75.47 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.458 1.026 . . . . 0.0 112.847 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3356 ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -67.86 -46.19 72.45 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.315 0.962 . . . . 0.0 109.305 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3357 ' ' LEU . . . . . . . . . . . . . 12.0 tp -61.78 -39.65 92.41 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.949 1.3 . . . . 0.0 111.861 177.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3358 ' ' VAL . . . . . . . . . . . . . 96.1 t -60.29 -32.52 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.056 1.298 . . . . 0.0 110.331 174.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3359 ' ' LEU . . . . . . . . . . . . . 6.4 tp -73.65 -29.49 62.36 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 120.86 -1.15 . . . . 0.0 112.779 175.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3360 ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.37 -29.93 69.24 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 120.102 1.319 . . . . 0.0 109.56 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3361 ' ' LEU . . . . . . . . . . . . . 2.5 mt -71.67 -53.68 12.8 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.483 -0.761 . . . . 0.0 109.768 175.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3362 ' ' HIS . . . . . . . . . . . . . 12.4 t60 -54.62 -53.62 52.24 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.381 0.673 . . . . 0.0 110.925 178.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3363 ' ' ALA . . . . . . . . . . . . . . . -59.91 -21.94 61.75 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -178.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3364 ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -87.53 -32.99 19.11 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.119 0.872 . . . . 0.0 111.958 174.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3365 ' ' LYS . . . . . . . . . . . . . 39.2 mttm -84.16 -41.5 16.97 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.043 1.337 . . . . 0.0 113.346 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3366 ' ' CYS . . . . . . . . . . . . . 34.5 t -56.73 -45.74 81.76 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.382 1.873 . . . . 0.0 111.212 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3367 ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -60.41 -38.55 84.41 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 176.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3368 ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -69.69 -43.94 71.45 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.625 -0.672 . . . . 0.0 110.551 177.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3369 ' ' ARG . . . . . . . . . . . . . 3.4 tmm_? -56.41 -42.85 78.67 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.757 1.623 . . . . 0.0 111.296 176.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3370 ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -69.08 -49.26 58.88 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.694 0.798 . . . . 0.0 111.745 178.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3371 ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -66.64 -38.13 86.26 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -178.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3372 ' ' ALA . . . . . . . . . . . . . . . -69.46 -33.76 73.39 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.911 0.885 . . . . 0.0 113.121 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3373 ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -81.01 -48.85 11.67 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.527 0.731 . . . . 0.0 112.142 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3374 ' ' GLY . . . . . . . . . . . . . . . 74.04 -15.16 3.35 Favored Glycine 0 CA--C 1.54 1.632 0 N-CA-C 116.977 1.551 . . . . 0.0 116.977 178.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3375 ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -97.01 -37.86 10.01 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.923 1.861 . . . . 0.0 111.837 178.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3376 ' ' VAL . . . . . . . . . . . . . 13.1 m -86.83 165.38 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.762 1.225 . . . . 0.0 110.997 176.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3377 ' ' ARG . . . . . . . . . . . . . 77.1 mmt-85 -118.98 171.29 8.35 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.2 1.4 . . . . 0.0 111.218 178.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3378 ' ' ALA . . . . . . . . . . . . . . . -60.45 160.72 8.39 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.053 0.941 . . . . 0.0 113.278 -178.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3379 ' ' CYS . . . . . . . . . . . . . 16.8 p -67.77 174.35 3.67 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 126.059 1.744 . . . . 0.0 114.179 -178.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3380 ' ' SER . . . . . . . . . . . . . 75.8 p -92.6 3.96 54.54 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.439 1.496 . . . . 0.0 114.668 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3381 ' ' LEU . . . . . . . . . . . . . 5.1 tt -72.31 125.09 91.53 Favored Pre-proline 0 CA--C 1.554 1.11 0 C-N-CA 124.738 1.215 . . . . 0.0 110.041 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3382 ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -65.9 -46.72 4.47 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.96 2.44 . . . . 0.0 115.055 -174.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3383 ' ' HIS . . . . . . . . . . . . . 72.8 m80 -74.73 -13.48 60.61 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3384 ' ' CYS . . . . . . . . . . . . . 41.4 t -62.27 -49.15 76.82 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.242 1.017 . . . . 0.0 110.379 178.021 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3385 ' ' ARG . . . . . . . . . . . . . 31.5 tpt180 -55.21 -37.58 67.32 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.916 1.286 . . . . 0.0 111.96 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3386 ' ' THR . . . . . . . . . . . . . 52.0 m -68.84 -55.77 10.1 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.672 0.789 . . . . 0.0 111.389 177.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3387 ' ' MET . . . . . . . . . . . . . 13.9 mmt -64.45 -35.25 80.33 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3388 ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -64.74 -33.29 75.62 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.711 1.596 . . . . 0.0 112.335 178.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3389 ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -70.72 -40.89 72.52 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.49 0.716 . . . . 0.0 110.298 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3390 ' ' VAL . . . . . . . . . . . . . 78.6 t -62.61 -47.54 92.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 123.353 0.661 . . . . 0.0 110.566 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3391 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.13 -42.83 95.63 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.182 0.993 . . . . 0.0 112.575 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3392 ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -65.08 -30.33 71.28 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 177.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3393 ' ' HIS . . . . . . . . . . . . . 64.8 t60 -78.32 -52.48 8.56 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.577 0.751 . . . . 0.0 110.3 174.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3394 ' ' MET . . . . . . . . . . . . . 32.6 ttp -55.6 -35.84 66.25 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.1 1.76 . . . . 0.0 113.698 -176.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3395 ' ' THR . . . . . . . . . . . . . 6.0 t -71.44 -11.46 60.9 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.101 1.319 . . . . 0.0 113.55 178.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3396 ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -112.9 -22.74 10.48 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.365 1.466 . . . . 0.0 112.791 176.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3397 ' ' CYS . . . . . . . . . . . . . 39.0 t -56.91 138.19 54.22 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.475 1.51 . . . . 0.0 112.452 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3398 ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -103.48 -16.55 15.53 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.672 1.589 . . . . 0.0 113.699 -178.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3399 ' ' ALA . . . . . . . . . . . . . . . -95.68 -31.18 13.36 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.34 1.056 . . . . 0.0 112.678 -178.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3400 ' ' GLY . . . . . . . . . . . . . . . 52.76 -108.06 0.65 Allowed Glycine 0 CA--C 1.536 1.35 0 C-N-CA 124.561 1.076 . . . . 0.0 112.917 178.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3401 ' ' LYS . . . . . . . . . . . . . 67.3 mttm -58.37 -25.08 61.62 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 121.446 -1.032 . . . . 0.0 113.13 177.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3402 ' ' ALA . . . . . . . . . . . . . . . -96.09 -0.69 49.96 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.335 1.454 . . . . 0.0 114.005 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3403 ' ' CYS . . . . . . . . . . . . . 16.2 t -60.07 144.24 50.08 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 122.341 1.067 . . . . 0.0 111.007 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3404 ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -80.01 -8.77 59.53 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.611 1.165 . . . . 0.0 113.036 -177.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3405 ' ' VAL . . . . . . . . . . . . . 95.9 t -89.56 117.41 32.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 173.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3406 ' ' ALA . . . . . . . . . . . . . . . -55.58 -40.73 72.39 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -177.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3407 ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -64.06 -38.37 90.82 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.664 0.786 . . . . 0.0 112.915 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3408 ' ' CYS . . . . . . . . . . . . . 51.9 t -68.03 -57.14 6.64 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.458 1.503 . . . . 0.0 110.285 178.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3409 ' ' ALA . . . . . . . . . . . . . . . -57.35 -28.09 62.85 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.296 1.039 . . . . 0.0 113.084 177.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3410 ' ' SER . . . . . . . . . . . . . 68.7 m -79.32 -49.77 11.91 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.739 0.816 . . . . 0.0 112.268 176.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3411 ' ' SER . . . . . . . . . . . . . 58.6 m -61.61 -33.98 74.86 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.498 -0.751 . . . . 0.0 111.962 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3412 ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -58.75 -31.87 68.73 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.014 0.926 . . . . 0.0 112.546 176.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3413 ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -68.74 -35.3 76.94 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.074 0.852 . . . . 0.0 111.592 176.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3414 ' ' ILE . . . . . . . . . . . . . 7.9 mt -68.84 -45.23 81.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 123.846 0.858 . . . . 0.0 109.668 176.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3415 ' ' ILE . . . . . . . . . . . . . 18.1 mm -62.44 -40.75 89.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.151 0.98 . . . . 0.0 110.911 175.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3416 ' ' SER . . . . . . . . . . . . . 70.8 m -61.09 -26.66 67.81 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.968 0.907 . . . . 0.0 113.106 178.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3417 ' ' HIS . . . . . . . . . . . . . 9.5 t60 -62.14 -56.59 17.26 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.688 1.131 . . . . 0.0 109.889 177.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3418 ' ' TRP . . . . . . . . . . . . . 41.5 m95 -60.19 -30.63 69.49 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 178.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3419 ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -72.8 -28.13 62.4 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 178.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3420 ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -100.14 -34.97 9.82 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 179.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3421 ' ' CYS . . . . . . . . . . . . . 5.3 t -74.39 134.16 42.44 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.413 1.485 . . . . 0.0 111.225 -178.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3422 ' ' THR . . . . . . . . . . . . . 61.6 p -123.22 -9.65 8.11 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -176.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3423 ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -78.91 159.81 27.56 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 0.0 113.499 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3424 ' ' HIS . . . . . . . . . . . . . 39.2 p-80 -93.14 -25.22 17.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.695 1.198 . . . . 0.0 111.324 172.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3425 ' ' ASP . . . . . . . . . . . . . 17.5 t0 -106.84 86.13 2.27 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.615 1.966 . . . . 0.0 110.797 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3426 ' ' CYS . . . . . . . . . . . . . 50.9 t -138.69 135.87 18.25 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 126.842 2.057 . . . . 0.0 108.7 179.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3427 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -58.76 -26.55 80.45 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 123.049 2.5 . . . . 0.0 114.627 -177.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3428 ' ' VAL . . . . . . . . . . . . . 39.4 t -92.07 -48.97 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.636 1.107 . . . . 0.0 111.643 176.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3429 ' ' CYS . . . . . . . . . . . . . 8.5 m -69.96 -43.98 70.43 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -175.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3430 ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.03 -54.31 48.62 Favored Pre-proline 0 CA--C 1.552 1.021 0 O-C-N 120.904 -1.123 . . . . 0.0 112.845 -178.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3431 ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -65.8 -4.41 9.88 Favored 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 122.91 2.406 . . . . 0.0 114.996 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3432 ' ' LEU . . . . . . . . . . . . . 96.6 mt -100.0 -47.61 4.94 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.91 1.284 . . . . 0.0 109.911 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3433 ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -58.59 -36.86 74.65 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.204 1.402 . . . . 0.0 111.918 176.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3434 ' ' ASN . . . . . . . . . . . . . 16.6 p30 -83.93 -10.02 58.27 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 179.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3435 ' ' ALA . . . . . . . . . . . . . . . -102.81 -38.96 7.2 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.947 1.299 . . . . 0.0 113.619 -178.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3436 ' ' SER . . . . . . . . . . . . . 32.8 t -73.37 142.03 47.02 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 121.684 0.754 . . . . 0.0 112.504 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3437 ' ' ASP . . . . . . . . . . . . . 38.0 t70 -84.54 -6.05 59.34 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.904 1.282 . . . . 0.0 112.844 178.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3438 ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -79.11 40.64 0.42 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 126.028 1.731 . . . . 0.0 113.383 -178.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3439 ' ' ARG . . . . . . . . . . . . . 40.9 ptt180 . . . . . 0 N--CA 1.478 0.951 0 C-N-CA 126.996 2.119 . . . . 0.0 113.973 -178.507 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A 5001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A 5002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A 5003 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_