data_nef_c36000_5b7a save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 25576 BMRB 25577 BMRB 36006 BMRB 36007 BMRB 36008 PDB 5B7A stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 50 PHE C 1 51 ALY N 1 51 ALY C 1 52 VAL N stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A -13 MET start . . 2 A -12 GLY middle . false 3 A -11 SER middle . . 4 A -10 SER middle . . 5 A -9 HIS middle . . 6 A -8 HIS middle . . 7 A -7 HIS middle . . 8 A -6 HIS middle . . 9 A -5 HIS middle . . 10 A -4 HIS middle . . 11 A -3 SER middle . . 12 A -2 GLN middle . . 13 A -1 ASP middle . . 14 A 0 PRO middle . false 15 A 1 MET middle . . 16 A 2 SER middle . . 17 A 3 ASP middle . . 18 A 4 GLN middle . . 19 A 5 GLU middle . . 20 A 6 ALA middle . . 21 A 7 LYS middle . . 22 A 8 PRO middle . false 23 A 9 SER middle . . 24 A 10 THR middle . . 25 A 11 GLU middle . . 26 A 12 ASP middle . . 27 A 13 LEU middle . . 28 A 14 GLY middle . false 29 A 15 ASP middle . . 30 A 16 LYS middle . . 31 A 17 LYS middle . . 32 A 18 GLU middle . . 33 A 19 GLY middle . false 34 A 20 GLU middle . . 35 A 21 TYR middle . . 36 A 22 ILE middle . . 37 A 23 LYS middle . . 38 A 24 LEU middle . . 39 A 25 LYS middle . . 40 A 26 VAL middle . . 41 A 27 ILE middle . . 42 A 28 GLY middle . false 43 A 29 GLN middle . . 44 A 30 ASP middle . . 45 A 31 SER middle . . 46 A 32 SER middle . . 47 A 33 GLU middle . . 48 A 34 ILE middle . . 49 A 35 HIS middle . . 50 A 36 PHE middle -OXT . 51 A 37 ALY middle -H2,-OXT . 52 A 38 VAL middle -H2 . 53 A 39 LYS middle . . 54 A 40 MET middle . . 55 A 41 THR middle . . 56 A 42 THR middle . . 57 A 43 HIS middle . . 58 A 44 LEU middle . . 59 A 45 LYS middle . . 60 A 46 LYS middle . . 61 A 47 LEU middle . . 62 A 48 LYS middle . . 63 A 49 GLU middle . . 64 A 50 SER middle . . 65 A 51 TYR middle . . 66 A 52 CYS middle . . 67 A 53 GLN middle . . 68 A 54 ARG middle . . 69 A 55 GLN middle . . 70 A 56 GLY middle . false 71 A 57 VAL middle . . 72 A 58 PRO middle . false 73 A 59 MET middle . . 74 A 60 ASN middle . . 75 A 61 SER middle . . 76 A 62 LEU middle . . 77 A 63 ARG middle . . 78 A 64 PHE middle . . 79 A 65 LEU middle . . 80 A 66 PHE middle . . 81 A 67 GLU middle . . 82 A 68 GLY middle . false 83 A 69 GLN middle . . 84 A 70 ARG middle . . 85 A 71 ILE middle . . 86 A 72 ALA middle . . 87 A 73 ASP middle . . 88 A 74 ASN middle . . 89 A 75 HIS middle . . 90 A 76 THR middle . . 91 A 77 PRO middle . false 92 A 78 LYS middle . . 93 A 79 GLU middle . . 94 A 80 LEU middle . . 95 A 81 GLY middle . false 96 A 82 MET middle . . 97 A 83 GLU middle . . 98 A 84 GLU middle . . 99 A 85 GLU middle . . 100 A 86 ASP middle . . 101 A 87 VAL middle . . 102 A 88 ILE middle . . 103 A 89 GLU middle . . 104 A 90 VAL middle . . 105 A 91 TYR middle . . 106 A 92 GLN middle . . 107 A 93 GLU middle . . 108 A 94 GLN middle . . 109 A 95 THR middle . . 110 A 96 GLY middle . false 111 A 97 GLY end . false stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET H H 1 8.490 0.020 A 1 MET HA H 1 4.548 0.020 A 1 MET HBx H 1 1.983 0.020 A 1 MET HBy H 1 1.983 0.020 A 1 MET HE% H 1 2.055 0.020 A 1 MET HGx H 1 2.616 0.020 A 1 MET HGy H 1 2.616 0.020 A 1 MET C C 13 176.778 0.400 A 1 MET CA C 13 55.755 0.400 A 1 MET CB C 13 32.553 0.400 A 1 MET CE C 13 16.930 0.400 A 1 MET CG C 13 32.267 0.400 A 1 MET N N 15 118.999 0.400 A 2 SER H H 1 8.132 0.020 A 2 SER HA H 1 4.463 0.020 A 2 SER HBx H 1 3.853 0.020 A 2 SER HBy H 1 3.853 0.020 A 2 SER C C 13 174.579 0.400 A 2 SER CA C 13 58.539 0.400 A 2 SER CB C 13 63.940 0.400 A 2 SER N N 15 116.367 0.400 A 3 ASP H H 1 8.358 0.020 A 3 ASP HA H 1 4.571 0.020 A 3 ASP HBx H 1 2.675 0.020 A 3 ASP HBy H 1 2.675 0.020 A 3 ASP C C 13 176.443 0.400 A 3 ASP CA C 13 54.819 0.400 A 3 ASP CB C 13 40.939 0.400 A 3 ASP N N 15 122.355 0.400 A 4 GLN H H 1 8.256 0.020 A 4 GLN HA H 1 4.267 0.020 A 4 GLN HBy H 1 2.155 0.020 A 4 GLN HBx H 1 1.969 0.020 A 4 GLN HE2y H 1 7.539 0.020 A 4 GLN HE2x H 1 6.893 0.020 A 4 GLN HGx H 1 2.341 0.020 A 4 GLN HGy H 1 2.341 0.020 A 4 GLN C C 13 176.138 0.400 A 4 GLN CA C 13 55.933 0.400 A 4 GLN CB C 13 29.411 0.400 A 4 GLN CG C 13 33.659 0.400 A 4 GLN N N 15 119.953 0.400 A 4 GLN NE2 N 15 112.025 0.400 A 5 GLU H H 1 8.298 0.020 A 5 GLU HA H 1 4.208 0.020 A 5 GLU HBx H 1 1.964 0.020 A 5 GLU HBy H 1 1.964 0.020 A 5 GLU HGx H 1 2.183 0.020 A 5 GLU HGy H 1 2.183 0.020 A 5 GLU C C 13 176.137 0.400 A 5 GLU CA C 13 56.480 0.400 A 5 GLU CB C 13 30.261 0.400 A 5 GLU CG C 13 36.415 0.400 A 5 GLU N N 15 121.532 0.400 A 6 ALA H H 1 8.270 0.020 A 6 ALA HA H 1 4.266 0.020 A 6 ALA HB% H 1 1.324 0.020 A 6 ALA C C 13 177.348 0.400 A 6 ALA CA C 13 52.319 0.400 A 6 ALA CB C 13 19.120 0.400 A 6 ALA N N 15 125.447 0.400 A 7 LYS H H 1 8.314 0.020 A 7 LYS HA H 1 4.578 0.020 A 7 LYS HBy H 1 1.798 0.020 A 7 LYS HBx H 1 1.690 0.020 A 7 LYS HDx H 1 1.651 0.020 A 7 LYS HDy H 1 1.651 0.020 A 7 LYS HEx H 1 2.975 0.020 A 7 LYS HEy H 1 2.975 0.020 A 7 LYS HGx H 1 1.424 0.020 A 7 LYS HGy H 1 1.424 0.020 A 7 LYS CA C 13 54.062 0.400 A 7 LYS CB C 13 32.588 0.400 A 7 LYS CD C 13 29.028 0.400 A 7 LYS CE C 13 42.083 0.400 A 7 LYS CG C 13 24.622 0.400 A 7 LYS N N 15 122.398 0.400 A 8 PRO HA H 1 4.431 0.020 A 8 PRO HB2 H 1 2.281 0.020 A 8 PRO HB3 H 1 1.897 0.020 A 8 PRO HDy H 1 3.798 0.020 A 8 PRO HDx H 1 3.622 0.020 A 8 PRO HGx H 1 1.984 0.020 A 8 PRO HGy H 1 1.984 0.020 A 8 PRO C C 13 177.021 0.400 A 8 PRO CA C 13 63.085 0.400 A 8 PRO CB C 13 32.163 0.400 A 8 PRO CD C 13 50.704 0.400 A 8 PRO CG C 13 27.357 0.400 A 9 SER H H 1 8.599 0.020 A 9 SER HA H 1 4.484 0.020 A 9 SER HBx H 1 3.865 0.020 A 9 SER HBy H 1 3.865 0.020 A 9 SER C C 13 174.261 0.400 A 9 SER CA C 13 58.299 0.400 A 9 SER CB C 13 63.848 0.400 A 9 SER N N 15 116.863 0.400 A 10 THR H H 1 8.247 0.020 A 10 THR HA H 1 4.338 0.020 A 10 THR HB H 1 4.243 0.020 A 10 THR HG2% H 1 1.176 0.020 A 10 THR C C 13 176.158 0.400 A 10 THR CA C 13 61.947 0.400 A 10 THR CB C 13 69.658 0.400 A 10 THR CG2 C 13 21.499 0.400 A 10 THR N N 15 115.742 0.400 A 11 GLU H H 1 8.367 0.020 A 11 GLU HA H 1 4.242 0.020 A 11 GLU HBx H 1 1.903 0.020 A 11 GLU HBy H 1 1.903 0.020 A 11 GLU HGx H 1 2.224 0.020 A 11 GLU HGy H 1 2.224 0.020 A 11 GLU C C 13 175.920 0.400 A 11 GLU CA C 13 56.779 0.400 A 11 GLU CB C 13 29.869 0.400 A 11 GLU CG C 13 36.240 0.400 A 11 GLU N N 15 122.926 0.400 A 12 ASP H H 1 8.406 0.020 A 12 ASP HA H 1 4.567 0.020 A 12 ASP HBx H 1 2.589 0.020 A 12 ASP HBy H 1 2.589 0.020 A 12 ASP C C 13 176.402 0.400 A 12 ASP CA C 13 54.224 0.400 A 12 ASP CB C 13 41.161 0.400 A 12 ASP N N 15 122.009 0.400 A 13 LEU H H 1 8.373 0.020 A 13 LEU HA H 1 4.311 0.020 A 13 LEU HBx H 1 1.596 0.020 A 13 LEU HBy H 1 1.678 0.020 A 13 LEU HDx% H 1 0.874 0.020 A 13 LEU HDy% H 1 0.815 0.020 A 13 LEU HG H 1 1.607 0.020 A 13 LEU C C 13 178.231 0.400 A 13 LEU CA C 13 55.384 0.400 A 13 LEU CB C 13 42.132 0.400 A 13 LEU CD1 C 13 25.138 0.400 A 13 LEU CD2 C 13 23.064 0.400 A 13 LEU CG C 13 26.930 0.400 A 13 LEU N N 15 123.684 0.400 A 14 GLY H H 1 8.444 0.020 A 14 GLY HAx H 1 3.897 0.020 A 14 GLY HAy H 1 3.897 0.020 A 14 GLY C C 13 174.014 0.400 A 14 GLY CA C 13 45.600 0.400 A 14 GLY N N 15 108.925 0.400 A 15 ASP H H 1 8.232 0.020 A 15 ASP HA H 1 4.549 0.020 A 15 ASP HBx H 1 2.630 0.020 A 15 ASP HBy H 1 2.630 0.020 A 15 ASP C C 13 176.810 0.400 A 15 ASP CA C 13 54.389 0.400 A 15 ASP CB C 13 41.153 0.400 A 15 ASP N N 15 120.460 0.400 A 16 LYS H H 1 8.365 0.020 A 16 LYS HA H 1 4.274 0.020 A 16 LYS HBx H 1 1.832 0.020 A 16 LYS HBy H 1 1.832 0.020 A 16 LYS HDx H 1 1.641 0.020 A 16 LYS HDy H 1 1.641 0.020 A 16 LYS HEx H 1 3.191 0.020 A 16 LYS HEy H 1 3.191 0.020 A 16 LYS HGx H 1 1.545 0.020 A 16 LYS HGy H 1 1.545 0.020 A 16 LYS C C 13 176.470 0.400 A 16 LYS CA C 13 56.579 0.400 A 16 LYS CB C 13 29.470 0.400 A 16 LYS CD C 13 28.764 0.400 A 16 LYS CE C 13 43.023 0.400 A 16 LYS CG C 13 27.435 0.400 A 16 LYS N N 15 121.738 0.400 A 17 LYS H H 1 8.372 0.020 A 17 LYS HA H 1 4.272 0.020 A 17 LYS HBx H 1 1.789 0.020 A 17 LYS HBy H 1 1.789 0.020 A 17 LYS HDx H 1 1.650 0.020 A 17 LYS HDy H 1 1.650 0.020 A 17 LYS HEx H 1 2.974 0.020 A 17 LYS HEy H 1 2.974 0.020 A 17 LYS HGx H 1 1.393 0.020 A 17 LYS HGy H 1 1.393 0.020 A 17 LYS C C 13 176.735 0.400 A 17 LYS CA C 13 56.177 0.400 A 17 LYS CB C 13 32.684 0.400 A 17 LYS CD C 13 29.000 0.400 A 17 LYS CE C 13 42.104 0.400 A 17 LYS CG C 13 24.651 0.400 A 17 LYS N N 15 122.625 0.400 A 18 GLU H H 1 8.512 0.020 A 18 GLU HA H 1 4.257 0.020 A 18 GLU HBx H 1 2.000 0.020 A 18 GLU HBy H 1 2.000 0.020 A 18 GLU HGx H 1 2.232 0.020 A 18 GLU HGy H 1 2.232 0.020 A 18 GLU C C 13 176.862 0.400 A 18 GLU CA C 13 57.094 0.400 A 18 GLU CB C 13 30.261 0.400 A 18 GLU CG C 13 36.277 0.400 A 18 GLU N N 15 122.042 0.400 A 19 GLY H H 1 8.472 0.020 A 19 GLY HAx H 1 3.922 0.020 A 19 GLY HAy H 1 3.922 0.020 A 19 GLY C C 13 173.482 0.400 A 19 GLY CA C 13 45.386 0.400 A 19 GLY N N 15 109.990 0.400 A 20 GLU H H 1 8.213 0.020 A 20 GLU HA H 1 4.260 0.020 A 20 GLU HBx H 1 1.889 0.020 A 20 GLU HBy H 1 1.889 0.020 A 20 GLU HGx H 1 2.229 0.020 A 20 GLU HGy H 1 2.229 0.020 A 20 GLU C C 13 175.504 0.400 A 20 GLU CA C 13 56.726 0.400 A 20 GLU CB C 13 30.806 0.400 A 20 GLU CG C 13 36.253 0.400 A 20 GLU N N 15 119.628 0.400 A 21 TYR H H 1 8.401 0.020 A 21 TYR HA H 1 5.084 0.020 A 21 TYR HB2 H 1 2.792 0.020 A 21 TYR HB3 H 1 2.569 0.020 A 21 TYR HD1 H 1 6.884 0.020 A 21 TYR HD2 H 1 6.884 0.020 A 21 TYR HE1 H 1 6.771 0.020 A 21 TYR HE2 H 1 6.771 0.020 A 21 TYR C C 13 175.676 0.400 A 21 TYR CA C 13 57.414 0.400 A 21 TYR CB C 13 41.718 0.400 A 21 TYR CD1 C 13 133.327 0.400 A 21 TYR CD2 C 13 133.298 0.400 A 21 TYR CE1 C 13 118.245 0.400 A 21 TYR CE2 C 13 118.245 0.400 A 21 TYR N N 15 119.449 0.400 A 22 ILE H H 1 9.168 0.020 A 22 ILE HA H 1 4.781 0.020 A 22 ILE HB H 1 1.642 0.020 A 22 ILE HD1% H 1 0.474 0.020 A 22 ILE HG12 H 1 1.339 0.020 A 22 ILE HG13 H 1 0.869 0.020 A 22 ILE HG2% H 1 0.836 0.020 A 22 ILE C C 13 173.382 0.400 A 22 ILE CA C 13 59.417 0.400 A 22 ILE CB C 13 42.383 0.400 A 22 ILE CD1 C 13 14.714 0.400 A 22 ILE CG1 C 13 26.244 0.400 A 22 ILE CG2 C 13 18.064 0.400 A 22 ILE N N 15 116.811 0.400 A 23 LYS H H 1 8.598 0.020 A 23 LYS HA H 1 5.294 0.020 A 23 LYS HB2 H 1 1.690 0.020 A 23 LYS HB3 H 1 1.579 0.020 A 23 LYS HDx H 1 1.585 0.020 A 23 LYS HDy H 1 1.585 0.020 A 23 LYS HEx H 1 2.761 0.020 A 23 LYS HEy H 1 2.761 0.020 A 23 LYS HGx H 1 1.157 0.020 A 23 LYS HGy H 1 1.157 0.020 A 23 LYS C C 13 175.553 0.400 A 23 LYS CA C 13 55.629 0.400 A 23 LYS CB C 13 33.744 0.400 A 23 LYS CD C 13 29.391 0.400 A 23 LYS CE C 13 41.224 0.400 A 23 LYS CG C 13 25.310 0.400 A 23 LYS N N 15 123.718 0.400 A 24 LEU H H 1 8.945 0.020 A 24 LEU HA H 1 4.965 0.020 A 24 LEU HB2 H 1 1.438 0.020 A 24 LEU HB3 H 1 1.202 0.020 A 24 LEU HDx% H 1 0.817 0.020 A 24 LEU HDy% H 1 0.817 0.020 A 24 LEU HG H 1 0.622 0.020 A 24 LEU C C 13 175.919 0.400 A 24 LEU CA C 13 52.892 0.400 A 24 LEU CB C 13 46.684 0.400 A 24 LEU CD1 C 13 24.096 0.400 A 24 LEU CD2 C 13 24.096 0.400 A 24 LEU CG C 13 26.611 0.400 A 24 LEU N N 15 123.843 0.400 A 25 LYS H H 1 8.625 0.020 A 25 LYS HA H 1 4.692 0.020 A 25 LYS HB2 H 1 1.545 0.020 A 25 LYS HB3 H 1 1.438 0.020 A 25 LYS HDx H 1 1.562 0.020 A 25 LYS HDy H 1 1.562 0.020 A 25 LYS HEx H 1 2.768 0.020 A 25 LYS HEy H 1 2.768 0.020 A 25 LYS HG2 H 1 0.932 0.020 A 25 LYS HG3 H 1 0.760 0.020 A 25 LYS C C 13 174.096 0.400 A 25 LYS CA C 13 55.045 0.400 A 25 LYS CB C 13 34.998 0.400 A 25 LYS CD C 13 29.479 0.400 A 25 LYS CE C 13 41.666 0.400 A 25 LYS CG C 13 25.100 0.400 A 25 LYS N N 15 120.699 0.400 A 26 VAL H H 1 9.100 0.020 A 26 VAL HA H 1 5.050 0.020 A 26 VAL HB H 1 2.221 0.020 A 26 VAL HGx% H 1 0.883 0.020 A 26 VAL HGy% H 1 0.335 0.020 A 26 VAL C C 13 176.206 0.400 A 26 VAL CA C 13 61.144 0.400 A 26 VAL CB C 13 32.270 0.400 A 26 VAL CG1 C 13 22.367 0.400 A 26 VAL CG2 C 13 23.102 0.400 A 26 VAL N N 15 124.114 0.400 A 27 ILE H H 1 9.068 0.020 A 27 ILE HA H 1 5.016 0.020 A 27 ILE HB H 1 1.746 0.020 A 27 ILE HD1% H 1 0.848 0.020 A 27 ILE HG1x H 1 1.063 0.020 A 27 ILE HG1y H 1 1.063 0.020 A 27 ILE HG2% H 1 0.944 0.020 A 27 ILE C C 13 175.985 0.400 A 27 ILE CA C 13 59.790 0.400 A 27 ILE CB C 13 39.820 0.400 A 27 ILE CD1 C 13 13.419 0.400 A 27 ILE CG1 C 13 27.428 0.400 A 27 ILE CG2 C 13 17.024 0.400 A 27 ILE N N 15 128.206 0.400 A 28 GLY H H 1 8.491 0.020 A 28 GLY HAx H 1 3.703 0.020 A 28 GLY HAy H 1 3.703 0.020 A 28 GLY C C 13 175.509 0.400 A 28 GLY CA C 13 44.073 0.400 A 28 GLY N N 15 113.282 0.400 A 29 GLN H H 1 8.762 0.020 A 29 GLN HA H 1 4.118 0.020 A 29 GLN HB2 H 1 2.063 0.020 A 29 GLN HB3 H 1 2.171 0.020 A 29 GLN HE21 H 1 7.657 0.020 A 29 GLN HE22 H 1 7.006 0.020 A 29 GLN HGx H 1 2.391 0.020 A 29 GLN HGy H 1 2.391 0.020 A 29 GLN C C 13 176.003 0.400 A 29 GLN CA C 13 57.808 0.400 A 29 GLN CB C 13 28.735 0.400 A 29 GLN CG C 13 34.578 0.400 A 29 GLN N N 15 120.483 0.400 A 29 GLN NE2 N 15 114.113 0.400 A 30 ASP H H 1 8.339 0.020 A 30 ASP HA H 1 4.542 0.020 A 30 ASP HB2 H 1 2.986 0.020 A 30 ASP HB3 H 1 2.615 0.020 A 30 ASP C C 13 176.461 0.400 A 30 ASP CA C 13 53.271 0.400 A 30 ASP CB C 13 39.867 0.400 A 30 ASP N N 15 118.362 0.400 A 31 SER H H 1 8.007 0.020 A 31 SER HA H 1 4.049 0.020 A 31 SER HBx H 1 4.000 0.020 A 31 SER HBy H 1 4.000 0.020 A 31 SER C C 13 173.554 0.400 A 31 SER CA C 13 60.529 0.400 A 31 SER CB C 13 62.268 0.400 A 31 SER N N 15 111.085 0.400 A 32 SER H H 1 8.089 0.020 A 32 SER HA H 1 4.385 0.020 A 32 SER HBy H 1 3.878 0.020 A 32 SER HBx H 1 3.790 0.020 A 32 SER C C 13 173.550 0.400 A 32 SER CA C 13 58.590 0.400 A 32 SER CB C 13 64.008 0.400 A 32 SER N N 15 117.478 0.400 A 33 GLU H H 1 8.618 0.020 A 33 GLU HA H 1 5.107 0.020 A 33 GLU HB2 H 1 1.928 0.020 A 33 GLU HB3 H 1 1.789 0.020 A 33 GLU HGx H 1 2.268 0.020 A 33 GLU HGy H 1 2.268 0.020 A 33 GLU C C 13 175.308 0.400 A 33 GLU CA C 13 55.227 0.400 A 33 GLU CB C 13 32.596 0.400 A 33 GLU CG C 13 36.053 0.400 A 33 GLU N N 15 121.738 0.400 A 34 ILE H H 1 8.675 0.020 A 34 ILE HA H 1 4.364 0.020 A 34 ILE HB H 1 1.862 0.020 A 34 ILE HD1% H 1 0.775 0.020 A 34 ILE HG1x H 1 1.161 0.020 A 34 ILE HG1y H 1 1.161 0.020 A 34 ILE HG2% H 1 0.668 0.020 A 34 ILE C C 13 174.612 0.400 A 34 ILE CA C 13 60.266 0.400 A 34 ILE CB C 13 40.982 0.400 A 34 ILE CD1 C 13 12.845 0.400 A 34 ILE CG1 C 13 27.456 0.400 A 34 ILE CG2 C 13 18.609 0.400 A 34 ILE N N 15 124.425 0.400 A 35 HIS H H 1 8.704 0.020 A 35 HIS HA H 1 5.578 0.020 A 35 HIS HB2 H 1 2.990 0.020 A 35 HIS HB3 H 1 2.888 0.020 A 35 HIS HD2 H 1 6.739 0.020 A 35 HIS HE1 H 1 7.991 0.020 A 35 HIS C C 13 174.840 0.400 A 35 HIS CA C 13 54.937 0.400 A 35 HIS CB C 13 32.138 0.400 A 35 HIS CD2 C 13 117.526 0.400 A 35 HIS CE1 C 13 138.397 0.400 A 35 HIS N N 15 125.440 0.400 A 36 PHE H H 1 9.087 0.020 A 36 PHE HA H 1 4.954 0.020 A 36 PHE HB2 H 1 2.951 0.020 A 36 PHE HB3 H 1 2.511 0.020 A 36 PHE HD1 H 1 7.226 0.020 A 36 PHE HD2 H 1 7.226 0.020 A 36 PHE HE1 H 1 7.292 0.020 A 36 PHE HE2 H 1 7.226 0.020 A 36 PHE CA C 13 57.003 0.400 A 36 PHE CB C 13 44.442 0.400 A 36 PHE CD1 C 13 132.080 0.400 A 36 PHE CD2 C 13 132.080 0.400 A 36 PHE CE1 C 13 131.783 0.400 A 36 PHE CE2 C 13 131.840 0.400 A 36 PHE N N 15 119.967 0.400 A 37 ALY H H 1 7.966 0.020 A 37 ALY HBx H 1 1.478 0.020 A 37 ALY HBy H 1 1.478 0.020 A 37 ALY HCA H 1 3.120 0.020 A 37 ALY HDx H 1 1.300 0.020 A 37 ALY HDy H 1 1.300 0.020 A 37 ALY HEx H 1 2.823 0.020 A 37 ALY HEy H 1 2.823 0.020 A 37 ALY HGx H 1 1.263 0.020 A 37 ALY HGy H 1 1.263 0.020 A 37 ALY HH3% H 1 1.673 0.020 A 37 ALY HZ H 1 7.596 0.020 A 38 VAL H H 1 9.130 0.020 A 38 VAL HA H 1 4.943 0.020 A 38 VAL HB H 1 2.135 0.020 A 38 VAL HGx% H 1 0.881 0.020 A 38 VAL HGy% H 1 0.698 0.020 A 38 VAL C C 13 174.381 0.400 A 38 VAL CA C 13 58.729 0.400 A 38 VAL CB C 13 35.429 0.400 A 38 VAL CG1 C 13 21.765 0.400 A 38 VAL CG2 C 13 19.622 0.400 A 38 VAL N N 15 119.816 0.400 A 39 LYS H H 1 8.559 0.020 A 39 LYS HA H 1 3.842 0.020 A 39 LYS HBx H 1 1.812 0.020 A 39 LYS HBy H 1 1.812 0.020 A 39 LYS HDx H 1 1.722 0.020 A 39 LYS HDy H 1 1.722 0.020 A 39 LYS HEx H 1 3.149 0.020 A 39 LYS HEy H 1 3.149 0.020 A 39 LYS HGx H 1 1.595 0.020 A 39 LYS HGy H 1 1.595 0.020 A 39 LYS C C 13 179.432 0.400 A 39 LYS CA C 13 56.814 0.400 A 39 LYS CB C 13 30.576 0.400 A 39 LYS CD C 13 28.288 0.400 A 39 LYS CE C 13 43.763 0.400 A 39 LYS CG C 13 27.138 0.400 A 39 LYS N N 15 122.440 0.400 A 40 MET H H 1 8.568 0.020 A 40 MET HA H 1 4.108 0.020 A 40 MET HB2 H 1 1.980 0.020 A 40 MET HB3 H 1 2.079 0.020 A 40 MET HE% H 1 1.899 0.020 A 40 MET HGx H 1 2.494 0.020 A 40 MET HGy H 1 2.494 0.020 A 40 MET C C 13 176.532 0.400 A 40 MET CA C 13 57.320 0.400 A 40 MET CB C 13 30.903 0.400 A 40 MET CE C 13 15.832 0.400 A 40 MET CG C 13 32.222 0.400 A 41 THR H H 1 6.973 0.020 A 41 THR HA H 1 4.354 0.020 A 41 THR HB H 1 4.586 0.020 A 41 THR HG2% H 1 1.115 0.020 A 41 THR C C 13 174.514 0.400 A 41 THR CA C 13 60.147 0.400 A 41 THR CB C 13 68.790 0.400 A 41 THR CG2 C 13 21.603 0.400 A 41 THR N N 15 100.257 0.400 A 42 THR H H 1 7.201 0.020 A 42 THR HA H 1 4.203 0.020 A 42 THR HB H 1 3.973 0.020 A 42 THR HG2% H 1 1.372 0.020 A 42 THR C C 13 174.052 0.400 A 42 THR CA C 13 63.062 0.400 A 42 THR CB C 13 69.585 0.400 A 42 THR CG2 C 13 22.470 0.400 A 42 THR N N 15 120.602 0.400 A 43 HIS H H 1 8.806 0.020 A 43 HIS HA H 1 4.416 0.020 A 43 HIS HB2 H 1 3.181 0.020 A 43 HIS HB3 H 1 3.069 0.020 A 43 HIS HD2 H 1 6.912 0.020 A 43 HIS HE1 H 1 8.048 0.020 A 43 HIS C C 13 178.434 0.400 A 43 HIS CA C 13 57.366 0.400 A 43 HIS CB C 13 30.155 0.400 A 43 HIS CD2 C 13 118.138 0.400 A 43 HIS CE1 C 13 137.619 0.400 A 43 HIS N N 15 126.195 0.400 A 44 LEU H H 1 9.364 0.020 A 44 LEU HA H 1 3.988 0.020 A 44 LEU HBx H 1 1.713 0.020 A 44 LEU HBy H 1 1.713 0.020 A 44 LEU HDx% H 1 0.696 0.020 A 44 LEU HDy% H 1 0.696 0.020 A 44 LEU HG H 1 1.656 0.020 A 44 LEU C C 13 177.051 0.400 A 44 LEU CA C 13 58.790 0.400 A 44 LEU CB C 13 41.240 0.400 A 44 LEU CD1 C 13 23.965 0.400 A 44 LEU CD2 C 13 23.965 0.400 A 44 LEU CG C 13 26.151 0.400 A 44 LEU N N 15 124.807 0.400 A 45 LYS H H 1 8.558 0.020 A 45 LYS HA H 1 3.574 0.020 A 45 LYS HB2 H 1 1.978 0.020 A 45 LYS HB3 H 1 1.511 0.020 A 45 LYS HDx H 1 1.534 0.020 A 45 LYS HDy H 1 1.534 0.020 A 45 LYS HEx H 1 2.889 0.020 A 45 LYS HEy H 1 2.889 0.020 A 45 LYS HG2 H 1 1.166 0.020 A 45 LYS HG3 H 1 1.283 0.020 A 45 LYS C C 13 176.881 0.400 A 45 LYS CA C 13 60.607 0.400 A 45 LYS CB C 13 33.389 0.400 A 45 LYS CD C 13 29.804 0.400 A 45 LYS CE C 13 42.162 0.400 A 45 LYS CG C 13 24.730 0.400 A 45 LYS N N 15 121.445 0.400 A 46 LYS H H 1 7.517 0.020 A 46 LYS HA H 1 4.092 0.020 A 46 LYS HBx H 1 1.824 0.020 A 46 LYS HBy H 1 1.824 0.020 A 46 LYS HDx H 1 1.686 0.020 A 46 LYS HDy H 1 1.686 0.020 A 46 LYS HEx H 1 2.975 0.020 A 46 LYS HEy H 1 2.975 0.020 A 46 LYS HGx H 1 1.408 0.020 A 46 LYS HGy H 1 1.408 0.020 A 46 LYS C C 13 178.975 0.400 A 46 LYS CA C 13 58.615 0.400 A 46 LYS CB C 13 31.643 0.400 A 46 LYS CD C 13 29.118 0.400 A 46 LYS CE C 13 42.048 0.400 A 46 LYS CG C 13 24.498 0.400 A 46 LYS N N 15 113.996 0.400 A 47 LEU H H 1 6.740 0.020 A 47 LEU HA H 1 3.689 0.020 A 47 LEU HBy H 1 1.465 0.020 A 47 LEU HBx H 1 1.322 0.020 A 47 LEU HDx% H 1 0.635 0.020 A 47 LEU HDy% H 1 0.206 0.020 A 47 LEU HG H 1 0.309 0.020 A 47 LEU C C 13 177.611 0.400 A 47 LEU CA C 13 58.300 0.400 A 47 LEU CB C 13 41.890 0.400 A 47 LEU CD1 C 13 27.028 0.400 A 47 LEU CD2 C 13 24.196 0.400 A 47 LEU CG C 13 26.722 0.400 A 47 LEU N N 15 121.869 0.400 A 48 LYS H H 1 7.561 0.020 A 48 LYS HA H 1 3.088 0.020 A 48 LYS HBx H 1 1.691 0.020 A 48 LYS HBy H 1 1.691 0.020 A 48 LYS HDx H 1 1.382 0.020 A 48 LYS HDy H 1 1.382 0.020 A 48 LYS HEx H 1 2.425 0.020 A 48 LYS HEy H 1 2.425 0.020 A 48 LYS HGx H 1 1.342 0.020 A 48 LYS HGy H 1 1.342 0.020 A 48 LYS C C 13 178.700 0.400 A 48 LYS CA C 13 59.685 0.400 A 48 LYS CB C 13 32.411 0.400 A 48 LYS CD C 13 30.415 0.400 A 48 LYS CE C 13 42.369 0.400 A 48 LYS CG C 13 23.057 0.400 A 48 LYS N N 15 118.231 0.400 A 49 GLU H H 1 8.499 0.020 A 49 GLU HA H 1 3.978 0.020 A 49 GLU HBx H 1 1.956 0.020 A 49 GLU HBy H 1 1.956 0.020 A 49 GLU HG2 H 1 2.450 0.020 A 49 GLU HG3 H 1 2.227 0.020 A 49 GLU C C 13 179.453 0.400 A 49 GLU CA C 13 59.627 0.400 A 49 GLU CB C 13 30.120 0.400 A 49 GLU CG C 13 36.782 0.400 A 49 GLU N N 15 118.080 0.400 A 50 SER H H 1 7.978 0.020 A 50 SER HA H 1 4.265 0.020 A 50 SER HBx H 1 4.014 0.020 A 50 SER HBy H 1 4.014 0.020 A 50 SER C C 13 177.159 0.400 A 50 SER CA C 13 61.947 0.400 A 50 SER CB C 13 63.258 0.400 A 50 SER N N 15 115.697 0.400 A 51 TYR H H 1 8.837 0.020 A 51 TYR HA H 1 4.031 0.020 A 51 TYR HB2 H 1 3.361 0.020 A 51 TYR HB3 H 1 2.947 0.020 A 51 TYR HD1 H 1 7.072 0.020 A 51 TYR HD2 H 1 7.072 0.020 A 51 TYR HE1 H 1 6.660 0.020 A 51 TYR HE2 H 1 6.771 0.020 A 51 TYR C C 13 177.370 0.400 A 51 TYR CA C 13 63.608 0.400 A 51 TYR CB C 13 38.600 0.400 A 51 TYR CD1 C 13 133.206 0.400 A 51 TYR CD2 C 13 132.344 0.400 A 51 TYR CE1 C 13 118.274 0.400 A 51 TYR CE2 C 13 118.245 0.400 A 51 TYR N N 15 122.684 0.400 A 52 CYS H H 1 8.684 0.020 A 52 CYS HA H 1 3.919 0.020 A 52 CYS HB2 H 1 3.430 0.020 A 52 CYS HB3 H 1 3.052 0.020 A 52 CYS C C 13 177.182 0.400 A 52 CYS CA C 13 65.062 0.400 A 52 CYS CB C 13 26.151 0.400 A 52 CYS N N 15 117.431 0.400 A 53 GLN H H 1 8.321 0.020 A 53 GLN HA H 1 4.114 0.020 A 53 GLN HBx H 1 2.223 0.020 A 53 GLN HBy H 1 2.223 0.020 A 53 GLN HE2y H 1 7.477 0.020 A 53 GLN HE2x H 1 6.876 0.020 A 53 GLN HG2 H 1 2.536 0.020 A 53 GLN HG3 H 1 2.393 0.020 A 53 GLN C C 13 179.090 0.400 A 53 GLN CA C 13 58.973 0.400 A 53 GLN CB C 13 28.211 0.400 A 53 GLN CG C 13 33.954 0.400 A 53 GLN N N 15 119.196 0.400 A 53 GLN NE2 N 15 111.600 0.400 A 54 ARG H H 1 8.009 0.020 A 54 ARG HA H 1 4.023 0.020 A 54 ARG HBx H 1 1.964 0.020 A 54 ARG HBy H 1 1.964 0.020 A 54 ARG HDx H 1 3.125 0.020 A 54 ARG HDy H 1 3.125 0.020 A 54 ARG HGx H 1 1.720 0.020 A 54 ARG HGy H 1 1.720 0.020 A 54 ARG C C 13 178.295 0.400 A 54 ARG CA C 13 58.552 0.400 A 54 ARG CB C 13 29.669 0.400 A 54 ARG CD C 13 42.350 0.400 A 54 ARG CG C 13 27.152 0.400 A 54 ARG N N 15 120.139 0.400 A 55 GLN H H 1 7.816 0.020 A 55 GLN HA H 1 4.256 0.020 A 55 GLN HBx H 1 1.626 0.020 A 55 GLN HBy H 1 1.626 0.020 A 55 GLN HE21 H 1 7.565 0.020 A 55 GLN HE22 H 1 6.865 0.020 A 55 GLN HGx H 1 2.116 0.020 A 55 GLN HGy H 1 2.116 0.020 A 55 GLN C C 13 176.410 0.400 A 55 GLN CA C 13 55.119 0.400 A 55 GLN CB C 13 29.424 0.400 A 55 GLN CG C 13 32.859 0.400 A 55 GLN N N 15 114.154 0.400 A 55 GLN NE2 N 15 112.748 0.400 A 56 GLY H H 1 7.936 0.020 A 56 GLY HAx H 1 3.915 0.020 A 56 GLY HAy H 1 3.915 0.020 A 56 GLY C C 13 174.907 0.400 A 56 GLY CA C 13 46.658 0.400 A 56 GLY N N 15 109.753 0.400 A 57 VAL H H 1 7.652 0.020 A 57 VAL HA H 1 4.943 0.020 A 57 VAL HB H 1 2.195 0.020 A 57 VAL HGx% H 1 0.854 0.020 A 57 VAL HGy% H 1 0.764 0.020 A 57 VAL CA C 13 57.539 0.400 A 57 VAL CB C 13 32.697 0.400 A 57 VAL CG1 C 13 21.251 0.400 A 57 VAL CG2 C 13 18.731 0.400 A 57 VAL N N 15 112.004 0.400 A 58 PRO HA H 1 4.533 0.020 A 58 PRO HBx H 1 2.396 0.020 A 58 PRO HBy H 1 2.396 0.020 A 58 PRO HDx H 1 3.613 0.020 A 58 PRO HDy H 1 3.613 0.020 A 58 PRO HGx H 1 2.092 0.020 A 58 PRO HGy H 1 2.092 0.020 A 58 PRO C C 13 179.174 0.400 A 58 PRO CA C 13 62.184 0.400 A 58 PRO CB C 13 32.543 0.400 A 58 PRO CD C 13 50.819 0.400 A 58 PRO CG C 13 27.906 0.400 A 59 MET H H 1 9.004 0.020 A 59 MET HA H 1 4.708 0.020 A 59 MET HBx H 1 2.107 0.020 A 59 MET HBy H 1 2.107 0.020 A 59 MET HE% H 1 2.088 0.020 A 59 MET HGx H 1 2.703 0.020 A 59 MET HGy H 1 2.703 0.020 A 59 MET C C 13 177.459 0.400 A 59 MET CA C 13 58.247 0.400 A 59 MET CB C 13 32.795 0.400 A 59 MET CE C 13 17.597 0.400 A 59 MET CG C 13 32.731 0.400 A 59 MET N N 15 124.522 0.400 A 60 ASN H H 1 8.429 0.020 A 60 ASN HA H 1 4.678 0.020 A 60 ASN HB2 H 1 3.046 0.020 A 60 ASN HB3 H 1 2.864 0.020 A 60 ASN HD21 H 1 7.588 0.020 A 60 ASN HD22 H 1 6.833 0.020 A 60 ASN C C 13 175.674 0.400 A 60 ASN CA C 13 53.935 0.400 A 60 ASN CB C 13 37.190 0.400 A 60 ASN N N 15 113.176 0.400 A 60 ASN ND2 N 15 111.588 0.400 A 61 SER H H 1 7.936 0.020 A 61 SER HA H 1 4.503 0.020 A 61 SER HB2 H 1 4.130 0.020 A 61 SER HB3 H 1 3.829 0.020 A 61 SER C C 13 173.456 0.400 A 61 SER CA C 13 59.500 0.400 A 61 SER CB C 13 64.725 0.400 A 61 SER N N 15 113.083 0.400 A 62 LEU H H 1 7.268 0.020 A 62 LEU HA H 1 5.110 0.020 A 62 LEU HB2 H 1 1.533 0.020 A 62 LEU HB3 H 1 0.774 0.020 A 62 LEU HDx% H 1 0.693 0.020 A 62 LEU HDy% H 1 0.693 0.020 A 62 LEU HG H 1 0.905 0.020 A 62 LEU C C 13 175.603 0.400 A 62 LEU CA C 13 53.580 0.400 A 62 LEU CB C 13 46.300 0.400 A 62 LEU CD1 C 13 22.830 0.400 A 62 LEU CD2 C 13 22.830 0.400 A 62 LEU CG C 13 27.023 0.400 A 62 LEU N N 15 120.956 0.400 A 63 ARG H H 1 8.998 0.020 A 63 ARG HA H 1 4.673 0.020 A 63 ARG HBx H 1 1.608 0.020 A 63 ARG HBy H 1 1.608 0.020 A 63 ARG HDx H 1 2.976 0.020 A 63 ARG HDy H 1 2.976 0.020 A 63 ARG HE H 1 7.177 0.020 A 63 ARG HGx H 1 1.463 0.020 A 63 ARG HGy H 1 1.463 0.020 A 63 ARG C C 13 172.829 0.400 A 63 ARG CA C 13 54.488 0.400 A 63 ARG CB C 13 33.111 0.400 A 63 ARG CD C 13 43.738 0.400 A 63 ARG CG C 13 27.035 0.400 A 63 ARG N N 15 120.125 0.400 A 63 ARG NE N 15 83.674 0.400 A 64 PHE H H 1 8.924 0.020 A 64 PHE HA H 1 4.964 0.020 A 64 PHE HB2 H 1 2.914 0.020 A 64 PHE HB3 H 1 2.441 0.020 A 64 PHE HD1 H 1 7.289 0.020 A 64 PHE HD2 H 1 7.289 0.020 A 64 PHE HE1 H 1 7.312 0.020 A 64 PHE HE2 H 1 7.332 0.020 A 64 PHE C C 13 174.163 0.400 A 64 PHE CA C 13 56.347 0.400 A 64 PHE CB C 13 40.762 0.400 A 64 PHE CD1 C 13 130.997 0.400 A 64 PHE CD2 C 13 130.997 0.400 A 64 PHE CE1 C 13 130.666 0.400 A 64 PHE CE2 C 13 130.666 0.400 A 64 PHE N N 15 122.498 0.400 A 65 LEU H H 1 9.747 0.020 A 65 LEU HA H 1 5.298 0.020 A 65 LEU HB2 H 1 1.860 0.020 A 65 LEU HB3 H 1 1.285 0.020 A 65 LEU HDx% H 1 0.704 0.020 A 65 LEU HDy% H 1 0.604 0.020 A 65 LEU HG H 1 1.461 0.020 A 65 LEU C C 13 175.900 0.400 A 65 LEU CA C 13 53.716 0.400 A 65 LEU CB C 13 46.414 0.400 A 65 LEU CD1 C 13 25.440 0.400 A 65 LEU CD2 C 13 24.021 0.400 A 65 LEU CG C 13 28.170 0.400 A 65 LEU N N 15 124.221 0.400 A 66 PHE H H 1 8.970 0.020 A 66 PHE HA H 1 5.208 0.020 A 66 PHE HB2 H 1 2.941 0.020 A 66 PHE HB3 H 1 2.721 0.020 A 66 PHE HD1 H 1 7.379 0.020 A 66 PHE HD2 H 1 7.379 0.020 A 66 PHE HE1 H 1 7.333 0.020 A 66 PHE HE2 H 1 7.333 0.020 A 66 PHE C C 13 175.030 0.400 A 66 PHE CA C 13 56.267 0.400 A 66 PHE CB C 13 41.700 0.400 A 66 PHE CD1 C 13 132.014 0.400 A 66 PHE CD2 C 13 132.014 0.400 A 66 PHE CE1 C 13 131.954 0.400 A 66 PHE CE2 C 13 131.954 0.400 A 66 PHE N N 15 119.383 0.400 A 67 GLU H H 1 9.386 0.020 A 67 GLU HA H 1 3.549 0.020 A 67 GLU HB2 H 1 1.803 0.020 A 67 GLU HB3 H 1 1.318 0.020 A 67 GLU HG2 H 1 1.152 0.020 A 67 GLU HG3 H 1 1.345 0.020 A 67 GLU C C 13 176.805 0.400 A 67 GLU CA C 13 56.768 0.400 A 67 GLU CB C 13 26.907 0.400 A 67 GLU CG C 13 35.297 0.400 A 67 GLU N N 15 129.210 0.400 A 68 GLY H H 1 8.867 0.020 A 68 GLY HA2 H 1 4.097 0.020 A 68 GLY HA3 H 1 3.451 0.020 A 68 GLY C C 13 173.651 0.400 A 68 GLY CA C 13 45.476 0.400 A 68 GLY N N 15 103.270 0.400 A 69 GLN H H 1 7.995 0.020 A 69 GLN HA H 1 4.594 0.020 A 69 GLN HB2 H 1 2.135 0.020 A 69 GLN HB3 H 1 2.179 0.020 A 69 GLN HE21 H 1 7.548 0.020 A 69 GLN HE22 H 1 6.998 0.020 A 69 GLN HGx H 1 2.339 0.020 A 69 GLN HGy H 1 2.339 0.020 A 69 GLN C C 13 175.208 0.400 A 69 GLN CA C 13 53.776 0.400 A 69 GLN CB C 13 30.660 0.400 A 69 GLN CG C 13 33.573 0.400 A 69 GLN N N 15 120.732 0.400 A 69 GLN NE2 N 15 112.325 0.400 A 70 ARG H H 1 8.823 0.020 A 70 ARG HA H 1 4.388 0.020 A 70 ARG HBx H 1 1.771 0.020 A 70 ARG HBy H 1 1.771 0.020 A 70 ARG HDx H 1 3.188 0.020 A 70 ARG HDy H 1 3.188 0.020 A 70 ARG HGx H 1 1.442 0.020 A 70 ARG HGy H 1 1.442 0.020 A 70 ARG C C 13 177.004 0.400 A 70 ARG CA C 13 57.243 0.400 A 70 ARG CB C 13 30.511 0.400 A 70 ARG CD C 13 43.410 0.400 A 70 ARG CG C 13 28.333 0.400 A 70 ARG N N 15 125.023 0.400 A 71 ILE H H 1 9.027 0.020 A 71 ILE HA H 1 4.485 0.020 A 71 ILE HB H 1 1.578 0.020 A 71 ILE HD1% H 1 0.720 0.020 A 71 ILE HG1x H 1 1.884 0.020 A 71 ILE HG1y H 1 1.884 0.020 A 71 ILE HG2% H 1 0.826 0.020 A 71 ILE C C 13 176.158 0.400 A 71 ILE CA C 13 61.302 0.400 A 71 ILE CB C 13 39.102 0.400 A 71 ILE CD1 C 13 15.490 0.400 A 71 ILE CG1 C 13 27.620 0.400 A 71 ILE CG2 C 13 19.047 0.400 A 71 ILE N N 15 126.941 0.400 A 72 ALA H H 1 10.910 0.020 A 72 ALA HA H 1 4.335 0.020 A 72 ALA HB% H 1 0.844 0.020 A 72 ALA C C 13 177.984 0.400 A 72 ALA CA C 13 50.789 0.400 A 72 ALA CB C 13 18.407 0.400 A 72 ALA N N 15 139.285 0.400 A 73 ASP H H 1 8.770 0.020 A 73 ASP HA H 1 3.824 0.020 A 73 ASP HBx H 1 2.545 0.020 A 73 ASP HBy H 1 2.545 0.020 A 73 ASP C C 13 176.111 0.400 A 73 ASP CA C 13 57.187 0.400 A 73 ASP CB C 13 40.032 0.400 A 73 ASP N N 15 120.483 0.400 A 74 ASN H H 1 7.744 0.020 A 74 ASN HA H 1 4.250 0.020 A 74 ASN HB2 H 1 2.644 0.020 A 74 ASN HB3 H 1 2.499 0.020 A 74 ASN HD21 H 1 7.588 0.020 A 74 ASN HD22 H 1 6.687 0.020 A 74 ASN C C 13 176.045 0.400 A 74 ASN CA C 13 52.073 0.400 A 74 ASN CB C 13 37.318 0.400 A 74 ASN N N 15 109.520 0.400 A 74 ASN ND2 N 15 112.030 0.400 A 75 HIS H H 1 7.155 0.020 A 75 HIS HA H 1 4.913 0.020 A 75 HIS HB2 H 1 3.326 0.020 A 75 HIS HB3 H 1 2.791 0.020 A 75 HIS HD2 H 1 7.137 0.020 A 75 HIS HE1 H 1 7.804 0.020 A 75 HIS C C 13 175.688 0.400 A 75 HIS CA C 13 56.606 0.400 A 75 HIS CB C 13 33.606 0.400 A 75 HIS CD2 C 13 116.330 0.400 A 75 HIS CE1 C 13 138.721 0.400 A 75 HIS N N 15 119.834 0.400 A 76 THR H H 1 7.311 0.020 A 76 THR HA H 1 5.181 0.020 A 76 THR HB H 1 4.483 0.020 A 76 THR HG2% H 1 1.013 0.020 A 76 THR CA C 13 57.602 0.400 A 76 THR CB C 13 69.969 0.400 A 76 THR CG2 C 13 21.490 0.400 A 76 THR N N 15 108.312 0.400 A 77 PRO HA H 1 4.243 0.020 A 77 PRO HBx H 1 2.105 0.020 A 77 PRO HBy H 1 2.105 0.020 A 77 PRO HDx H 1 3.851 0.020 A 77 PRO HDy H 1 3.851 0.020 A 77 PRO HGx H 1 2.171 0.020 A 77 PRO HGy H 1 2.171 0.020 A 77 PRO C C 13 178.439 0.400 A 77 PRO CA C 13 65.707 0.400 A 77 PRO CB C 13 32.479 0.400 A 77 PRO CD C 13 50.873 0.400 A 77 PRO CG C 13 28.213 0.400 A 78 LYS H H 1 8.069 0.020 A 78 LYS HA H 1 3.961 0.020 A 78 LYS HB2 H 1 1.729 0.020 A 78 LYS HB3 H 1 1.608 0.020 A 78 LYS HDx H 1 1.576 0.020 A 78 LYS HDy H 1 1.576 0.020 A 78 LYS HEx H 1 2.887 0.020 A 78 LYS HEy H 1 2.887 0.020 A 78 LYS HGx H 1 1.337 0.020 A 78 LYS HGy H 1 1.337 0.020 A 78 LYS C C 13 179.328 0.400 A 78 LYS CA C 13 59.012 0.400 A 78 LYS CB C 13 32.845 0.400 A 78 LYS CD C 13 29.290 0.400 A 78 LYS CE C 13 42.055 0.400 A 78 LYS CG C 13 24.293 0.400 A 78 LYS N N 15 115.412 0.400 A 79 GLU H H 1 7.977 0.020 A 79 GLU HA H 1 3.962 0.020 A 79 GLU HB2 H 1 2.209 0.020 A 79 GLU HB3 H 1 2.030 0.020 A 79 GLU HGx H 1 2.268 0.020 A 79 GLU HGy H 1 2.268 0.020 A 79 GLU C C 13 178.598 0.400 A 79 GLU CA C 13 58.790 0.400 A 79 GLU CB C 13 30.290 0.400 A 79 GLU CG C 13 36.108 0.400 A 79 GLU N N 15 120.840 0.400 A 80 LEU H H 1 7.497 0.020 A 80 LEU HA H 1 4.227 0.020 A 80 LEU HBx H 1 1.483 0.020 A 80 LEU HBy H 1 1.483 0.020 A 80 LEU HDx% H 1 0.569 0.020 A 80 LEU HDy% H 1 0.292 0.020 A 80 LEU HG H 1 1.403 0.020 A 80 LEU C C 13 176.617 0.400 A 80 LEU CA C 13 54.613 0.400 A 80 LEU CB C 13 42.453 0.400 A 80 LEU CD1 C 13 25.841 0.400 A 80 LEU CD2 C 13 20.818 0.400 A 80 LEU CG C 13 27.096 0.400 A 80 LEU N N 15 115.108 0.400 A 81 GLY H H 1 7.648 0.020 A 81 GLY HAx H 1 3.898 0.020 A 81 GLY HAy H 1 3.898 0.020 A 81 GLY C C 13 175.433 0.400 A 81 GLY CA C 13 46.542 0.400 A 81 GLY N N 15 108.015 0.400 A 82 MET H H 1 7.626 0.020 A 82 MET HA H 1 4.190 0.020 A 82 MET HBx H 1 1.709 0.020 A 82 MET HBy H 1 1.709 0.020 A 82 MET HE% H 1 1.899 0.020 A 82 MET HGx H 1 1.930 0.020 A 82 MET HGy H 1 1.930 0.020 A 82 MET C C 13 174.458 0.400 A 82 MET CA C 13 57.019 0.400 A 82 MET CB C 13 34.089 0.400 A 82 MET CE C 13 15.832 0.400 A 82 MET CG C 13 33.436 0.400 A 82 MET N N 15 117.670 0.400 A 83 GLU H H 1 9.316 0.020 A 83 GLU HA H 1 4.440 0.020 A 83 GLU HBy H 1 2.062 0.020 A 83 GLU HBx H 1 1.781 0.020 A 83 GLU HGx H 1 2.208 0.020 A 83 GLU HGy H 1 2.208 0.020 A 83 GLU C C 13 174.297 0.400 A 83 GLU CA C 13 53.888 0.400 A 83 GLU CB C 13 33.937 0.400 A 83 GLU CG C 13 36.073 0.400 A 83 GLU N N 15 121.112 0.400 A 84 GLU H H 1 8.340 0.020 A 84 GLU HA H 1 4.204 0.020 A 84 GLU HB2 H 1 2.090 0.020 A 84 GLU HB3 H 1 1.922 0.020 A 84 GLU HGx H 1 2.244 0.020 A 84 GLU HGy H 1 2.244 0.020 A 84 GLU C C 13 177.567 0.400 A 84 GLU CA C 13 58.549 0.400 A 84 GLU CB C 13 29.993 0.400 A 84 GLU CG C 13 36.288 0.400 A 84 GLU N N 15 119.063 0.400 A 85 GLU H H 1 9.363 0.020 A 85 GLU HA H 1 3.677 0.020 A 85 GLU HBx H 1 2.355 0.020 A 85 GLU HBy H 1 2.355 0.020 A 85 GLU HGx H 1 2.394 0.020 A 85 GLU HGy H 1 2.394 0.020 A 85 GLU C C 13 175.047 0.400 A 85 GLU CA C 13 58.884 0.400 A 85 GLU CB C 13 26.691 0.400 A 85 GLU CG C 13 37.181 0.400 A 85 GLU N N 15 118.835 0.400 A 86 ASP H H 1 8.152 0.020 A 86 ASP HA H 1 4.896 0.020 A 86 ASP HBy H 1 2.960 0.020 A 86 ASP HBx H 1 2.744 0.020 A 86 ASP C C 13 174.417 0.400 A 86 ASP CA C 13 55.682 0.400 A 86 ASP CB C 13 41.926 0.400 A 86 ASP N N 15 120.236 0.400 A 87 VAL H H 1 8.212 0.020 A 87 VAL HA H 1 4.920 0.020 A 87 VAL HB H 1 2.003 0.020 A 87 VAL HGx% H 1 1.051 0.020 A 87 VAL HGy% H 1 1.051 0.020 A 87 VAL C C 13 176.092 0.400 A 87 VAL CA C 13 61.236 0.400 A 87 VAL CB C 13 35.067 0.400 A 87 VAL CG1 C 13 22.131 0.400 A 87 VAL CG2 C 13 22.131 0.400 A 87 VAL N N 15 116.627 0.400 A 88 ILE H H 1 9.160 0.020 A 88 ILE HA H 1 4.850 0.020 A 88 ILE HB H 1 1.742 0.020 A 88 ILE HD1% H 1 0.651 0.020 A 88 ILE HG1x H 1 0.874 0.020 A 88 ILE HG1y H 1 0.874 0.020 A 88 ILE HG2% H 1 0.910 0.020 A 88 ILE C C 13 174.976 0.400 A 88 ILE CA C 13 59.381 0.400 A 88 ILE CB C 13 40.984 0.400 A 88 ILE CD1 C 13 14.876 0.400 A 88 ILE CG1 C 13 27.793 0.400 A 88 ILE CG2 C 13 18.033 0.400 A 88 ILE N N 15 127.352 0.400 A 89 GLU H H 1 8.866 0.020 A 89 GLU HA H 1 4.856 0.020 A 89 GLU HBx H 1 1.970 0.020 A 89 GLU HBy H 1 1.970 0.020 A 89 GLU HG2 H 1 2.299 0.020 A 89 GLU HG3 H 1 2.104 0.020 A 89 GLU C C 13 175.270 0.400 A 89 GLU CA C 13 55.158 0.400 A 89 GLU CB C 13 33.359 0.400 A 89 GLU CG C 13 36.636 0.400 A 89 GLU N N 15 125.844 0.400 A 90 VAL H H 1 7.778 0.020 A 90 VAL HA H 1 4.822 0.020 A 90 VAL HB H 1 1.264 0.020 A 90 VAL HGx% H 1 0.189 0.020 A 90 VAL HGy% H 1 0.005 0.020 A 90 VAL C C 13 174.870 0.400 A 90 VAL CA C 13 59.412 0.400 A 90 VAL CB C 13 33.971 0.400 A 90 VAL CG1 C 13 21.870 0.400 A 90 VAL CG2 C 13 22.247 0.400 A 90 VAL N N 15 119.742 0.400 A 91 TYR H H 1 8.543 0.020 A 91 TYR HA H 1 4.626 0.020 A 91 TYR HB2 H 1 3.024 0.020 A 91 TYR HB3 H 1 2.332 0.020 A 91 TYR HD1 H 1 6.900 0.020 A 91 TYR HD2 H 1 6.900 0.020 A 91 TYR HE1 H 1 6.679 0.020 A 91 TYR HE2 H 1 6.679 0.020 A 91 TYR C C 13 174.593 0.400 A 91 TYR CA C 13 56.018 0.400 A 91 TYR CB C 13 42.641 0.400 A 91 TYR CD1 C 13 132.894 0.400 A 91 TYR CD2 C 13 132.894 0.400 A 91 TYR CE1 C 13 118.494 0.400 A 91 TYR CE2 C 13 118.494 0.400 A 91 TYR N N 15 124.212 0.400 A 92 GLN H H 1 8.723 0.020 A 92 GLN HA H 1 4.534 0.020 A 92 GLN HB2 H 1 1.991 0.020 A 92 GLN HB3 H 1 2.131 0.020 A 92 GLN HE21 H 1 7.563 0.020 A 92 GLN HE22 H 1 6.854 0.020 A 92 GLN HGx H 1 2.433 0.020 A 92 GLN HGy H 1 2.433 0.020 A 92 GLN C C 13 176.679 0.400 A 92 GLN CA C 13 56.135 0.400 A 92 GLN CB C 13 29.342 0.400 A 92 GLN CG C 13 34.102 0.400 A 92 GLN N N 15 120.772 0.400 A 92 GLN NE2 N 15 113.162 0.400 A 93 GLU H H 1 8.425 0.020 A 93 GLU HA H 1 4.369 0.020 A 93 GLU HB2 H 1 1.888 0.020 A 93 GLU HB3 H 1 1.661 0.020 A 93 GLU HGx H 1 2.050 0.020 A 93 GLU HGy H 1 2.050 0.020 A 93 GLU C C 13 176.243 0.400 A 93 GLU CA C 13 56.111 0.400 A 93 GLU CB C 13 30.517 0.400 A 93 GLU CG C 13 35.388 0.400 A 93 GLU N N 15 125.144 0.400 A 94 GLN H H 1 8.785 0.020 A 94 GLN HA H 1 4.445 0.020 A 94 GLN HBy H 1 2.113 0.020 A 94 GLN HBx H 1 2.004 0.020 A 94 GLN HE2y H 1 6.816 0.020 A 94 GLN HE2x H 1 6.467 0.020 A 94 GLN HGx H 1 2.315 0.020 A 94 GLN HGy H 1 2.315 0.020 A 94 GLN C C 13 176.135 0.400 A 94 GLN CA C 13 55.578 0.400 A 94 GLN CB C 13 29.513 0.400 A 94 GLN CG C 13 33.666 0.400 A 94 GLN N N 15 122.920 0.400 A 94 GLN NE2 N 15 109.979 0.400 A 95 THR H H 1 8.397 0.020 A 95 THR HA H 1 4.299 0.020 A 95 THR HB H 1 4.214 0.020 A 95 THR HG2% H 1 1.172 0.020 A 95 THR C C 13 175.137 0.400 A 95 THR CA C 13 61.971 0.400 A 95 THR CB C 13 69.886 0.400 A 95 THR CG2 C 13 21.545 0.400 A 95 THR N N 15 116.098 0.400 A 96 GLY H H 1 8.511 0.020 A 96 GLY HAx H 1 3.951 0.020 A 96 GLY HAy H 1 3.951 0.020 A 96 GLY C C 13 173.697 0.400 A 96 GLY CA C 13 45.366 0.400 A 96 GLY N N 15 111.852 0.400 A 97 GLY H H 1 8.029 0.020 A 97 GLY HAx H 1 3.724 0.020 A 97 GLY HAy H 1 3.724 0.020 A 97 GLY CA C 13 46.009 0.400 A 97 GLY N N 15 115.357 0.400 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 28 GLY H A 90 VAL HGy% 1.0 1.8 4.50 2 2 A 90 VAL HA A 90 VAL HGx% 1.0 1.8 3.36 3 3 A 90 VAL HGx% A 92 GLN HA 1.0 1.8 4.21 4 4 A 47 LEU HDy% A 64 PHE HD% 1.0 1.8 4.87 5 5 A 47 LEU HDy% A 47 LEU HA 1.0 1.8 4.20 6 6 A 36 PHE HE1 A 47 LEU HG 1.0 1.8 5.59 7 7 A 64 PHE HD% A 47 LEU HG 1.0 1.8 5.98 8 8 A 26 VAL HGy% A 27 ILE HA 1.0 1.8 3.97 9 9 A 71 ILE HA A 80 LEU HDx% 1.0 1.8 5.05 10 10 A 80 LEU HDx% A 80 LEU HA 1.0 1.8 4.13 11 11 A 80 LEU HDx% A 80 LEU HBx 1.0 1.8 3.20 12 11 A 80 LEU HDx% A 80 LEU HBy 1.0 1.8 3.20 13 12 A 65 LEU HDy% A 91 TYR HE% 1.0 1.8 4.79 14 13 A 66 PHE HE% A 88 ILE HD1% 1.0 1.8 4.15 15 14 A 88 ILE HD1% A 88 ILE HA 1.0 1.8 3.82 16 15 A 59 MET H A 62 LEU HDx% 1.0 1.8 4.14 17 15 A 59 MET H A 62 LEU HDy% 1.0 1.8 4.14 18 16 A 62 LEU HA A 62 LEU HDx% 1.0 1.8 3.12 19 16 A 62 LEU HDy% A 62 LEU HA 1.0 1.8 3.12 20 17 A 90 VAL HA A 62 LEU HDx% 1.0 1.8 4.85 21 17 A 90 VAL HA A 62 LEU HDy% 1.0 1.8 4.85 22 18 A 58 PRO HBy A 62 LEU HDx% 1.0 1.8 3.91 23 18 A 58 PRO HBx A 62 LEU HDx% 1.0 1.8 3.91 24 18 A 62 LEU HDy% A 58 PRO HBx 1.0 1.8 3.91 25 18 A 62 LEU HDy% A 58 PRO HBy 1.0 1.8 3.91 26 19 A 65 LEU H A 65 LEU HDx% 1.0 1.8 4.30 27 20 A 65 LEU HDx% A 65 LEU HA 1.0 1.8 4.02 28 21 A 65 LEU HDx% A 91 TYR HB2 1.0 1.8 3.76 29 22 A 65 LEU HDx% A 65 LEU HB2 1.0 1.8 3.15 30 23 A 71 ILE H A 71 ILE HD1% 1.0 1.8 4.35 31 24 A 71 ILE HA A 71 ILE HD1% 1.0 1.8 4.26 32 25 A 34 ILE HD1% A 51 TYR HD% 1.0 1.8 4.12 33 26 A 34 ILE HD1% A 54 ARG HDx 1.0 1.8 3.81 34 26 A 34 ILE HD1% A 54 ARG HDy 1.0 1.8 3.81 35 27 A 36 PHE H A 24 LEU HDx% 1.0 1.8 4.24 36 27 A 24 LEU HDy% A 36 PHE H 1.0 1.8 4.24 37 28 A 23 LYS H A 24 LEU HDx% 1.0 1.8 4.41 38 28 A 24 LEU HDy% A 23 LYS H 1.0 1.8 4.41 39 29 A 25 LYS H A 24 LEU HDx% 1.0 1.8 4.62 40 29 A 24 LEU HDy% A 25 LYS H 1.0 1.8 4.62 41 30 A 24 LEU HB3 A 24 LEU HDx% 1.0 1.8 2.91 42 30 A 24 LEU HDy% A 24 LEU HB3 1.0 1.8 2.91 43 31 A 72 ALA HB% A 73 ASP H 1.0 1.8 3.84 44 32 A 55 GLN HE22 A 57 VAL HGy% 1.0 1.8 5.44 45 33 A 71 ILE HG2% A 75 HIS HA 1.0 1.8 4.33 46 34 A 71 ILE HG2% A 48 LYS HEx 1.0 1.8 3.72 47 34 A 71 ILE HG2% A 48 LYS HEy 1.0 1.8 3.72 48 35 A 71 ILE HG2% A 64 PHE HB3 1.0 1.8 4.28 49 36 A 47 LEU HDy% A 71 ILE HG2% 1.0 1.8 4.28 50 37 A 23 LYS H A 22 ILE HG2% 1.0 1.8 3.83 51 38 A 27 ILE H A 27 ILE HD1% 1.0 1.8 3.85 52 39 A 27 ILE HD1% A 26 VAL HA 1.0 1.8 4.35 53 40 A 27 ILE HD1% A 25 LYS HEx 1.0 1.8 4.04 54 40 A 27 ILE HD1% A 25 LYS HEy 1.0 1.8 4.04 55 41 A 66 PHE HD% A 88 ILE HG1x 1.0 1.8 4.63 56 41 A 66 PHE HD% A 88 ILE HG1y 1.0 1.8 4.63 57 42 A 66 PHE HA A 88 ILE HG1x 1.0 1.8 5.12 58 42 A 88 ILE HG1y A 66 PHE HA 1.0 1.8 5.12 59 43 A 24 LEU HB2 A 26 VAL HGx% 1.0 1.8 4.39 60 44 A 38 VAL HGx% A 46 LYS HGx 1.0 1.8 4.63 61 44 A 38 VAL HGx% A 46 LYS HGy 1.0 1.8 4.63 62 45 A 62 LEU H A 62 LEU HG 1.0 1.8 3.78 63 46 A 62 LEU HG A 29 GLN HE22 1.0 1.8 3.58 64 47 A 88 ILE HA A 88 ILE HG2% 1.0 1.8 3.38 65 48 A 27 ILE HG2% A 31 SER HA 1.0 1.8 3.58 66 49 A 25 LYS HDx A 87 VAL HGx% 1.0 1.8 3.69 67 49 A 25 LYS HDy A 87 VAL HGx% 1.0 1.8 3.69 68 49 A 87 VAL HGy% A 25 LYS HDx 1.0 1.8 3.69 69 49 A 25 LYS HDy A 87 VAL HGy% 1.0 1.8 3.69 70 50 A 25 LYS HEy A 87 VAL HGx% 1.0 1.8 3.48 71 50 A 25 LYS HEx A 87 VAL HGx% 1.0 1.8 3.48 72 50 A 87 VAL HGy% A 25 LYS HEx 1.0 1.8 3.48 73 50 A 25 LYS HEy A 87 VAL HGy% 1.0 1.8 3.48 74 51 A 41 THR HG2% A 78 LYS HA 1.0 1.8 4.62 75 52 A 41 THR HG2% A 77 PRO HGx 1.0 1.8 4.17 76 52 A 41 THR HG2% A 77 PRO HGy 1.0 1.8 4.17 77 53 A 51 TYR HD% A 34 ILE HG1x 1.0 1.8 4.55 78 53 A 51 TYR HD% A 34 ILE HG1y 1.0 1.8 4.55 79 54 A 62 LEU HG A 90 VAL HB 1.0 1.8 4.20 80 55 A 66 PHE HA A 65 LEU HB3 1.0 1.8 4.88 81 56 A 6 ALA HB% A 7 LYS H 1.0 1.8 3.96 82 57 A 79 GLU HA A 78 LYS HGx 1.0 1.8 4.30 83 57 A 78 LYS HGy A 79 GLU HA 1.0 1.8 4.30 84 58 A 7 LYS HDy A 7 LYS HGx 1.0 1.8 2.58 85 58 A 7 LYS HDx A 7 LYS HGx 1.0 1.8 2.58 86 58 A 7 LYS HGy A 7 LYS HDx 1.0 1.8 2.58 87 58 A 7 LYS HGy A 7 LYS HDy 1.0 1.8 2.58 88 59 A 17 LYS HDx A 17 LYS HGx 1.0 1.8 2.77 89 59 A 17 LYS HDy A 17 LYS HGx 1.0 1.8 2.77 90 59 A 17 LYS HGy A 17 LYS HDx 1.0 1.8 2.77 91 59 A 17 LYS HGy A 17 LYS HDy 1.0 1.8 2.77 92 60 A 78 LYS HA A 78 LYS HDx 1.0 1.8 4.53 93 60 A 78 LYS HA A 78 LYS HDy 1.0 1.8 4.53 94 61 A 79 GLU HA A 78 LYS HDx 1.0 1.8 4.78 95 61 A 79 GLU HA A 78 LYS HDy 1.0 1.8 4.78 96 62 A 14 GLY H A 13 LEU HBx 1.0 1.8 4.15 97 63 A 22 ILE HB A 84 GLU HA 1.0 1.8 4.08 98 64 A 52 CYS HA A 55 GLN HBx 1.0 1.8 3.90 99 64 A 52 CYS HA A 55 GLN HBy 1.0 1.8 3.90 100 65 A 23 LYS HB2 A 23 LYS HEx 1.0 1.8 4.63 101 65 A 23 LYS HB2 A 23 LYS HEy 1.0 1.8 4.63 102 66 A 49 GLU HA A 48 LYS HBx 1.0 1.8 4.34 103 66 A 48 LYS HBy A 49 GLU HA 1.0 1.8 4.34 104 67 A 27 ILE HG2% A 33 GLU HB3 1.0 1.8 4.10 105 68 A 41 THR HA A 39 LYS HBx 1.0 1.8 4.80 106 68 A 39 LYS HBy A 41 THR HA 1.0 1.8 4.80 107 69 A 27 ILE HD1% A 33 GLU HB3 1.0 1.8 4.28 108 70 A 21 TYR H A 20 GLU HBx 1.0 1.8 3.66 109 70 A 20 GLU HBy A 21 TYR H 1.0 1.8 3.66 110 71 A 40 MET HE% A 78 LYS H 1.0 1.8 3.89 111 72 A 82 MET H A 82 MET HE% 1.0 1.8 4.56 112 73 A 82 MET HE% A 24 LEU HDx% 1.0 1.8 3.21 113 73 A 24 LEU HDy% A 82 MET HE% 1.0 1.8 3.21 114 74 A 40 MET HE% A 22 ILE HD1% 1.0 1.8 3.95 115 75 A 12 ASP H A 11 GLU HBx 1.0 1.8 3.41 116 75 A 11 GLU HBy A 12 ASP H 1.0 1.8 3.41 117 76 A 94 GLN H A 94 GLN HBx 1.0 1.8 3.61 118 77 A 50 SER H A 49 GLU HBx 1.0 1.8 3.90 119 77 A 49 GLU HBy A 50 SER H 1.0 1.8 3.90 120 78 A 79 GLU HB3 A 80 LEU HBx 1.0 1.8 4.91 121 78 A 80 LEU HBy A 79 GLU HB3 1.0 1.8 4.91 122 79 A 88 ILE HG2% A 89 GLU HBx 1.0 1.8 4.12 123 79 A 88 ILE HG2% A 89 GLU HBy 1.0 1.8 4.12 124 80 A 19 GLY H A 18 GLU HBx 1.0 1.8 3.81 125 80 A 18 GLU HBy A 19 GLY H 1.0 1.8 3.81 126 81 A 93 GLU H A 93 GLU HGx 1.0 1.8 4.35 127 81 A 93 GLU H A 93 GLU HGy 1.0 1.8 4.35 128 82 A 57 VAL HGx% A 59 MET HE% 1.0 1.8 4.55 129 83 A 93 GLU H A 92 GLN HB3 1.0 1.8 4.68 130 84 A 84 GLU HB2 A 23 LYS HDx 1.0 1.8 4.77 131 84 A 23 LYS HDy A 84 GLU HB2 1.0 1.8 4.77 132 85 A 92 GLN HB3 A 62 LEU HB3 1.0 1.8 4.49 133 86 A 11 GLU H A 11 GLU HGx 1.0 1.8 3.72 134 86 A 11 GLU H A 11 GLU HGy 1.0 1.8 3.72 135 87 A 6 ALA HB% A 5 GLU HGx 1.0 1.8 4.47 136 87 A 6 ALA HB% A 5 GLU HGy 1.0 1.8 4.47 137 88 A 49 GLU H A 49 GLU HG3 1.0 1.8 4.07 138 89 A 49 GLU HG3 A 45 LYS HEx 1.0 1.8 4.46 139 89 A 49 GLU HG3 A 45 LYS HEy 1.0 1.8 4.46 140 90 A 50 SER H A 53 GLN HBx 1.0 1.8 4.74 141 90 A 50 SER H A 53 GLN HBy 1.0 1.8 4.74 142 91 A 11 GLU HA A 11 GLU HGx 1.0 1.8 3.88 143 91 A 11 GLU HGy A 11 GLU HA 1.0 1.8 3.88 144 92 A 89 GLU HA A 89 GLU HG2 1.0 1.8 4.21 145 93 A 88 ILE HG2% A 89 GLU HG2 1.0 1.8 4.63 146 94 A 94 GLN H A 94 GLN HGx 1.0 1.8 4.00 147 94 A 94 GLN H A 94 GLN HGy 1.0 1.8 4.00 148 95 A 92 GLN H A 29 GLN HGx 1.0 1.8 4.32 149 95 A 29 GLN HGy A 92 GLN H 1.0 1.8 4.32 150 96 A 92 GLN H A 92 GLN HGx 1.0 1.8 4.65 151 96 A 92 GLN H A 92 GLN HGy 1.0 1.8 4.65 152 97 A 30 ASP HA A 29 GLN HGx 1.0 1.8 3.81 153 97 A 29 GLN HGy A 30 ASP HA 1.0 1.8 3.81 154 98 A 53 GLN HA A 53 GLN HG3 1.0 1.8 4.12 155 99 A 85 GLU HA A 85 GLU HGx 1.0 1.8 4.12 156 99 A 85 GLU HA A 85 GLU HGy 1.0 1.8 4.12 157 100 A 53 GLN H A 53 GLN HG2 1.0 1.8 4.08 158 101 A 13 LEU H A 12 ASP HBx 1.0 1.8 3.75 159 101 A 12 ASP HBy A 13 LEU H 1.0 1.8 3.75 160 102 A 4 GLN H A 3 ASP HBx 1.0 1.8 3.80 161 102 A 3 ASP HBy A 4 GLN H 1.0 1.8 3.80 162 103 A 13 LEU HG A 15 ASP HBx 1.0 1.8 5.92 163 103 A 13 LEU HG A 15 ASP HBy 1.0 1.8 5.92 164 104 A 51 TYR HB3 A 59 MET HGx 1.0 1.8 3.64 165 104 A 51 TYR HB3 A 59 MET HGy 1.0 1.8 3.64 166 105 A 66 PHE HB3 A 69 GLN HB3 1.0 1.8 4.13 167 106 A 23 LYS HEy A 85 GLU HBx 1.0 1.8 3.81 168 106 A 23 LYS HEx A 85 GLU HBx 1.0 1.8 3.81 169 106 A 85 GLU HBy A 23 LYS HEx 1.0 1.8 3.81 170 106 A 23 LYS HEy A 85 GLU HBy 1.0 1.8 3.81 171 107 A 84 GLU HB2 A 23 LYS HEx 1.0 1.8 4.14 172 107 A 23 LYS HEy A 84 GLU HB2 1.0 1.8 4.14 173 108 A 25 LYS HB2 A 25 LYS HEx 1.0 1.8 3.17 174 108 A 25 LYS HEy A 25 LYS HB2 1.0 1.8 3.17 175 109 A 45 LYS HDy A 45 LYS HEx 1.0 1.8 2.78 176 109 A 45 LYS HDx A 45 LYS HEx 1.0 1.8 2.78 177 109 A 45 LYS HEy A 45 LYS HDx 1.0 1.8 2.78 178 109 A 45 LYS HEy A 45 LYS HDy 1.0 1.8 2.78 179 110 A 45 LYS HG3 A 45 LYS HEx 1.0 1.8 2.97 180 110 A 45 LYS HEy A 45 LYS HG3 1.0 1.8 2.97 181 111 A 71 ILE HG2% A 64 PHE HB2 1.0 1.8 4.32 182 112 A 46 LYS HEy A 50 SER HBx 1.0 1.8 4.91 183 112 A 46 LYS HEx A 50 SER HBx 1.0 1.8 4.91 184 112 A 50 SER HBy A 46 LYS HEx 1.0 1.8 4.91 185 112 A 46 LYS HEy A 50 SER HBy 1.0 1.8 4.91 186 113 A 82 MET HE% A 86 ASP HBy 1.0 1.8 4.84 187 114 A 7 LYS HDx A 7 LYS HEx 1.0 1.8 2.96 188 114 A 7 LYS HDy A 7 LYS HEx 1.0 1.8 2.96 189 114 A 7 LYS HEy A 7 LYS HDx 1.0 1.8 2.96 190 114 A 7 LYS HDy A 7 LYS HEy 1.0 1.8 2.96 191 115 A 63 ARG H A 63 ARG HDx 1.0 1.8 4.26 192 115 A 63 ARG H A 63 ARG HDy 1.0 1.8 4.26 193 116 A 65 LEU HDx% A 63 ARG HDx 1.0 1.8 4.15 194 116 A 65 LEU HDx% A 63 ARG HDy 1.0 1.8 4.15 195 117 A 39 LYS HDy A 39 LYS HEx 1.0 1.8 2.99 196 117 A 39 LYS HDx A 39 LYS HEx 1.0 1.8 2.99 197 117 A 39 LYS HEy A 39 LYS HDx 1.0 1.8 2.99 198 117 A 39 LYS HDy A 39 LYS HEy 1.0 1.8 2.99 199 118 A 45 LYS HA A 45 LYS HDx 1.0 1.8 3.79 200 118 A 45 LYS HDy A 45 LYS HA 1.0 1.8 3.79 201 119 A 85 GLU HA A 24 LEU HA 1.0 1.8 4.19 202 120 A 47 LEU HA A 50 SER HBx 1.0 1.8 3.48 203 120 A 47 LEU HA A 50 SER HBy 1.0 1.8 3.48 204 121 A 84 GLU HB2 A 85 GLU HA 1.0 1.8 4.74 205 122 A 47 LEU HA A 46 LYS HGx 1.0 1.8 4.06 206 122 A 47 LEU HA A 46 LYS HGy 1.0 1.8 4.06 207 123 A 32 SER H A 32 SER HBx 1.0 1.8 4.16 208 124 A 45 LYS HB2 A 73 ASP HA 1.0 1.8 3.88 209 125 A 44 LEU HBx A 77 PRO HDx 1.0 1.8 4.88 210 125 A 44 LEU HBy A 77 PRO HDx 1.0 1.8 4.88 211 125 A 77 PRO HDy A 44 LEU HBx 1.0 1.8 4.88 212 125 A 44 LEU HBy A 77 PRO HDy 1.0 1.8 4.88 213 126 A 52 CYS HA A 56 GLY H 1.0 1.8 4.35 214 127 A 79 GLU HA A 79 GLU HB2 1.0 1.8 2.90 215 128 A 44 LEU HA A 44 LEU HG 1.0 1.8 3.29 216 129 A 78 LYS HA A 78 LYS HGx 1.0 1.8 3.42 217 129 A 78 LYS HA A 78 LYS HGy 1.0 1.8 3.42 218 130 A 51 TYR HA A 54 ARG HBx 1.0 1.8 3.96 219 130 A 51 TYR HA A 54 ARG HBy 1.0 1.8 3.96 220 131 A 46 LYS HDy A 50 SER HBx 1.0 1.8 4.21 221 131 A 46 LYS HDx A 50 SER HBx 1.0 1.8 4.21 222 131 A 50 SER HBy A 46 LYS HDx 1.0 1.8 4.21 223 131 A 50 SER HBy A 46 LYS HDy 1.0 1.8 4.21 224 132 A 29 GLN HA A 29 GLN HGx 1.0 1.8 3.61 225 132 A 29 GLN HGy A 29 GLN HA 1.0 1.8 3.61 226 133 A 62 LEU H A 61 SER HB2 1.0 1.8 3.88 227 134 A 84 GLU HA A 85 GLU H 1.0 1.8 3.33 228 135 A 95 THR H A 95 THR HB 1.0 1.8 3.86 229 136 A 12 ASP H A 11 GLU HA 1.0 1.8 3.02 230 137 A 77 PRO HA A 24 LEU HDx% 1.0 1.8 4.25 231 137 A 24 LEU HDy% A 77 PRO HA 1.0 1.8 4.25 232 138 A 25 LYS HB3 A 35 HIS HA 1.0 1.8 4.90 233 139 A 65 LEU HDy% A 69 GLN H 1.0 1.8 4.71 234 140 A 65 LEU HDy% A 64 PHE HA 1.0 1.8 4.53 235 141 A 47 LEU HDx% A 64 PHE HE2 1.0 1.8 5.95 236 142 A 34 ILE HG2% A 51 TYR HE1 1.0 1.8 4.43 237 143 A 65 LEU HDx% A 91 TYR H 1.0 1.8 4.49 238 144 A 71 ILE HD1% A 75 HIS HB2 1.0 1.8 4.63 239 145 A 62 LEU HB3 A 92 GLN HE22 1.0 1.8 5.68 240 146 A 62 LEU HB3 A 91 TYR HA 1.0 1.8 5.07 241 147 A 71 ILE HG2% A 44 LEU H 1.0 1.8 4.86 242 148 A 65 LEU HA A 71 ILE HG2% 1.0 1.8 5.35 243 149 A 28 GLY H A 27 ILE HD1% 1.0 1.8 5.26 244 150 A 21 TYR HA A 22 ILE HG13 1.0 1.8 4.43 245 151 A 15 ASP HBy A 13 LEU HDx% 1.0 1.8 4.97 246 151 A 13 LEU HDx% A 15 ASP HBx 1.0 1.8 4.97 247 152 A 26 VAL H A 88 ILE HG1x 1.0 1.8 5.25 248 152 A 88 ILE HG1y A 26 VAL H 1.0 1.8 5.25 249 153 A 90 VAL HA A 62 LEU HG 1.0 1.8 5.66 250 154 A 88 ILE HG2% A 90 VAL H 1.0 1.8 4.68 251 155 A 41 THR HG2% A 79 GLU H 1.0 1.8 5.22 252 156 A 28 GLY H A 90 VAL HB 1.0 1.8 5.04 253 157 A 90 VAL HB A 62 LEU HDx% 1.0 1.8 4.44 254 157 A 62 LEU HDy% A 90 VAL HB 1.0 1.8 4.44 255 158 A 23 LYS H A 22 ILE HG12 1.0 1.8 5.76 256 159 A 22 ILE HG12 A 40 MET H 1.0 1.8 6.00 257 160 A 19 GLY H A 17 LYS HGx 1.0 1.8 6.00 258 160 A 17 LYS HGy A 19 GLY H 1.0 1.8 6.00 259 161 A 49 GLU H A 46 LYS HGx 1.0 1.8 6.00 260 161 A 46 LYS HGy A 49 GLU H 1.0 1.8 6.00 261 162 A 90 VAL HA A 65 LEU HG 1.0 1.8 4.63 262 163 A 45 LYS HB3 A 73 ASP HBx 1.0 1.8 4.59 263 163 A 45 LYS HB3 A 73 ASP HBy 1.0 1.8 4.59 264 164 A 91 TYR HA A 62 LEU HB2 1.0 1.8 4.78 265 165 A 25 LYS H A 25 LYS HDx 1.0 1.8 5.22 266 165 A 25 LYS H A 25 LYS HDy 1.0 1.8 5.22 267 166 A 25 LYS HB2 A 87 VAL HA 1.0 1.8 5.28 268 167 A 91 TYR H A 63 ARG HBx 1.0 1.8 4.68 269 167 A 91 TYR H A 63 ARG HBy 1.0 1.8 4.68 270 168 A 41 THR HG2% A 78 LYS HB3 1.0 1.8 4.59 271 169 A 94 GLN H A 93 GLU HB3 1.0 1.8 4.50 272 170 A 47 LEU HDx% A 46 LYS HDx 1.0 1.8 4.95 273 170 A 46 LYS HDy A 47 LEU HDx% 1.0 1.8 4.95 274 171 A 65 LEU HA A 70 ARG HBx 1.0 1.8 5.34 275 171 A 65 LEU HA A 70 ARG HBy 1.0 1.8 5.34 276 172 A 65 LEU HDx% A 70 ARG HBx 1.0 1.8 4.92 277 172 A 65 LEU HDx% A 70 ARG HBy 1.0 1.8 4.92 278 173 A 34 ILE HB A 55 GLN HGx 1.0 1.8 4.74 279 173 A 34 ILE HB A 55 GLN HGy 1.0 1.8 4.74 280 174 A 40 MET HE% A 41 THR H 1.0 1.8 4.52 281 175 A 6 ALA HB% A 5 GLU HBx 1.0 1.8 4.95 282 175 A 6 ALA HB% A 5 GLU HBy 1.0 1.8 4.95 283 176 A 22 ILE HG12 A 84 GLU HB3 1.0 1.8 5.34 284 177 A 10 THR HG2% A 11 GLU HBx 1.0 1.8 5.39 285 177 A 11 GLU HBy A 10 THR HG2% 1.0 1.8 5.39 286 178 A 34 ILE HG1y A 54 ARG HBx 1.0 1.8 6.00 287 178 A 34 ILE HG1x A 54 ARG HBx 1.0 1.8 6.00 288 178 A 54 ARG HBy A 34 ILE HG1x 1.0 1.8 6.00 289 178 A 34 ILE HG1y A 54 ARG HBy 1.0 1.8 6.00 290 179 A 81 GLY H A 82 MET HGx 1.0 1.8 4.42 291 179 A 81 GLY H A 82 MET HGy 1.0 1.8 4.42 292 180 A 69 GLN HB2 A 69 GLN HE21 1.0 1.8 4.45 293 181 A 40 MET HA A 77 PRO HBx 1.0 1.8 4.50 294 181 A 40 MET HA A 77 PRO HBy 1.0 1.8 4.50 295 182 A 75 HIS HA A 79 GLU HB2 1.0 1.8 5.38 296 183 A 49 GLU HG3 A 48 LYS H 1.0 1.8 5.04 297 184 A 26 VAL HB A 34 ILE H 1.0 1.8 5.54 298 185 A 91 TYR HB3 A 93 GLU HB2 1.0 1.8 4.96 299 186 A 91 TYR HB3 A 63 ARG HGx 1.0 1.8 5.12 300 186 A 91 TYR HB3 A 63 ARG HGy 1.0 1.8 5.12 301 187 A 23 LYS HDy A 85 GLU HBx 1.0 1.8 4.82 302 187 A 23 LYS HDx A 85 GLU HBx 1.0 1.8 4.82 303 187 A 85 GLU HBy A 23 LYS HDx 1.0 1.8 4.82 304 187 A 23 LYS HDy A 85 GLU HBy 1.0 1.8 4.82 305 188 A 50 SER H A 53 GLN HG3 1.0 1.8 5.45 306 189 A 90 VAL HGx% A 29 GLN HGx 1.0 1.8 5.16 307 189 A 90 VAL HGx% A 29 GLN HGy 1.0 1.8 5.16 308 190 A 64 PHE HB3 A 48 LYS HDx 1.0 1.8 4.69 309 190 A 64 PHE HB3 A 48 LYS HDy 1.0 1.8 4.69 310 191 A 11 GLU HBy A 12 ASP HBx 1.0 1.8 4.48 311 191 A 11 GLU HBx A 12 ASP HBx 1.0 1.8 4.48 312 191 A 12 ASP HBy A 11 GLU HBx 1.0 1.8 4.48 313 191 A 11 GLU HBy A 12 ASP HBy 1.0 1.8 4.48 314 192 A 22 ILE HG13 A 21 TYR HB3 1.0 1.8 6.00 315 193 A 78 LYS H A 78 LYS HEx 1.0 1.8 4.57 316 193 A 78 LYS H A 78 LYS HEy 1.0 1.8 4.57 317 194 A 38 VAL H A 46 LYS HEx 1.0 1.8 5.22 318 194 A 46 LYS HEy A 38 VAL H 1.0 1.8 5.22 319 195 A 91 TYR H A 63 ARG HDx 1.0 1.8 4.51 320 195 A 63 ARG HDy A 91 TYR H 1.0 1.8 4.51 321 196 A 29 GLN HE21 A 30 ASP HB2 1.0 1.8 5.00 322 197 A 9 SER H A 7 LYS HEx 1.0 1.8 4.99 323 197 A 7 LYS HEy A 9 SER H 1.0 1.8 4.99 324 198 A 48 LYS HA A 64 PHE HE1 1.0 1.8 5.19 325 199 A 64 PHE HE2 A 48 LYS HA 1.0 1.8 5.55 326 200 A 64 PHE HD% A 48 LYS HA 1.0 1.8 5.23 327 201 A 42 THR HA A 43 HIS HB2 1.0 1.8 4.89 328 202 A 64 PHE HE2 A 51 TYR HB2 1.0 1.8 5.60 329 203 A 25 LYS H A 85 GLU HA 1.0 1.8 5.16 330 204 A 47 LEU HA A 51 TYR HB2 1.0 1.8 4.96 331 205 A 85 GLU HA A 23 LYS HEx 1.0 1.8 4.44 332 205 A 23 LYS HEy A 85 GLU HA 1.0 1.8 4.44 333 206 A 21 TYR H A 39 LYS HA 1.0 1.8 4.87 334 207 A 41 THR H A 77 PRO HDx 1.0 1.8 5.31 335 207 A 77 PRO HDy A 41 THR H 1.0 1.8 5.31 336 208 A 52 CYS HA A 57 VAL HB 1.0 1.8 5.34 337 209 A 39 LYS H A 42 THR HB 1.0 1.8 4.44 338 210 A 65 LEU HB3 A 68 GLY HA2 1.0 1.8 4.44 339 211 A 65 LEU HDx% A 68 GLY HA2 1.0 1.8 4.76 340 212 A 45 LYS HG3 A 48 LYS HGx 1.0 1.8 5.34 341 212 A 45 LYS HG3 A 48 LYS HGy 1.0 1.8 5.34 342 213 A 46 LYS H A 47 LEU H 1.0 1.8 3.67 343 214 A 47 LEU H A 44 LEU HDx% 1.0 1.8 4.34 344 214 A 47 LEU H A 44 LEU HDy% 1.0 1.8 4.34 345 215 A 41 THR H A 42 THR HB 1.0 1.8 4.19 346 216 A 41 THR H A 40 MET HB3 1.0 1.8 3.99 347 217 A 75 HIS HB2 A 75 HIS H 1.0 1.8 3.31 348 218 A 75 HIS H A 75 HIS HB3 1.0 1.8 3.56 349 219 A 42 THR HB A 42 THR H 1.0 1.8 3.52 350 220 A 62 LEU H A 93 GLU H 1.0 1.8 5.26 351 221 A 62 LEU H A 59 MET HE% 1.0 1.8 4.59 352 222 A 79 GLU HB2 A 76 THR H 1.0 1.8 3.82 353 223 A 79 GLU HB2 A 80 LEU H 1.0 1.8 4.11 354 224 A 80 LEU H A 80 LEU HDy% 1.0 1.8 3.77 355 225 A 48 LYS H A 47 LEU H 1.0 1.8 3.59 356 226 A 48 LYS H A 48 LYS HEx 1.0 1.8 4.47 357 226 A 48 LYS HEy A 48 LYS H 1.0 1.8 4.47 358 227 A 48 LYS H A 47 LEU HBx 1.0 1.8 4.20 359 228 A 48 LYS H A 48 LYS HGx 1.0 1.8 3.91 360 228 A 48 LYS H A 48 LYS HGy 1.0 1.8 3.91 361 229 A 82 MET H A 83 GLU H 1.0 1.8 4.60 362 230 A 80 LEU HDx% A 82 MET H 1.0 1.8 4.31 363 231 A 81 GLY H A 81 GLY HAx 1.0 1.8 2.85 364 231 A 81 GLY H A 81 GLY HAy 1.0 1.8 2.85 365 232 A 57 VAL HGy% A 57 VAL H 1.0 1.8 3.00 366 233 A 74 ASN H A 73 ASP HBx 1.0 1.8 4.02 367 233 A 73 ASP HBy A 74 ASN H 1.0 1.8 4.02 368 234 A 89 GLU HA A 90 VAL H 1.0 1.8 2.93 369 235 A 34 ILE HD1% A 55 GLN H 1.0 1.8 4.31 370 236 A 62 LEU H A 61 SER H 1.0 1.8 3.31 371 237 A 61 SER H A 61 SER HB3 1.0 1.8 3.66 372 238 A 53 GLN HA A 56 GLY H 1.0 1.8 4.06 373 239 A 56 GLY H A 56 GLY HAx 1.0 1.8 2.80 374 239 A 56 GLY H A 56 GLY HAy 1.0 1.8 2.80 375 240 A 56 GLY H A 55 GLN HGx 1.0 1.8 5.09 376 240 A 56 GLY H A 55 GLN HGy 1.0 1.8 5.09 377 241 A 79 GLU H A 80 LEU H 1.0 1.8 3.47 378 242 A 66 PHE HB3 A 69 GLN H 1.0 1.8 4.42 379 243 A 79 GLU H A 78 LYS HGx 1.0 1.8 3.43 380 243 A 78 LYS HGy A 79 GLU H 1.0 1.8 3.43 381 244 A 79 GLU H A 76 THR HG2% 1.0 1.8 4.34 382 245 A 50 SER H A 50 SER HBx 1.0 1.8 3.49 383 245 A 50 SER H A 50 SER HBy 1.0 1.8 3.49 384 246 A 30 ASP H A 31 SER H 1.0 1.8 3.35 385 247 A 31 SER H A 28 GLY HAx 1.0 1.8 4.44 386 247 A 31 SER H A 28 GLY HAy 1.0 1.8 4.44 387 248 A 78 LYS H A 80 LEU H 1.0 1.8 4.74 388 249 A 78 LYS H A 77 PRO HBx 1.0 1.8 3.67 389 249 A 78 LYS H A 77 PRO HBy 1.0 1.8 3.67 390 250 A 85 GLU H A 86 ASP H 1.0 1.8 3.46 391 251 A 86 ASP H A 86 ASP HBy 1.0 1.8 3.58 392 252 A 66 PHE HE% A 87 VAL H 1.0 1.8 4.25 393 253 A 9 SER HA A 10 THR H 1.0 1.8 3.28 394 254 A 10 THR HG2% A 10 THR H 1.0 1.8 4.38 395 255 A 53 GLN H A 52 CYS H 1.0 1.8 3.58 396 256 A 30 ASP H A 30 ASP HB3 1.0 1.8 3.56 397 257 A 17 LYS H A 16 LYS HBx 1.0 1.8 3.40 398 257 A 16 LYS HBy A 17 LYS H 1.0 1.8 3.40 399 258 A 21 TYR H A 22 ILE HA 1.0 1.8 5.01 400 259 A 13 LEU H A 12 ASP HA 1.0 1.8 3.47 401 260 A 13 LEU H A 13 LEU HDy% 1.0 1.8 4.75 402 261 A 93 GLU H A 93 GLU HB3 1.0 1.8 3.55 403 262 A 93 GLU H A 62 LEU HDx% 1.0 1.8 4.20 404 262 A 62 LEU HDy% A 93 GLU H 1.0 1.8 4.20 405 263 A 28 GLY H A 27 ILE HA 1.0 1.8 3.02 406 264 A 49 GLU H A 48 LYS H 1.0 1.8 3.88 407 265 A 49 GLU H A 49 GLU HG2 1.0 1.8 3.46 408 266 A 17 LYS HA A 18 GLU H 1.0 1.8 3.28 409 267 A 90 VAL HA A 91 TYR H 1.0 1.8 3.01 410 268 A 9 SER H A 8 PRO HA 1.0 1.8 3.30 411 269 A 32 SER H A 33 GLU H 1.0 1.8 4.55 412 270 A 25 LYS H A 88 ILE HG1x 1.0 1.8 3.96 413 270 A 25 LYS H A 88 ILE HG1y 1.0 1.8 3.96 414 271 A 50 SER H A 52 CYS H 1.0 1.8 4.60 415 272 A 51 TYR HB2 A 52 CYS H 1.0 1.8 3.62 416 273 A 26 VAL H A 34 ILE H 1.0 1.8 3.80 417 274 A 34 ILE H A 33 GLU HA 1.0 1.8 2.98 418 275 A 34 ILE HB A 34 ILE H 1.0 1.8 3.36 419 276 A 34 ILE H A 34 ILE HG1x 1.0 1.8 4.25 420 276 A 34 ILE HG1y A 34 ILE H 1.0 1.8 4.25 421 277 A 34 ILE HG2% A 35 HIS H 1.0 1.8 3.96 422 278 A 92 GLN H A 91 TYR HA 1.0 1.8 2.82 423 279 A 29 GLN H A 28 GLY HAx 1.0 1.8 3.23 424 279 A 28 GLY HAy A 29 GLN H 1.0 1.8 3.23 425 280 A 91 TYR HB2 A 92 GLN H 1.0 1.8 4.13 426 281 A 29 GLN H A 29 GLN HGx 1.0 1.8 3.48 427 281 A 29 GLN HGy A 29 GLN H 1.0 1.8 3.48 428 282 A 29 GLN H A 29 GLN HB2 1.0 1.8 3.62 429 283 A 92 GLN H A 92 GLN HB2 1.0 1.8 2.99 430 284 A 92 GLN H A 62 LEU HB2 1.0 1.8 4.56 431 285 A 90 VAL HB A 29 GLN H 1.0 1.8 4.40 432 286 A 29 GLN H A 62 LEU HDx% 1.0 1.8 4.80 433 286 A 62 LEU HDy% A 29 GLN H 1.0 1.8 4.80 434 287 A 71 ILE H A 70 ARG H 1.0 1.8 4.26 435 288 A 70 ARG H A 70 ARG HDx 1.0 1.8 4.85 436 288 A 70 ARG H A 70 ARG HDy 1.0 1.8 4.85 437 289 A 70 ARG H A 70 ARG HBx 1.0 1.8 2.96 438 289 A 70 ARG HBy A 70 ARG H 1.0 1.8 2.96 439 290 A 51 TYR HD% A 51 TYR H 1.0 1.8 4.28 440 291 A 51 TYR HB2 A 51 TYR H 1.0 1.8 3.59 441 292 A 51 TYR HB3 A 51 TYR H 1.0 1.8 3.54 442 293 A 88 ILE HA A 89 GLU H 1.0 1.8 3.15 443 294 A 89 GLU H A 89 GLU HBx 1.0 1.8 3.43 444 294 A 89 GLU HBy A 89 GLU H 1.0 1.8 3.43 445 295 A 69 GLN H A 68 GLY H 1.0 1.8 3.81 446 296 A 66 PHE HA A 68 GLY H 1.0 1.8 4.43 447 297 A 65 LEU HB2 A 68 GLY H 1.0 1.8 4.40 448 298 A 68 GLY H A 67 GLU HG3 1.0 1.8 4.08 449 299 A 23 LYS H A 24 LEU H 1.0 1.8 4.56 450 300 A 66 PHE HD% A 66 PHE H 1.0 1.8 4.32 451 301 A 65 LEU HA A 66 PHE H 1.0 1.8 3.11 452 302 A 63 ARG H A 91 TYR HA 1.0 1.8 4.87 453 303 A 66 PHE HB3 A 66 PHE H 1.0 1.8 3.94 454 304 A 63 ARG H A 91 TYR HB3 1.0 1.8 4.88 455 305 A 63 ARG H A 62 LEU HB2 1.0 1.8 3.38 456 306 A 63 ARG H A 62 LEU HDx% 1.0 1.8 3.47 457 306 A 62 LEU HDy% A 63 ARG H 1.0 1.8 3.47 458 307 A 63 ARG H A 91 TYR H 1.0 1.8 3.91 459 308 A 62 LEU HA A 63 ARG H 1.0 1.8 3.21 460 309 A 71 ILE H A 70 ARG HA 1.0 1.8 3.30 461 310 A 71 ILE H A 71 ILE HB 1.0 1.8 3.64 462 311 A 27 ILE H A 26 VAL HA 1.0 1.8 3.14 463 312 A 35 HIS HA A 26 VAL H 1.0 1.8 4.38 464 313 A 36 PHE H A 35 HIS H 1.0 1.8 4.76 465 314 A 36 PHE H A 25 LYS HA 1.0 1.8 4.19 466 315 A 36 PHE H A 35 HIS HB3 1.0 1.8 3.76 467 316 A 38 VAL H A 23 LYS HB3 1.0 1.8 5.43 468 317 A 22 ILE H A 24 LEU HDx% 1.0 1.8 4.52 469 317 A 24 LEU HDy% A 22 ILE H 1.0 1.8 4.52 470 318 A 87 VAL HA A 88 ILE H 1.0 1.8 3.22 471 319 A 83 GLU H A 83 GLU HBx 1.0 1.8 3.93 472 320 A 83 GLU H A 24 LEU HDx% 1.0 1.8 4.76 473 320 A 24 LEU HDy% A 83 GLU H 1.0 1.8 4.76 474 321 A 44 LEU H A 77 PRO HDx 1.0 1.8 4.28 475 321 A 77 PRO HDy A 44 LEU H 1.0 1.8 4.28 476 322 A 44 LEU HG A 44 LEU H 1.0 1.8 3.41 477 323 A 23 LYS HB2 A 85 GLU H 1.0 1.8 5.05 478 324 A 85 GLU H A 24 LEU HDx% 1.0 1.8 4.48 479 324 A 24 LEU HDy% A 85 GLU H 1.0 1.8 4.48 480 325 A 22 ILE HD1% A 85 GLU H 1.0 1.8 4.78 481 326 A 66 PHE HA A 67 GLU H 1.0 1.8 3.27 482 327 A 65 LEU H A 89 GLU H 1.0 1.8 3.94 483 328 A 65 LEU H A 64 PHE HA 1.0 1.8 3.20 484 329 A 65 LEU H A 65 LEU HB2 1.0 1.8 3.61 485 330 A 75 HIS H A 74 ASN HD22 1.0 1.8 4.72 486 331 A 55 GLN HE22 A 55 GLN H 1.0 1.8 4.58 487 332 A 29 GLN HE22 A 92 GLN HB2 1.0 1.8 4.59 488 333 A 53 GLN H A 55 GLN HE21 1.0 1.8 5.22 489 334 A 69 GLN HE21 A 70 ARG HBx 1.0 1.8 5.18 490 334 A 70 ARG HBy A 69 GLN HE21 1.0 1.8 5.18 491 335 A 91 TYR HB2 A 63 ARG HE 1.0 1.8 4.78 492 336 A 5 GLU H A 5 GLU HGx 1.0 1.8 4.12 493 336 A 5 GLU HGy A 5 GLU H 1.0 1.8 4.12 494 337 A 2 SER H A 3 ASP H 1.0 1.8 4.54 495 338 A 42 THR H A 44 LEU HDx% 1.0 1.8 4.88 496 338 A 44 LEU HDy% A 42 THR H 1.0 1.8 4.88 497 339 A 90 VAL HGx% A 62 LEU H 1.0 1.8 5.21 498 340 A 48 LYS H A 51 TYR H 1.0 1.8 4.92 499 341 A 80 LEU HDx% A 81 GLY H 1.0 1.8 4.95 500 342 A 81 GLY H A 80 LEU HDy% 1.0 1.8 5.25 501 343 A 56 GLY H A 57 VAL HA 1.0 1.8 5.43 502 344 A 50 SER H A 47 LEU HDx% 1.0 1.8 5.68 503 345 A 78 LYS H A 44 LEU HDx% 1.0 1.8 5.25 504 345 A 78 LYS H A 44 LEU HDy% 1.0 1.8 5.25 505 346 A 49 GLU H A 47 LEU H 1.0 1.8 4.83 506 347 A 18 GLU H A 19 GLY HAx 1.0 1.8 5.34 507 347 A 18 GLU H A 19 GLY HAy 1.0 1.8 5.34 508 348 A 48 LYS H A 45 LYS H 1.0 1.8 4.95 509 349 A 33 GLU H A 51 TYR HE2 1.0 1.8 5.92 510 350 A 51 TYR HD% A 34 ILE H 1.0 1.8 4.92 511 351 A 25 LYS HB2 A 35 HIS H 1.0 1.8 5.86 512 352 A 73 ASP H A 75 HIS HB2 1.0 1.8 5.36 513 353 A 59 MET H A 52 CYS HA 1.0 1.8 5.21 514 354 A 71 ILE H A 64 PHE HB2 1.0 1.8 4.86 515 355 A 23 LYS H A 22 ILE H 1.0 1.8 5.05 516 356 A 88 ILE HA A 67 GLU H 1.0 1.8 5.03 517 357 A 29 GLN HE22 A 92 GLN H 1.0 1.8 5.87 518 358 A 62 LEU HB3 A 29 GLN HE21 1.0 1.8 5.20 519 359 A 42 THR H A 76 THR HB 1.0 1.8 4.39 520 360 A 19 GLY H A 20 GLU H 1.0 1.8 4.50 521 361 A 94 GLN H A 95 THR H 1.0 1.8 4.88 522 362 A 92 GLN H A 63 ARG HGx 1.0 1.8 5.92 523 362 A 92 GLN H A 63 ARG HGy 1.0 1.8 5.92 524 363 A 38 VAL H A 39 LYS H 1.0 1.8 5.17 525 364 A 26 VAL H A 35 HIS HD2 1.0 1.8 3.68 526 365 A 25 LYS HA A 35 HIS HD2 1.0 1.8 3.60 527 366 A 44 LEU HA A 47 LEU H 1.0 1.8 4.12 528 367 A 45 LYS HA A 47 LEU H 1.0 1.8 4.78 529 368 A 48 LYS HA A 47 LEU H 1.0 1.8 5.41 530 369 A 35 HIS HB3 A 35 HIS HD2 1.0 1.8 3.82 531 370 A 47 LEU H A 48 LYS HEx 1.0 1.8 5.96 532 370 A 48 LYS HEy A 47 LEU H 1.0 1.8 5.96 533 371 A 47 LEU H A 46 LYS HBx 1.0 1.8 3.66 534 371 A 47 LEU H A 46 LYS HBy 1.0 1.8 3.66 535 372 A 21 TYR HE% A 39 LYS HDx 1.0 1.8 4.57 536 372 A 39 LYS HDy A 21 TYR HE% 1.0 1.8 4.57 537 373 A 47 LEU H A 44 LEU HBx 1.0 1.8 5.05 538 373 A 44 LEU HBy A 47 LEU H 1.0 1.8 5.05 539 374 A 47 LEU H A 46 LYS HDx 1.0 1.8 3.58 540 374 A 46 LYS HDy A 47 LEU H 1.0 1.8 3.58 541 375 A 25 LYS HB2 A 35 HIS HD2 1.0 1.8 3.50 542 376 A 47 LEU H A 46 LYS HGx 1.0 1.8 3.70 543 376 A 46 LYS HGy A 47 LEU H 1.0 1.8 3.70 544 377 A 35 HIS HD2 A 25 LYS HG2 1.0 1.8 3.94 545 378 A 34 ILE HG2% A 35 HIS HD2 1.0 1.8 4.68 546 379 A 47 LEU HDx% A 47 LEU H 1.0 1.8 4.19 547 380 A 47 LEU H A 48 LYS HGx 1.0 1.8 5.88 548 380 A 48 LYS HGy A 47 LEU H 1.0 1.8 5.88 549 381 A 40 MET H A 41 THR H 1.0 1.8 4.04 550 382 A 41 THR H A 42 THR H 1.0 1.8 4.23 551 383 A 80 LEU HA A 69 GLN HE22 1.0 1.8 4.83 552 384 A 41 THR H A 39 LYS HA 1.0 1.8 5.14 553 385 A 69 GLN HB2 A 69 GLN HE22 1.0 1.8 5.03 554 386 A 44 LEU H A 75 HIS H 1.0 1.8 4.89 555 387 A 79 GLU H A 75 HIS HD2 1.0 1.8 4.97 556 388 A 80 LEU H A 75 HIS HD2 1.0 1.8 4.56 557 389 A 76 THR H A 75 HIS HD2 1.0 1.8 3.35 558 390 A 75 HIS HD2 A 76 THR HA 1.0 1.8 4.97 559 391 A 71 ILE HA A 75 HIS H 1.0 1.8 4.30 560 392 A 63 ARG HE A 93 GLU HA 1.0 1.8 6.00 561 393 A 75 HIS H A 72 ALA HA 1.0 1.8 6.00 562 394 A 75 HIS H A 74 ASN HB2 1.0 1.8 4.37 563 395 A 75 HIS H A 74 ASN HB3 1.0 1.8 4.25 564 396 A 75 HIS HD2 A 79 GLU HGx 1.0 1.8 3.86 565 396 A 75 HIS HD2 A 79 GLU HGy 1.0 1.8 3.86 566 397 A 79 GLU HB3 A 75 HIS HD2 1.0 1.8 3.93 567 398 A 93 GLU HB3 A 63 ARG HE 1.0 1.8 4.67 568 399 A 75 HIS HD2 A 80 LEU HBx 1.0 1.8 4.94 569 399 A 80 LEU HBy A 75 HIS HD2 1.0 1.8 4.94 570 400 A 75 HIS HD2 A 80 LEU HG 1.0 1.8 4.12 571 401 A 80 LEU HDx% A 75 HIS HD2 1.0 1.8 3.67 572 402 A 63 ARG HE A 91 TYR HD% 1.0 1.8 4.60 573 403 A 42 THR H A 76 THR HA 1.0 1.8 4.96 574 404 A 42 THR H A 41 THR HB 1.0 1.8 4.52 575 405 A 42 THR H A 77 PRO HDx 1.0 1.8 4.54 576 405 A 77 PRO HDy A 42 THR H 1.0 1.8 4.54 577 406 A 91 TYR HB3 A 63 ARG HE 1.0 1.8 4.69 578 407 A 42 THR H A 77 PRO HGx 1.0 1.8 4.29 579 407 A 77 PRO HGy A 42 THR H 1.0 1.8 4.29 580 408 A 93 GLU HB2 A 63 ARG HE 1.0 1.8 5.03 581 409 A 63 ARG HE A 63 ARG HBx 1.0 1.8 4.48 582 409 A 63 ARG HBy A 63 ARG HE 1.0 1.8 4.48 583 410 A 42 THR H A 42 THR HG2% 1.0 1.8 3.54 584 411 A 64 PHE HD% A 63 ARG H 1.0 1.8 5.45 585 412 A 64 PHE HD% A 63 ARG HA 1.0 1.8 3.91 586 413 A 62 LEU H A 61 SER HB3 1.0 1.8 4.32 587 414 A 36 PHE HD% A 34 ILE HG1x 1.0 1.8 4.03 588 414 A 34 ILE HG1y A 36 PHE HD% 1.0 1.8 4.03 589 415 A 66 PHE HE% A 67 GLU H 1.0 1.8 4.53 590 416 A 36 PHE HE1 A 26 VAL H 1.0 1.8 3.97 591 417 A 66 PHE HE% A 82 MET H 1.0 1.8 3.98 592 418 A 76 THR H A 80 LEU H 1.0 1.8 4.34 593 419 A 36 PHE HE1 A 26 VAL HA 1.0 1.8 5.45 594 420 A 75 HIS HA A 76 THR H 1.0 1.8 3.18 595 421 A 90 VAL HA A 64 PHE HD% 1.0 1.8 4.74 596 422 A 76 THR H A 76 THR HB 1.0 1.8 4.20 597 423 A 66 PHE HE% A 82 MET HA 1.0 1.8 4.05 598 424 A 76 THR H A 77 PRO HDx 1.0 1.8 4.56 599 424 A 77 PRO HDy A 76 THR H 1.0 1.8 4.56 600 425 A 36 PHE HE1 A 36 PHE HB3 1.0 1.8 4.72 601 426 A 64 PHE HE1 A 48 LYS HEx 1.0 1.8 6.00 602 426 A 48 LYS HEy A 64 PHE HE1 1.0 1.8 6.00 603 427 A 64 PHE HE2 A 48 LYS HEx 1.0 1.8 6.00 604 427 A 48 LYS HEy A 64 PHE HE2 1.0 1.8 6.00 605 428 A 64 PHE HD% A 26 VAL HB 1.0 1.8 4.12 606 429 A 64 PHE HE1 A 59 MET HBx 1.0 1.8 4.73 607 429 A 64 PHE HE1 A 59 MET HBy 1.0 1.8 4.73 608 430 A 59 MET HE% A 64 PHE HE1 1.0 1.8 5.30 609 431 A 59 MET HE% A 64 PHE HE2 1.0 1.8 5.20 610 432 A 79 GLU HB3 A 76 THR H 1.0 1.8 3.65 611 433 A 66 PHE HE% A 82 MET HBx 1.0 1.8 3.79 612 433 A 66 PHE HE% A 82 MET HBy 1.0 1.8 3.79 613 434 A 66 PHE HE% A 80 LEU HBx 1.0 1.8 3.71 614 434 A 80 LEU HBy A 66 PHE HE% 1.0 1.8 3.71 615 435 A 76 THR H A 80 LEU HG 1.0 1.8 3.54 616 436 A 66 PHE HE% A 67 GLU HB3 1.0 1.8 3.52 617 437 A 36 PHE HE1 A 34 ILE HG1x 1.0 1.8 4.25 618 437 A 36 PHE HE1 A 34 ILE HG1y 1.0 1.8 4.25 619 438 A 66 PHE HE% A 67 GLU HG2 1.0 1.8 3.63 620 439 A 76 THR H A 76 THR HG2% 1.0 1.8 3.52 621 440 A 36 PHE HE1 A 26 VAL HGx% 1.0 1.8 3.07 622 441 A 62 LEU H A 62 LEU HDx% 1.0 1.8 3.13 623 441 A 62 LEU HDy% A 62 LEU H 1.0 1.8 3.13 624 442 A 36 PHE HE1 A 26 VAL HGy% 1.0 1.8 3.45 625 443 A 47 LEU HDy% A 36 PHE HE1 1.0 1.8 4.28 626 444 A 90 VAL HGx% A 64 PHE HE2 1.0 1.8 4.84 627 445 A 64 PHE HE1 A 48 LYS HGx 1.0 1.8 5.14 628 445 A 64 PHE HE1 A 48 LYS HGy 1.0 1.8 5.14 629 446 A 64 PHE HE2 A 48 LYS HGx 1.0 1.8 5.57 630 446 A 64 PHE HE2 A 48 LYS HGy 1.0 1.8 5.57 631 447 A 44 LEU H A 46 LYS H 1.0 1.8 5.21 632 448 A 47 LEU HA A 46 LYS H 1.0 1.8 5.68 633 449 A 75 HIS HB3 A 80 LEU H 1.0 1.8 5.67 634 450 A 79 GLU HB3 A 80 LEU H 1.0 1.8 3.91 635 451 A 45 LYS HB2 A 46 LYS H 1.0 1.8 4.87 636 452 A 46 LYS H A 46 LYS HBx 1.0 1.8 3.31 637 452 A 46 LYS H A 46 LYS HBy 1.0 1.8 3.31 638 453 A 46 LYS H A 44 LEU HBx 1.0 1.8 4.70 639 453 A 44 LEU HBy A 46 LYS H 1.0 1.8 4.70 640 454 A 45 LYS HB3 A 46 LYS H 1.0 1.8 3.36 641 455 A 46 LYS H A 46 LYS HGx 1.0 1.8 3.80 642 455 A 46 LYS HGy A 46 LYS H 1.0 1.8 3.80 643 456 A 46 LYS H A 44 LEU HDx% 1.0 1.8 4.93 644 456 A 46 LYS H A 44 LEU HDy% 1.0 1.8 4.93 645 457 A 51 TYR HD% A 55 GLN HE21 1.0 1.8 3.98 646 458 A 69 GLN HE21 A 69 GLN HA 1.0 1.8 4.75 647 459 A 48 LYS H A 46 LYS HA 1.0 1.8 4.37 648 460 A 45 LYS HA A 48 LYS H 1.0 1.8 4.37 649 461 A 69 GLN HB3 A 69 GLN HE21 1.0 1.8 4.18 650 462 A 55 GLN HE21 A 54 ARG HBx 1.0 1.8 4.29 651 462 A 54 ARG HBy A 55 GLN HE21 1.0 1.8 4.29 652 463 A 48 LYS H A 48 LYS HBx 1.0 1.8 4.18 653 463 A 48 LYS HBy A 48 LYS H 1.0 1.8 4.18 654 464 A 48 LYS H A 48 LYS HDx 1.0 1.8 3.80 655 464 A 48 LYS H A 48 LYS HDy 1.0 1.8 3.80 656 465 A 48 LYS H A 45 LYS HG2 1.0 1.8 5.43 657 466 A 55 GLN HE21 A 34 ILE HG1x 1.0 1.8 5.99 658 466 A 34 ILE HG1y A 55 GLN HE21 1.0 1.8 5.99 659 467 A 82 MET H A 82 MET HGx 1.0 1.8 3.50 660 467 A 82 MET H A 82 MET HGy 1.0 1.8 3.50 661 468 A 57 VAL H A 52 CYS H 1.0 1.8 5.52 662 469 A 29 GLN HE21 A 30 ASP H 1.0 1.8 4.89 663 470 A 78 LYS H A 81 GLY H 1.0 1.8 5.02 664 471 A 80 LEU HA A 81 GLY H 1.0 1.8 3.54 665 472 A 52 CYS HA A 57 VAL H 1.0 1.8 2.90 666 473 A 57 VAL H A 58 PRO HDx 1.0 1.8 4.41 667 473 A 57 VAL H A 58 PRO HDy 1.0 1.8 4.41 668 474 A 57 VAL H A 52 CYS HB2 1.0 1.8 4.88 669 475 A 57 VAL H A 52 CYS HB3 1.0 1.8 5.70 670 476 A 29 GLN HE21 A 29 GLN HB3 1.0 1.8 3.93 671 477 A 29 GLN HE21 A 29 GLN HB2 1.0 1.8 4.49 672 478 A 57 VAL H A 55 GLN HBx 1.0 1.8 4.08 673 478 A 55 GLN HBy A 57 VAL H 1.0 1.8 4.08 674 479 A 81 GLY H A 80 LEU HBx 1.0 1.8 4.65 675 479 A 80 LEU HBy A 81 GLY H 1.0 1.8 4.65 676 480 A 82 MET H A 80 LEU HBx 1.0 1.8 4.83 677 480 A 80 LEU HBy A 82 MET H 1.0 1.8 4.83 678 481 A 81 GLY H A 80 LEU HG 1.0 1.8 4.66 679 482 A 30 ASP HA A 29 GLN HE21 1.0 1.8 5.93 680 483 A 92 GLN HA A 29 GLN HE21 1.0 1.8 6.00 681 484 A 74 ASN H A 72 ALA H 1.0 1.8 5.14 682 485 A 75 HIS HB2 A 74 ASN H 1.0 1.8 4.73 683 486 A 75 HIS HB3 A 74 ASN H 1.0 1.8 4.80 684 487 A 27 ILE H A 90 VAL H 1.0 1.8 4.41 685 488 A 27 ILE HA A 90 VAL H 1.0 1.8 5.24 686 489 A 64 PHE HA A 90 VAL H 1.0 1.8 5.08 687 490 A 90 VAL H A 28 GLY HAx 1.0 1.8 4.59 688 490 A 90 VAL H A 28 GLY HAy 1.0 1.8 4.59 689 491 A 75 HIS HE1 A 79 GLU HGx 1.0 1.8 4.48 690 491 A 79 GLU HGy A 75 HIS HE1 1.0 1.8 4.48 691 492 A 57 VAL H A 55 GLN H 1.0 1.8 4.22 692 493 A 75 HIS HA A 75 HIS HE1 1.0 1.8 5.46 693 494 A 53 GLN HA A 55 GLN H 1.0 1.8 5.21 694 495 A 52 CYS HA A 55 GLN H 1.0 1.8 3.96 695 496 A 75 HIS HB2 A 75 HIS HE1 1.0 1.8 4.88 696 497 A 55 GLN H A 54 ARG HDx 1.0 1.8 5.25 697 497 A 54 ARG HDy A 55 GLN H 1.0 1.8 5.25 698 498 A 55 GLN H A 55 GLN HGx 1.0 1.8 3.62 699 498 A 55 GLN HGy A 55 GLN H 1.0 1.8 3.62 700 499 A 55 GLN H A 55 GLN HBx 1.0 1.8 3.58 701 499 A 55 GLN HBy A 55 GLN H 1.0 1.8 3.58 702 500 A 80 LEU HG A 75 HIS HE1 1.0 1.8 6.00 703 501 A 59 MET H A 61 SER H 1.0 1.8 4.75 704 502 A 56 GLY H A 52 CYS H 1.0 1.8 5.57 705 503 A 55 GLN HE22 A 56 GLY H 1.0 1.8 5.66 706 504 A 61 SER HB2 A 61 SER H 1.0 1.8 3.54 707 505 A 61 SER H A 60 ASN HB2 1.0 1.8 4.33 708 506 A 61 SER H A 58 PRO HBx 1.0 1.8 4.21 709 506 A 58 PRO HBy A 61 SER H 1.0 1.8 4.21 710 507 A 61 SER H A 58 PRO HGx 1.0 1.8 3.92 711 507 A 61 SER H A 58 PRO HGy 1.0 1.8 3.92 712 508 A 56 GLY H A 54 ARG HBx 1.0 1.8 4.26 713 508 A 56 GLY H A 54 ARG HBy 1.0 1.8 4.26 714 509 A 56 GLY H A 55 GLN HBx 1.0 1.8 3.84 715 509 A 55 GLN HBy A 56 GLY H 1.0 1.8 3.84 716 510 A 69 GLN H A 67 GLU H 1.0 1.8 4.55 717 511 A 69 GLN H A 66 PHE H 1.0 1.8 3.68 718 512 A 50 SER H A 51 TYR H 1.0 1.8 3.73 719 513 A 79 GLU H A 81 GLY H 1.0 1.8 4.40 720 514 A 79 GLU H A 76 THR H 1.0 1.8 4.03 721 515 A 65 LEU HA A 69 GLN H 1.0 1.8 4.09 722 516 A 66 PHE HA A 69 GLN H 1.0 1.8 4.45 723 517 A 69 GLN H A 70 ARG HA 1.0 1.8 6.00 724 518 A 41 THR HA A 79 GLU H 1.0 1.8 6.00 725 519 A 47 LEU HA A 50 SER H 1.0 1.8 4.29 726 520 A 50 SER H A 49 GLU HG2 1.0 1.8 4.60 727 521 A 69 GLN H A 69 GLN HGx 1.0 1.8 3.28 728 521 A 69 GLN H A 69 GLN HGy 1.0 1.8 3.28 729 522 A 79 GLU HB2 A 79 GLU H 1.0 1.8 3.06 730 523 A 69 GLN H A 69 GLN HB2 1.0 1.8 3.11 731 524 A 79 GLU HB3 A 79 GLU H 1.0 1.8 3.49 732 525 A 79 GLU H A 78 LYS HB2 1.0 1.8 4.78 733 526 A 79 GLU H A 80 LEU HG 1.0 1.8 4.26 734 527 A 29 GLN HA A 31 SER H 1.0 1.8 3.62 735 528 A 31 SER HA A 31 SER H 1.0 1.8 2.75 736 529 A 30 ASP HB2 A 31 SER H 1.0 1.8 4.58 737 530 A 31 SER H A 30 ASP HB3 1.0 1.8 3.70 738 531 A 52 CYS H A 54 ARG H 1.0 1.8 4.45 739 532 A 53 GLN H A 54 ARG H 1.0 1.8 3.73 740 533 A 29 GLN HE21 A 31 SER H 1.0 1.8 5.88 741 534 A 57 VAL H A 54 ARG H 1.0 1.8 6.00 742 535 A 54 ARG H A 54 ARG HDx 1.0 1.8 4.63 743 535 A 54 ARG HDy A 54 ARG H 1.0 1.8 4.63 744 536 A 43 HIS HB3 A 43 HIS HE1 1.0 1.8 5.14 745 537 A 53 GLN HG3 A 54 ARG H 1.0 1.8 5.65 746 538 A 54 ARG H A 54 ARG HBx 1.0 1.8 3.31 747 538 A 54 ARG HBy A 54 ARG H 1.0 1.8 3.31 748 539 A 54 ARG H A 54 ARG HGx 1.0 1.8 4.02 749 539 A 54 ARG H A 54 ARG HGy 1.0 1.8 4.02 750 540 A 55 GLN H A 54 ARG H 1.0 1.8 3.61 751 541 A 34 ILE HD1% A 54 ARG H 1.0 1.8 4.17 752 542 A 78 LYS H A 76 THR HB 1.0 1.8 4.01 753 543 A 41 THR HA A 78 LYS H 1.0 1.8 4.33 754 544 A 32 SER H A 30 ASP HB3 1.0 1.8 4.61 755 545 A 78 LYS H A 78 LYS HB3 1.0 1.8 3.53 756 546 A 78 LYS H A 78 LYS HGx 1.0 1.8 3.67 757 546 A 78 LYS HGy A 78 LYS H 1.0 1.8 3.67 758 547 A 80 LEU HDx% A 78 LYS H 1.0 1.8 4.77 759 548 A 78 LYS H A 22 ILE HD1% 1.0 1.8 6.00 760 549 A 28 GLY H A 32 SER H 1.0 1.8 4.44 761 550 A 32 SER H A 30 ASP H 1.0 1.8 4.05 762 551 A 32 SER H A 33 GLU HA 1.0 1.8 5.46 763 552 A 30 ASP HA A 32 SER H 1.0 1.8 4.44 764 553 A 31 SER HA A 32 SER H 1.0 1.8 3.46 765 554 A 32 SER H A 32 SER HBy 1.0 1.8 4.16 766 555 A 78 LYS H A 77 PRO HDx 1.0 1.8 3.44 767 555 A 78 LYS H A 77 PRO HDy 1.0 1.8 3.44 768 556 A 32 SER H A 28 GLY HAx 1.0 1.8 4.83 769 556 A 32 SER H A 28 GLY HAy 1.0 1.8 4.83 770 557 A 24 LEU HA A 86 ASP H 1.0 1.8 4.30 771 558 A 84 GLU HA A 86 ASP H 1.0 1.8 3.77 772 559 A 86 ASP H A 86 ASP HBx 1.0 1.8 3.58 773 560 A 86 ASP H A 85 GLU HBx 1.0 1.8 3.97 774 560 A 85 GLU HBy A 86 ASP H 1.0 1.8 3.97 775 561 A 84 GLU HB2 A 86 ASP H 1.0 1.8 5.04 776 562 A 2 SER H A 1 MET HBx 1.0 1.8 3.95 777 562 A 2 SER H A 1 MET HBy 1.0 1.8 3.95 778 563 A 24 LEU HB2 A 86 ASP H 1.0 1.8 4.95 779 564 A 24 LEU HB3 A 86 ASP H 1.0 1.8 4.69 780 565 A 87 VAL H A 88 ILE H 1.0 1.8 4.63 781 566 A 14 GLY H A 15 ASP H 1.0 1.8 3.41 782 567 A 21 TYR HA A 20 GLU H 1.0 1.8 5.46 783 568 A 15 ASP H A 14 GLY HAx 1.0 1.8 3.23 784 568 A 15 ASP H A 14 GLY HAy 1.0 1.8 3.23 785 569 A 20 GLU H A 19 GLY HAx 1.0 1.8 3.34 786 569 A 19 GLY HAy A 20 GLU H 1.0 1.8 3.34 787 570 A 87 VAL H A 25 LYS HEx 1.0 1.8 5.59 788 570 A 25 LYS HEy A 87 VAL H 1.0 1.8 5.59 789 571 A 15 ASP H A 15 ASP HBx 1.0 1.8 3.30 790 571 A 15 ASP HBy A 15 ASP H 1.0 1.8 3.30 791 572 A 20 GLU H A 20 GLU HGx 1.0 1.8 3.66 792 572 A 20 GLU H A 20 GLU HGy 1.0 1.8 3.66 793 573 A 20 GLU H A 20 GLU HBx 1.0 1.8 3.30 794 573 A 20 GLU HBy A 20 GLU H 1.0 1.8 3.30 795 574 A 15 ASP H A 16 LYS H 1.0 1.8 3.17 796 575 A 10 THR H A 9 SER HBx 1.0 1.8 3.98 797 575 A 10 THR H A 9 SER HBy 1.0 1.8 3.98 798 576 A 6 ALA H A 5 GLU HBx 1.0 1.8 3.27 799 576 A 5 GLU HBy A 6 ALA H 1.0 1.8 3.27 800 577 A 53 GLN H A 51 TYR H 1.0 1.8 4.59 801 578 A 53 GLN H A 55 GLN H 1.0 1.8 4.58 802 579 A 53 GLN H A 51 TYR HA 1.0 1.8 4.44 803 580 A 53 GLN H A 52 CYS HB3 1.0 1.8 3.79 804 581 A 30 ASP H A 29 GLN HGx 1.0 1.8 3.78 805 581 A 29 GLN HGy A 30 ASP H 1.0 1.8 3.78 806 582 A 53 GLN HG3 A 53 GLN H 1.0 1.8 4.08 807 583 A 7 LYS H A 7 LYS HGx 1.0 1.8 3.63 808 583 A 7 LYS H A 7 LYS HGy 1.0 1.8 3.63 809 584 A 34 ILE HD1% A 53 GLN H 1.0 1.8 5.30 810 585 A 83 GLU H A 84 GLU H 1.0 1.8 4.44 811 586 A 28 GLY H A 30 ASP H 1.0 1.8 4.18 812 587 A 3 ASP H A 2 SER HA 1.0 1.8 3.46 813 588 A 30 ASP H A 28 GLY HAx 1.0 1.8 3.90 814 588 A 30 ASP H A 28 GLY HAy 1.0 1.8 3.90 815 589 A 30 ASP HB2 A 30 ASP H 1.0 1.8 3.53 816 590 A 84 GLU H A 83 GLU HBy 1.0 1.8 3.80 817 591 A 84 GLU HB3 A 84 GLU H 1.0 1.8 3.27 818 592 A 84 GLU H A 83 GLU HBx 1.0 1.8 3.80 819 593 A 16 LYS H A 16 LYS HDx 1.0 1.8 4.19 820 593 A 16 LYS H A 16 LYS HDy 1.0 1.8 4.19 821 594 A 22 ILE HB A 84 GLU H 1.0 1.8 4.60 822 595 A 17 LYS H A 16 LYS HA 1.0 1.8 2.96 823 596 A 21 TYR H A 20 GLU HA 1.0 1.8 3.10 824 597 A 3 ASP H A 2 SER HBx 1.0 1.8 3.82 825 597 A 3 ASP H A 2 SER HBy 1.0 1.8 3.82 826 598 A 16 LYS H A 15 ASP HBx 1.0 1.8 3.29 827 598 A 15 ASP HBy A 16 LYS H 1.0 1.8 3.29 828 599 A 16 LYS H A 16 LYS HBx 1.0 1.8 3.61 829 599 A 16 LYS HBy A 16 LYS H 1.0 1.8 3.61 830 600 A 17 LYS H A 17 LYS HBx 1.0 1.8 3.97 831 600 A 17 LYS H A 17 LYS HBy 1.0 1.8 3.97 832 601 A 13 LEU H A 13 LEU HBx 1.0 1.8 4.15 833 602 A 13 LEU H A 13 LEU HG 1.0 1.8 3.74 834 603 A 17 LYS H A 17 LYS HGx 1.0 1.8 3.97 835 603 A 17 LYS HGy A 17 LYS H 1.0 1.8 3.97 836 604 A 21 TYR H A 22 ILE H 1.0 1.8 4.47 837 605 A 95 THR H A 96 GLY HAx 1.0 1.8 4.77 838 605 A 95 THR H A 96 GLY HAy 1.0 1.8 4.77 839 606 A 95 THR H A 94 GLN HGx 1.0 1.8 4.18 840 606 A 94 GLN HGy A 95 THR H 1.0 1.8 4.18 841 607 A 59 MET H A 60 ASN H 1.0 1.8 3.64 842 608 A 60 ASN H A 60 ASN HD21 1.0 1.8 4.53 843 609 A 62 LEU HA A 93 GLU H 1.0 1.8 3.56 844 610 A 92 GLN HA A 93 GLU H 1.0 1.8 2.91 845 611 A 61 SER HB2 A 60 ASN H 1.0 1.8 4.74 846 612 A 60 ASN HB2 A 60 ASN H 1.0 1.8 3.55 847 613 A 60 ASN H A 58 PRO HBx 1.0 1.8 3.73 848 613 A 58 PRO HBy A 60 ASN H 1.0 1.8 3.73 849 614 A 93 GLU H A 92 GLN HGx 1.0 1.8 4.24 850 614 A 93 GLU H A 92 GLN HGy 1.0 1.8 4.24 851 615 A 60 ASN H A 59 MET HBx 1.0 1.8 3.32 852 615 A 59 MET HBy A 60 ASN H 1.0 1.8 3.32 853 616 A 93 GLU H A 62 LEU HB3 1.0 1.8 4.14 854 617 A 14 GLY H A 13 LEU HG 1.0 1.8 4.78 855 618 A 28 GLY H A 27 ILE H 1.0 1.8 4.49 856 619 A 50 SER H A 49 GLU H 1.0 1.8 3.74 857 620 A 49 GLU H A 46 LYS HA 1.0 1.8 3.99 858 621 A 49 GLU H A 59 MET HGx 1.0 1.8 5.14 859 621 A 49 GLU H A 59 MET HGy 1.0 1.8 5.14 860 622 A 18 GLU H A 18 GLU HBx 1.0 1.8 2.96 861 622 A 18 GLU HBy A 18 GLU H 1.0 1.8 2.96 862 623 A 49 GLU H A 45 LYS HDx 1.0 1.8 4.22 863 623 A 49 GLU H A 45 LYS HDy 1.0 1.8 4.22 864 624 A 47 LEU HG A 49 GLU H 1.0 1.8 5.66 865 625 A 49 GLU H A 48 LYS HGx 1.0 1.8 4.62 866 625 A 49 GLU H A 48 LYS HGy 1.0 1.8 4.62 867 626 A 49 GLU H A 51 TYR H 1.0 1.8 4.63 868 627 A 18 GLU H A 18 GLU HGx 1.0 1.8 3.28 869 627 A 18 GLU H A 18 GLU HGy 1.0 1.8 3.28 870 628 A 49 GLU H A 49 GLU HBx 1.0 1.8 2.93 871 628 A 49 GLU HBy A 49 GLU H 1.0 1.8 2.93 872 629 A 18 GLU H A 17 LYS HBx 1.0 1.8 3.64 873 629 A 18 GLU H A 17 LYS HBy 1.0 1.8 3.64 874 630 A 18 GLU H A 17 LYS HDx 1.0 1.8 4.16 875 630 A 17 LYS HDy A 18 GLU H 1.0 1.8 4.16 876 631 A 95 THR HG2% A 96 GLY H 1.0 1.8 4.27 877 632 A 91 TYR H A 29 GLN H 1.0 1.8 5.84 878 633 A 65 LEU H A 91 TYR H 1.0 1.8 4.59 879 634 A 44 LEU H A 45 LYS H 1.0 1.8 4.24 880 635 A 91 TYR H A 90 VAL H 1.0 1.8 4.43 881 636 A 46 LYS H A 45 LYS H 1.0 1.8 4.09 882 637 A 91 TYR HB2 A 91 TYR H 1.0 1.8 3.84 883 638 A 45 LYS H A 45 LYS HEx 1.0 1.8 4.72 884 638 A 45 LYS HEy A 45 LYS H 1.0 1.8 4.72 885 639 A 40 MET H A 40 MET HGx 1.0 1.8 4.40 886 639 A 40 MET H A 40 MET HGy 1.0 1.8 4.40 887 640 A 45 LYS H A 73 ASP HBx 1.0 1.8 4.77 888 640 A 73 ASP HBy A 45 LYS H 1.0 1.8 4.77 889 641 A 44 LEU HG A 45 LYS H 1.0 1.8 4.76 890 642 A 45 LYS HB3 A 45 LYS H 1.0 1.8 3.59 891 643 A 91 TYR H A 62 LEU HB2 1.0 1.8 4.12 892 644 A 45 LYS H A 45 LYS HG2 1.0 1.8 4.26 893 645 A 76 THR HG2% A 45 LYS H 1.0 1.8 5.98 894 646 A 38 VAL HGx% A 39 LYS H 1.0 1.8 4.18 895 647 A 62 LEU HB3 A 91 TYR H 1.0 1.8 5.16 896 648 A 47 LEU HG A 45 LYS H 1.0 1.8 5.39 897 649 A 23 LYS H A 85 GLU H 1.0 1.8 4.20 898 650 A 25 LYS H A 86 ASP H 1.0 1.8 4.48 899 651 A 25 LYS H A 36 PHE HE2 1.0 1.8 5.25 900 652 A 25 LYS H A 35 HIS HA 1.0 1.8 4.97 901 653 A 25 LYS H A 24 LEU HA 1.0 1.8 2.97 902 654 A 23 LYS H A 22 ILE HA 1.0 1.8 3.22 903 655 A 9 SER H A 8 PRO HDx 1.0 1.8 5.43 904 656 A 33 GLU H A 33 GLU HGx 1.0 1.8 4.36 905 656 A 33 GLU H A 33 GLU HGy 1.0 1.8 4.36 906 657 A 9 SER H A 8 PRO HB3 1.0 1.8 3.98 907 658 A 25 LYS H A 24 LEU HB2 1.0 1.8 3.59 908 659 A 25 LYS H A 25 LYS HB3 1.0 1.8 3.84 909 660 A 25 LYS H A 24 LEU HB3 1.0 1.8 3.63 910 661 A 25 LYS H A 87 VAL HGx% 1.0 1.8 5.10 911 661 A 25 LYS H A 87 VAL HGy% 1.0 1.8 5.10 912 662 A 33 GLU H A 27 ILE HG1x 1.0 1.8 5.54 913 662 A 33 GLU H A 27 ILE HG1y 1.0 1.8 5.54 914 663 A 25 LYS H A 26 VAL HGx% 1.0 1.8 3.65 915 664 A 23 LYS H A 24 LEU HG 1.0 1.8 4.71 916 665 A 25 LYS H A 24 LEU HG 1.0 1.8 5.18 917 666 A 9 SER H A 10 THR HA 1.0 1.8 5.45 918 667 A 33 GLU H A 34 ILE HA 1.0 1.8 5.79 919 668 A 9 SER H A 8 PRO HGx 1.0 1.8 3.80 920 668 A 9 SER H A 8 PRO HGy 1.0 1.8 3.80 921 669 A 55 GLN H A 52 CYS H 1.0 1.8 5.22 922 670 A 27 ILE HA A 34 ILE H 1.0 1.8 4.18 923 671 A 34 ILE H A 25 LYS HA 1.0 1.8 4.45 924 672 A 52 CYS H A 52 CYS HB2 1.0 1.8 3.64 925 673 A 52 CYS H A 52 CYS HB3 1.0 1.8 3.60 926 674 A 51 TYR HB3 A 52 CYS H 1.0 1.8 3.40 927 675 A 53 GLN HG2 A 52 CYS H 1.0 1.8 4.93 928 676 A 53 GLN HG3 A 52 CYS H 1.0 1.8 5.68 929 677 A 52 CYS H A 59 MET HBx 1.0 1.8 4.68 930 677 A 52 CYS H A 59 MET HBy 1.0 1.8 4.68 931 678 A 59 MET HE% A 52 CYS H 1.0 1.8 5.13 932 679 A 34 ILE H A 33 GLU HB2 1.0 1.8 3.99 933 680 A 33 GLU HB3 A 34 ILE H 1.0 1.8 4.29 934 681 A 52 CYS H A 55 GLN HBx 1.0 1.8 5.11 935 681 A 55 GLN HBy A 52 CYS H 1.0 1.8 5.11 936 682 A 34 ILE H A 27 ILE HG1x 1.0 1.8 4.58 937 682 A 34 ILE H A 27 ILE HG1y 1.0 1.8 4.58 938 683 A 26 VAL HGy% A 34 ILE H 1.0 1.8 4.32 939 684 A 35 HIS H A 35 HIS HB3 1.0 1.8 3.83 940 685 A 35 HIS H A 35 HIS HB2 1.0 1.8 3.39 941 686 A 35 HIS H A 25 LYS HG2 1.0 1.8 5.59 942 687 A 73 ASP H A 72 ALA H 1.0 1.8 4.70 943 688 A 71 ILE H A 73 ASP H 1.0 1.8 5.97 944 689 A 73 ASP H A 74 ASN H 1.0 1.8 3.82 945 690 A 73 ASP H A 75 HIS H 1.0 1.8 4.64 946 691 A 73 ASP H A 74 ASN HA 1.0 1.8 6.00 947 692 A 94 GLN H A 95 THR HA 1.0 1.8 6.00 948 693 A 73 ASP H A 73 ASP HBx 1.0 1.8 3.55 949 693 A 73 ASP H A 73 ASP HBy 1.0 1.8 3.55 950 694 A 29 GLN H A 29 GLN HB3 1.0 1.8 3.37 951 695 A 94 GLN H A 93 GLU HGx 1.0 1.8 3.30 952 695 A 94 GLN H A 93 GLU HGy 1.0 1.8 3.30 953 696 A 62 LEU HB3 A 29 GLN H 1.0 1.8 5.28 954 697 A 62 LEU HA A 94 GLN H 1.0 1.8 6.00 955 698 A 94 GLN H A 94 GLN HBy 1.0 1.8 3.61 956 699 A 94 GLN H A 93 GLU HB2 1.0 1.8 4.05 957 700 A 44 LEU H A 43 HIS H 1.0 1.8 4.61 958 701 A 42 THR H A 43 HIS H 1.0 1.8 4.55 959 702 A 69 GLN HB3 A 70 ARG H 1.0 1.8 3.53 960 703 A 70 ARG H A 70 ARG HGx 1.0 1.8 3.96 961 703 A 70 ARG H A 70 ARG HGy 1.0 1.8 3.96 962 704 A 52 CYS H A 51 TYR H 1.0 1.8 3.71 963 705 A 51 TYR H A 50 SER HBx 1.0 1.8 3.35 964 705 A 50 SER HBy A 51 TYR H 1.0 1.8 3.35 965 706 A 47 LEU HA A 51 TYR H 1.0 1.8 4.48 966 707 A 48 LYS HA A 51 TYR H 1.0 1.8 4.03 967 708 A 49 GLU HG2 A 51 TYR H 1.0 1.8 6.00 968 709 A 64 PHE HB3 A 89 GLU H 1.0 1.8 6.00 969 710 A 80 LEU HDy% A 70 ARG H 1.0 1.8 4.52 970 711 A 68 GLY H A 67 GLU H 1.0 1.8 3.60 971 712 A 89 GLU H A 88 ILE H 1.0 1.8 4.55 972 713 A 27 ILE H A 89 GLU H 1.0 1.8 5.25 973 714 A 68 GLY H A 66 PHE H 1.0 1.8 3.93 974 715 A 90 VAL H A 89 GLU H 1.0 1.8 4.44 975 716 A 65 LEU HA A 68 GLY H 1.0 1.8 5.76 976 717 A 65 LEU HA A 89 GLU H 1.0 1.8 6.00 977 718 A 66 PHE HA A 89 GLU H 1.0 1.8 3.96 978 719 A 26 VAL HA A 89 GLU H 1.0 1.8 5.31 979 720 A 64 PHE HA A 89 GLU H 1.0 1.8 5.22 980 721 A 68 GLY H A 67 GLU HA 1.0 1.8 3.29 981 722 A 51 TYR H A 59 MET HGx 1.0 1.8 4.80 982 722 A 59 MET HGy A 51 TYR H 1.0 1.8 4.80 983 723 A 89 GLU HG2 A 89 GLU H 1.0 1.8 3.91 984 724 A 65 LEU HB2 A 89 GLU H 1.0 1.8 4.89 985 725 A 65 LEU HB3 A 68 GLY H 1.0 1.8 3.57 986 726 A 68 GLY H A 67 GLU HG2 1.0 1.8 4.66 987 727 A 89 GLU H A 87 VAL HGx% 1.0 1.8 4.90 988 727 A 87 VAL HGy% A 89 GLU H 1.0 1.8 4.90 989 728 A 65 LEU H A 64 PHE H 1.0 1.8 4.61 990 729 A 91 TYR H A 64 PHE H 1.0 1.8 5.15 991 730 A 64 PHE HB2 A 64 PHE H 1.0 1.8 3.89 992 731 A 64 PHE HB3 A 64 PHE H 1.0 1.8 3.93 993 732 A 36 PHE H A 24 LEU H 1.0 1.8 3.98 994 733 A 24 LEU H A 23 LYS HEx 1.0 1.8 5.62 995 733 A 23 LYS HEy A 24 LEU H 1.0 1.8 5.62 996 734 A 24 LEU HB3 A 24 LEU H 1.0 1.8 4.11 997 735 A 65 LEU H A 66 PHE H 1.0 1.8 4.52 998 736 A 24 LEU H A 23 LYS HA 1.0 1.8 3.56 999 737 A 65 LEU HB3 A 66 PHE H 1.0 1.8 3.79 1000 738 A 92 GLN H A 63 ARG H 1.0 1.8 4.93 1001 739 A 62 LEU H A 63 ARG H 1.0 1.8 4.52 1002 740 A 90 VAL HA A 63 ARG H 1.0 1.8 4.61 1003 741 A 59 MET H A 58 PRO HDx 1.0 1.8 5.10 1004 741 A 59 MET H A 58 PRO HDy 1.0 1.8 5.10 1005 742 A 59 MET H A 52 CYS HB3 1.0 1.8 5.11 1006 743 A 91 TYR HB2 A 63 ARG H 1.0 1.8 5.47 1007 744 A 59 MET H A 58 PRO HBx 1.0 1.8 3.62 1008 744 A 59 MET H A 58 PRO HBy 1.0 1.8 3.62 1009 745 A 66 PHE H A 69 GLN HGx 1.0 1.8 4.22 1010 745 A 66 PHE H A 69 GLN HGy 1.0 1.8 4.22 1011 746 A 88 ILE HG2% A 66 PHE H 1.0 1.8 4.25 1012 747 A 62 LEU HB3 A 63 ARG H 1.0 1.8 3.71 1013 748 A 71 ILE H A 71 ILE HG1x 1.0 1.8 3.86 1014 748 A 71 ILE H A 71 ILE HG1y 1.0 1.8 3.86 1015 749 A 71 ILE H A 70 ARG HBx 1.0 1.8 3.97 1016 749 A 71 ILE H A 70 ARG HBy 1.0 1.8 3.97 1017 750 A 27 ILE H A 33 GLU HB2 1.0 1.8 5.61 1018 751 A 27 ILE H A 89 GLU HBx 1.0 1.8 6.00 1019 751 A 27 ILE H A 89 GLU HBy 1.0 1.8 6.00 1020 752 A 27 ILE H A 27 ILE HG1x 1.0 1.8 3.95 1021 752 A 27 ILE H A 27 ILE HG1y 1.0 1.8 3.95 1022 753 A 36 PHE H A 36 PHE HB3 1.0 1.8 3.86 1023 754 A 26 VAL H A 26 VAL HB 1.0 1.8 4.08 1024 755 A 38 VAL H A 24 LEU H 1.0 1.8 4.37 1025 756 A 25 LYS H A 88 ILE H 1.0 1.8 4.15 1026 757 A 21 TYR HA A 22 ILE H 1.0 1.8 3.34 1027 758 A 84 GLU HA A 22 ILE H 1.0 1.8 5.98 1028 759 A 22 ILE H A 21 TYR HB2 1.0 1.8 4.13 1029 760 A 21 TYR HB3 A 22 ILE H 1.0 1.8 3.93 1030 761 A 22 ILE H A 20 GLU HBx 1.0 1.8 6.00 1031 761 A 20 GLU HBy A 22 ILE H 1.0 1.8 6.00 1032 762 A 40 MET HE% A 22 ILE H 1.0 1.8 6.00 1033 763 A 88 ILE H A 25 LYS HDx 1.0 1.8 4.02 1034 763 A 25 LYS HDy A 88 ILE H 1.0 1.8 4.02 1035 764 A 83 GLU H A 82 MET HA 1.0 1.8 3.34 1036 765 A 83 GLU H A 86 ASP HBx 1.0 1.8 4.72 1037 766 A 83 GLU H A 83 GLU HGx 1.0 1.8 4.24 1038 766 A 83 GLU H A 83 GLU HGy 1.0 1.8 4.24 1039 767 A 83 GLU H A 83 GLU HBy 1.0 1.8 3.93 1040 768 A 44 LEU H A 76 THR HA 1.0 1.8 4.27 1041 769 A 24 LEU HA A 85 GLU H 1.0 1.8 4.70 1042 770 A 85 GLU H A 86 ASP HA 1.0 1.8 5.50 1043 771 A 75 HIS HB2 A 44 LEU H 1.0 1.8 6.00 1044 772 A 85 GLU H A 23 LYS HEx 1.0 1.8 4.90 1045 772 A 23 LYS HEy A 85 GLU H 1.0 1.8 4.90 1046 773 A 85 GLU H A 85 GLU HBx 1.0 1.8 3.61 1047 773 A 85 GLU HBy A 85 GLU H 1.0 1.8 3.61 1048 774 A 44 LEU H A 42 THR HG2% 1.0 1.8 4.54 1049 775 A 85 GLU H A 23 LYS HGx 1.0 1.8 4.14 1050 775 A 85 GLU H A 23 LYS HGy 1.0 1.8 4.14 1051 776 A 85 GLU H A 24 LEU HG 1.0 1.8 4.65 1052 777 A 66 PHE H A 67 GLU H 1.0 1.8 4.52 1053 778 A 66 PHE HD% A 67 GLU H 1.0 1.8 3.72 1054 779 A 68 GLY HA2 A 67 GLU H 1.0 1.8 5.45 1055 780 A 66 PHE HB3 A 67 GLU H 1.0 1.8 4.68 1056 781 A 67 GLU H A 67 GLU HB2 1.0 1.8 4.12 1057 782 A 88 ILE HG2% A 67 GLU H 1.0 1.8 4.90 1058 783 A 65 LEU H A 89 GLU HA 1.0 1.8 5.09 1059 784 A 65 LEU H A 64 PHE HB2 1.0 1.8 4.52 1060 785 A 65 LEU H A 64 PHE HB3 1.0 1.8 4.30 1061 786 A 65 LEU H A 89 GLU HBx 1.0 1.8 4.43 1062 786 A 65 LEU H A 89 GLU HBy 1.0 1.8 4.43 1063 787 A 65 LEU H A 65 LEU HB3 1.0 1.8 3.94 1064 788 A 91 TYR HE% A 65 LEU H 1.0 1.8 4.32 1065 789 A 91 TYR HE% A 65 LEU HA 1.0 1.8 5.29 1066 790 A 59 MET HE% A 51 TYR HE1 1.0 1.8 4.71 1067 791 A 91 TYR HE% A 89 GLU HBx 1.0 1.8 2.99 1068 791 A 91 TYR HE% A 89 GLU HBy 1.0 1.8 2.99 1069 792 A 91 TYR HE% A 65 LEU HB2 1.0 1.8 3.12 1070 793 A 91 TYR HE% A 65 LEU HB3 1.0 1.8 3.70 1071 794 A 51 TYR HE1 A 27 ILE HG1x 1.0 1.8 5.33 1072 794 A 51 TYR HE1 A 27 ILE HG1y 1.0 1.8 5.33 1073 795 A 59 MET H A 60 ASN HD22 1.0 1.8 4.50 1074 796 A 60 ASN HD22 A 60 ASN HA 1.0 1.8 3.96 1075 797 A 92 GLN HE22 A 61 SER HA 1.0 1.8 4.63 1076 798 A 92 GLN HA A 92 GLN HE22 1.0 1.8 5.24 1077 799 A 55 GLN HE22 A 51 TYR HA 1.0 1.8 3.86 1078 800 A 55 GLN HE22 A 51 TYR HB2 1.0 1.8 4.73 1079 801 A 60 ASN HB2 A 60 ASN HD22 1.0 1.8 3.80 1080 802 A 92 GLN HE22 A 92 GLN HGx 1.0 1.8 3.67 1081 802 A 92 GLN HGy A 92 GLN HE22 1.0 1.8 3.67 1082 803 A 53 GLN HE2x A 53 GLN HBx 1.0 1.8 4.27 1083 803 A 53 GLN HBy A 53 GLN HE2x 1.0 1.8 4.27 1084 804 A 21 TYR H A 21 TYR HD% 1.0 1.8 3.51 1085 805 A 93 GLU H A 92 GLN HE22 1.0 1.8 3.91 1086 806 A 21 TYR HA A 21 TYR HD% 1.0 1.8 3.68 1087 807 A 92 GLN HE22 A 61 SER HB3 1.0 1.8 5.55 1088 808 A 55 GLN HE22 A 54 ARG HBx 1.0 1.8 3.67 1089 808 A 55 GLN HE22 A 54 ARG HBy 1.0 1.8 3.67 1090 809 A 55 GLN HE22 A 54 ARG HGx 1.0 1.8 3.76 1091 809 A 55 GLN HE22 A 54 ARG HGy 1.0 1.8 3.76 1092 810 A 55 GLN HE22 A 55 GLN HBx 1.0 1.8 3.63 1093 810 A 55 GLN HE22 A 55 GLN HBy 1.0 1.8 3.63 1094 811 A 65 LEU H A 91 TYR HD% 1.0 1.8 4.43 1095 812 A 63 ARG H A 91 TYR HD% 1.0 1.8 5.08 1096 813 A 91 TYR H A 91 TYR HD% 1.0 1.8 3.48 1097 814 A 90 VAL H A 91 TYR HD% 1.0 1.8 4.72 1098 815 A 65 LEU HA A 91 TYR HD% 1.0 1.8 5.30 1099 816 A 90 VAL HA A 91 TYR HD% 1.0 1.8 3.77 1100 817 A 74 ASN HA A 43 HIS HD2 1.0 1.8 3.51 1101 818 A 39 LYS HA A 21 TYR HD% 1.0 1.8 4.55 1102 819 A 21 TYR HD% A 39 LYS HEx 1.0 1.8 4.36 1103 819 A 39 LYS HEy A 21 TYR HD% 1.0 1.8 4.36 1104 820 A 65 LEU HB2 A 91 TYR HD% 1.0 1.8 3.88 1105 821 A 21 TYR HD% A 39 LYS HDx 1.0 1.8 4.72 1106 821 A 39 LYS HDy A 21 TYR HD% 1.0 1.8 4.72 1107 822 A 65 LEU HG A 91 TYR HD% 1.0 1.8 3.40 1108 823 A 65 LEU HB3 A 91 TYR HD% 1.0 1.8 4.48 1109 824 A 29 GLN HE22 A 30 ASP H 1.0 1.8 5.23 1110 825 A 29 GLN HE22 A 30 ASP HB2 1.0 1.8 3.76 1111 826 A 69 GLN HE22 A 69 GLN HGx 1.0 1.8 3.45 1112 826 A 69 GLN HE22 A 69 GLN HGy 1.0 1.8 3.45 1113 827 A 69 GLN HB3 A 69 GLN HE22 1.0 1.8 4.52 1114 828 A 29 GLN HE22 A 29 GLN H 1.0 1.8 4.69 1115 829 A 29 GLN HE22 A 31 SER H 1.0 1.8 6.00 1116 830 A 92 GLN HE21 A 92 GLN HGx 1.0 1.8 3.46 1117 830 A 92 GLN HGy A 92 GLN HE21 1.0 1.8 3.46 1118 831 A 71 ILE H A 72 ALA H 1.0 1.8 4.66 1119 832 A 75 HIS H A 72 ALA H 1.0 1.8 4.40 1120 833 A 75 HIS HA A 72 ALA H 1.0 1.8 5.68 1121 834 A 75 HIS HB2 A 72 ALA H 1.0 1.8 4.49 1122 835 A 75 HIS HB3 A 72 ALA H 1.0 1.8 5.16 1123 836 A 72 ALA H A 71 ILE HG1x 1.0 1.8 4.49 1124 836 A 72 ALA H A 71 ILE HG1y 1.0 1.8 4.49 1125 837 A 72 ALA H A 70 ARG HGx 1.0 1.8 5.36 1126 837 A 72 ALA H A 70 ARG HGy 1.0 1.8 5.36 1127 838 A 44 LEU H A 43 HIS HD2 1.0 1.8 4.21 1128 839 A 51 TYR HD% A 52 CYS H 1.0 1.8 3.69 1129 840 A 51 TYR HD% A 54 ARG H 1.0 1.8 4.91 1130 841 A 51 TYR HD% A 55 GLN H 1.0 1.8 4.41 1131 842 A 51 TYR HD% A 55 GLN HE22 1.0 1.8 3.80 1132 843 A 51 TYR HD% A 33 GLU HA 1.0 1.8 5.29 1133 844 A 51 TYR HD% A 59 MET HA 1.0 1.8 5.47 1134 845 A 51 TYR HD% A 34 ILE HA 1.0 1.8 5.71 1135 846 A 51 TYR HD% A 52 CYS HA 1.0 1.8 3.63 1136 847 A 51 TYR HD% A 54 ARG HBx 1.0 1.8 4.76 1137 847 A 51 TYR HD% A 54 ARG HBy 1.0 1.8 4.76 1138 848 A 51 TYR HD% A 57 VAL HGy% 1.0 1.8 3.09 1139 849 A 51 TYR HD% A 34 ILE HG2% 1.0 1.8 3.06 1140 850 A 26 VAL HGy% A 51 TYR HD% 1.0 1.8 3.32 1141 851 A 51 TYR HD% A 48 LYS HGx 1.0 1.8 6.00 1142 851 A 51 TYR HD% A 48 LYS HGy 1.0 1.8 6.00 1143 852 A 51 TYR HE1 A 26 VAL H 1.0 1.8 5.08 1144 853 A 27 ILE H A 51 TYR HE1 1.0 1.8 5.49 1145 854 A 51 TYR HE1 A 34 ILE H 1.0 1.8 3.97 1146 855 A 51 TYR HE1 A 33 GLU HA 1.0 1.8 4.45 1147 856 A 27 ILE HA A 51 TYR HE1 1.0 1.8 4.52 1148 857 A 74 ASN HD22 A 74 ASN HA 1.0 1.8 5.04 1149 858 A 51 TYR HE1 A 28 GLY HAx 1.0 1.8 4.82 1150 858 A 51 TYR HE1 A 28 GLY HAy 1.0 1.8 4.82 1151 859 A 26 VAL HGy% A 51 TYR HE1 1.0 1.8 3.27 1152 860 A 36 PHE H A 36 PHE HD% 1.0 1.8 3.43 1153 861 A 24 LEU H A 36 PHE HD% 1.0 1.8 4.71 1154 862 A 35 HIS HD2 A 36 PHE HD% 1.0 1.8 6.00 1155 863 A 47 LEU H A 36 PHE HD% 1.0 1.8 6.00 1156 864 A 35 HIS HA A 36 PHE HD% 1.0 1.8 3.89 1157 865 A 36 PHE HD% A 23 LYS HA 1.0 1.8 4.92 1158 866 A 36 PHE HD% A 36 PHE HA 1.0 1.8 4.72 1159 867 A 25 LYS HA A 36 PHE HD% 1.0 1.8 4.73 1160 868 A 47 LEU HA A 36 PHE HD% 1.0 1.8 4.30 1161 869 A 51 TYR HB2 A 36 PHE HD% 1.0 1.8 5.86 1162 870 A 24 LEU HB2 A 36 PHE HE2 1.0 1.8 4.03 1163 871 A 38 VAL HGx% A 36 PHE HD% 1.0 1.8 2.90 1164 872 A 34 ILE HG2% A 36 PHE HD% 1.0 1.8 3.43 1165 873 A 66 PHE HD% A 89 GLU H 1.0 1.8 4.63 1166 874 A 66 PHE HD% A 87 VAL H 1.0 1.8 4.66 1167 875 A 66 PHE HD% A 66 PHE HA 1.0 1.8 3.32 1168 876 A 80 LEU HA A 66 PHE HD% 1.0 1.8 4.22 1169 877 A 66 PHE HD% A 82 MET HGx 1.0 1.8 4.95 1170 877 A 66 PHE HD% A 82 MET HGy 1.0 1.8 4.95 1171 878 A 66 PHE HD% A 82 MET HE% 1.0 1.8 5.43 1172 879 A 66 PHE HD% A 71 ILE HG1x 1.0 1.8 4.76 1173 879 A 66 PHE HD% A 71 ILE HG1y 1.0 1.8 4.76 1174 880 A 66 PHE HD% A 67 GLU HB2 1.0 1.8 4.97 1175 881 A 66 PHE HD% A 80 LEU HBx 1.0 1.8 4.08 1176 881 A 80 LEU HBy A 66 PHE HD% 1.0 1.8 4.08 1177 882 A 66 PHE HD% A 67 GLU HB3 1.0 1.8 3.82 1178 883 A 66 PHE HD% A 67 GLU HG2 1.0 1.8 4.10 1179 884 A 66 PHE HD% A 87 VAL HGx% 1.0 1.8 4.25 1180 884 A 66 PHE HD% A 87 VAL HGy% 1.0 1.8 4.25 1181 885 A 71 ILE HD1% A 66 PHE HD% 1.0 1.8 3.74 1182 886 A 88 ILE HD1% A 66 PHE HD% 1.0 1.8 4.11 1183 887 A 90 VAL HGy% A 65 LEU H 1.0 1.8 4.26 1184 888 A 90 VAL HGy% A 27 ILE H 1.0 1.8 4.12 1185 889 A 90 VAL HGy% A 64 PHE H 1.0 1.8 4.71 1186 890 A 90 VAL HGy% A 89 GLU H 1.0 1.8 4.53 1187 891 A 90 VAL HGy% A 91 TYR H 1.0 1.8 4.08 1188 892 A 90 VAL HGy% A 64 PHE HD% 1.0 1.8 4.30 1189 893 A 90 VAL HGy% A 51 TYR HE2 1.0 1.8 5.91 1190 894 A 90 VAL HGy% A 26 VAL HA 1.0 1.8 4.89 1191 895 A 90 VAL HGy% A 27 ILE HA 1.0 1.8 5.19 1192 896 A 90 VAL HGy% A 64 PHE HA 1.0 1.8 3.73 1193 897 A 90 VAL HGy% A 90 VAL HA 1.0 1.8 3.45 1194 898 A 90 VAL HGy% A 28 GLY HAx 1.0 1.8 4.12 1195 898 A 90 VAL HGy% A 28 GLY HAy 1.0 1.8 4.12 1196 899 A 90 VAL HGy% A 64 PHE HB3 1.0 1.8 4.22 1197 900 A 90 VAL HGy% A 26 VAL HB 1.0 1.8 4.13 1198 901 A 90 VAL HGy% A 59 MET HE% 1.0 1.8 4.51 1199 902 A 90 VAL HGy% A 89 GLU HBx 1.0 1.8 4.68 1200 902 A 90 VAL HGy% A 89 GLU HBy 1.0 1.8 4.68 1201 903 A 90 VAL HGy% A 88 ILE HB 1.0 1.8 4.32 1202 904 A 90 VAL HGy% A 62 LEU HB2 1.0 1.8 4.51 1203 905 A 90 VAL HGy% A 27 ILE HG1x 1.0 1.8 6.00 1204 905 A 90 VAL HGy% A 27 ILE HG1y 1.0 1.8 6.00 1205 906 A 90 VAL HGy% A 87 VAL HGx% 1.0 1.8 6.00 1206 906 A 90 VAL HGy% A 87 VAL HGy% 1.0 1.8 6.00 1207 907 A 90 VAL HGy% A 62 LEU HDx% 1.0 1.8 3.46 1208 907 A 90 VAL HGy% A 62 LEU HDy% 1.0 1.8 3.46 1209 908 A 90 VAL HGy% A 26 VAL HGy% 1.0 1.8 2.83 1210 909 A 90 VAL HGx% A 63 ARG H 1.0 1.8 3.85 1211 910 A 90 VAL HGx% A 29 GLN H 1.0 1.8 4.00 1212 911 A 90 VAL HGx% A 91 TYR H 1.0 1.8 3.44 1213 912 A 90 VAL HGx% A 93 GLU H 1.0 1.8 5.55 1214 913 A 90 VAL HGx% A 30 ASP H 1.0 1.8 4.94 1215 914 A 47 LEU HDy% A 48 LYS H 1.0 1.8 3.78 1216 915 A 90 VAL HGx% A 64 PHE HD% 1.0 1.8 4.23 1217 916 A 90 VAL HGx% A 64 PHE HE1 1.0 1.8 4.40 1218 917 A 90 VAL HGx% A 29 GLN HE22 1.0 1.8 4.34 1219 918 A 47 LEU HDy% A 47 LEU H 1.0 1.8 3.78 1220 919 A 90 VAL HGx% A 62 LEU HA 1.0 1.8 4.09 1221 920 A 90 VAL HGx% A 28 GLY HAx 1.0 1.8 3.37 1222 920 A 90 VAL HGx% A 28 GLY HAy 1.0 1.8 3.37 1223 921 A 47 LEU HDy% A 45 LYS HA 1.0 1.8 4.99 1224 922 A 90 VAL HGx% A 63 ARG HDx 1.0 1.8 4.45 1225 922 A 90 VAL HGx% A 63 ARG HDy 1.0 1.8 4.45 1226 923 A 47 LEU HDy% A 36 PHE HB3 1.0 1.8 5.30 1227 924 A 47 LEU HDy% A 44 LEU HBx 1.0 1.8 3.78 1228 924 A 47 LEU HDy% A 44 LEU HBy 1.0 1.8 3.78 1229 925 A 90 VAL HGx% A 62 LEU HB2 1.0 1.8 3.45 1230 926 A 47 LEU HDy% A 48 LYS HDx 1.0 1.8 3.37 1231 926 A 47 LEU HDy% A 48 LYS HDy 1.0 1.8 3.37 1232 927 A 90 VAL HGx% A 62 LEU HG 1.0 1.8 2.72 1233 928 A 90 VAL HGx% A 62 LEU HB3 1.0 1.8 3.18 1234 929 A 47 LEU HDy% A 44 LEU HDx% 1.0 1.8 2.86 1235 929 A 47 LEU HDy% A 44 LEU HDy% 1.0 1.8 2.86 1236 930 A 90 VAL HGx% A 62 LEU HDx% 1.0 1.8 3.17 1237 930 A 90 VAL HGx% A 62 LEU HDy% 1.0 1.8 3.17 1238 931 A 47 LEU HG A 44 LEU H 1.0 1.8 6.00 1239 932 A 80 LEU HDy% A 66 PHE H 1.0 1.8 4.54 1240 933 A 69 GLN H A 80 LEU HDy% 1.0 1.8 5.09 1241 934 A 47 LEU HG A 48 LYS H 1.0 1.8 4.01 1242 935 A 66 PHE HD% A 80 LEU HDy% 1.0 1.8 3.62 1243 936 A 66 PHE HE% A 80 LEU HDy% 1.0 1.8 4.52 1244 937 A 76 THR H A 80 LEU HDy% 1.0 1.8 4.96 1245 938 A 47 LEU HG A 47 LEU H 1.0 1.8 3.83 1246 939 A 65 LEU HA A 80 LEU HDy% 1.0 1.8 5.32 1247 940 A 80 LEU HDy% A 69 GLN HA 1.0 1.8 5.07 1248 941 A 71 ILE HA A 80 LEU HDy% 1.0 1.8 4.25 1249 942 A 75 HIS HB2 A 80 LEU HDy% 1.0 1.8 4.13 1250 943 A 47 LEU HG A 48 LYS HA 1.0 1.8 4.38 1251 944 A 75 HIS HB3 A 80 LEU HDy% 1.0 1.8 3.85 1252 945 A 66 PHE HB3 A 80 LEU HDy% 1.0 1.8 4.27 1253 946 A 80 LEU HDy% A 69 GLN HGx 1.0 1.8 3.94 1254 946 A 80 LEU HDy% A 69 GLN HGy 1.0 1.8 3.94 1255 947 A 79 GLU HB3 A 80 LEU HDy% 1.0 1.8 4.50 1256 948 A 80 LEU HDy% A 71 ILE HG1x 1.0 1.8 4.18 1257 948 A 80 LEU HDy% A 71 ILE HG1y 1.0 1.8 4.18 1258 949 A 47 LEU HG A 48 LYS HGx 1.0 1.8 5.13 1259 949 A 47 LEU HG A 48 LYS HGy 1.0 1.8 5.13 1260 950 A 26 VAL HGy% A 26 VAL H 1.0 1.8 3.46 1261 951 A 28 GLY H A 26 VAL HGy% 1.0 1.8 4.72 1262 952 A 26 VAL HGy% A 26 VAL HA 1.0 1.8 3.25 1263 953 A 26 VAL HGy% A 89 GLU HA 1.0 1.8 5.48 1264 954 A 26 VAL HGy% A 25 LYS HA 1.0 1.8 4.37 1265 955 A 26 VAL HGy% A 51 TYR HB2 1.0 1.8 4.81 1266 956 A 26 VAL HGy% A 33 GLU HB2 1.0 1.8 4.92 1267 957 A 47 LEU HG A 44 LEU HBx 1.0 1.8 3.48 1268 957 A 47 LEU HG A 44 LEU HBy 1.0 1.8 3.48 1269 958 A 26 VAL HGy% A 27 ILE HG1x 1.0 1.8 4.31 1270 958 A 26 VAL HGy% A 27 ILE HG1y 1.0 1.8 4.31 1271 959 A 22 ILE HD1% A 22 ILE H 1.0 1.8 4.01 1272 960 A 22 ILE HD1% A 24 LEU H 1.0 1.8 4.96 1273 961 A 23 LYS H A 22 ILE HD1% 1.0 1.8 3.85 1274 962 A 22 ILE HD1% A 36 PHE HD% 1.0 1.8 5.41 1275 963 A 22 ILE HD1% A 36 PHE HE2 1.0 1.8 5.78 1276 964 A 22 ILE HD1% A 23 LYS HA 1.0 1.8 5.21 1277 965 A 22 ILE HD1% A 21 TYR HA 1.0 1.8 5.58 1278 966 A 22 ILE HD1% A 24 LEU HA 1.0 1.8 4.62 1279 967 A 84 GLU HA A 22 ILE HD1% 1.0 1.8 3.56 1280 968 A 22 ILE HD1% A 40 MET HA 1.0 1.8 4.60 1281 969 A 22 ILE HD1% A 39 LYS HA 1.0 1.8 5.82 1282 970 A 22 ILE HD1% A 77 PRO HDx 1.0 1.8 6.00 1283 970 A 22 ILE HD1% A 77 PRO HDy 1.0 1.8 6.00 1284 971 A 22 ILE HD1% A 21 TYR HB3 1.0 1.8 6.00 1285 972 A 22 ILE HD1% A 77 PRO HBx 1.0 1.8 3.39 1286 972 A 22 ILE HD1% A 77 PRO HBy 1.0 1.8 3.39 1287 973 A 82 MET HE% A 22 ILE HD1% 1.0 1.8 3.97 1288 974 A 22 ILE HD1% A 84 GLU HB3 1.0 1.8 4.07 1289 975 A 22 ILE HB A 22 ILE HD1% 1.0 1.8 3.17 1290 976 A 80 LEU HDx% A 80 LEU H 1.0 1.8 3.58 1291 977 A 80 LEU HDx% A 66 PHE HD% 1.0 1.8 3.55 1292 978 A 80 LEU HDx% A 76 THR H 1.0 1.8 3.96 1293 979 A 80 LEU HDx% A 65 LEU HA 1.0 1.8 6.00 1294 980 A 80 LEU HDx% A 77 PRO HA 1.0 1.8 3.28 1295 981 A 80 LEU HDx% A 66 PHE HB2 1.0 1.8 4.03 1296 982 A 80 LEU HDx% A 75 HIS HB3 1.0 1.8 3.47 1297 983 A 80 LEU HDx% A 66 PHE HB3 1.0 1.8 3.85 1298 984 A 80 LEU HDx% A 69 GLN HGx 1.0 1.8 4.57 1299 984 A 80 LEU HDx% A 69 GLN HGy 1.0 1.8 4.57 1300 985 A 65 LEU HDy% A 65 LEU H 1.0 1.8 3.81 1301 986 A 65 LEU HDy% A 66 PHE H 1.0 1.8 3.74 1302 987 A 86 ASP H A 24 LEU HG 1.0 1.8 4.58 1303 988 A 47 LEU HDx% A 48 LYS H 1.0 1.8 4.39 1304 989 A 36 PHE HE1 A 47 LEU HDx% 1.0 1.8 4.26 1305 990 A 47 LEU HDx% A 36 PHE HD% 1.0 1.8 3.86 1306 991 A 65 LEU HDy% A 65 LEU HA 1.0 1.8 3.06 1307 992 A 24 LEU HA A 24 LEU HG 1.0 1.8 3.43 1308 993 A 44 LEU HA A 47 LEU HDx% 1.0 1.8 5.14 1309 994 A 45 LYS HA A 47 LEU HDx% 1.0 1.8 5.73 1310 995 A 65 LEU HDy% A 63 ARG HDx 1.0 1.8 4.24 1311 995 A 65 LEU HDy% A 63 ARG HDy 1.0 1.8 4.24 1312 996 A 47 LEU HDx% A 48 LYS HEx 1.0 1.8 4.19 1313 996 A 48 LYS HEy A 47 LEU HDx% 1.0 1.8 4.19 1314 997 A 65 LEU HDy% A 70 ARG HBx 1.0 1.8 3.47 1315 997 A 65 LEU HDy% A 70 ARG HBy 1.0 1.8 3.47 1316 998 A 65 LEU HDy% A 63 ARG HGx 1.0 1.8 2.93 1317 998 A 65 LEU HDy% A 63 ARG HGy 1.0 1.8 2.93 1318 999 A 65 LEU HDy% A 65 LEU HB3 1.0 1.8 3.10 1319 1000 A 22 ILE HD1% A 24 LEU HG 1.0 1.8 3.20 1320 1001 A 88 ILE HD1% A 65 LEU H 1.0 1.8 5.40 1321 1002 A 88 ILE HD1% A 88 ILE H 1.0 1.8 3.90 1322 1003 A 88 ILE HD1% A 66 PHE H 1.0 1.8 4.61 1323 1004 A 88 ILE HD1% A 89 GLU H 1.0 1.8 4.18 1324 1005 A 88 ILE HD1% A 66 PHE HA 1.0 1.8 4.51 1325 1006 A 26 VAL HA A 34 ILE HG2% 1.0 1.8 5.41 1326 1007 A 88 ILE HD1% A 26 VAL HA 1.0 1.8 5.84 1327 1008 A 88 ILE HD1% A 66 PHE HB2 1.0 1.8 3.96 1328 1009 A 88 ILE HD1% A 88 ILE HB 1.0 1.8 3.23 1329 1010 A 88 ILE HD1% A 88 ILE HG2% 1.0 1.8 2.70 1330 1011 A 34 ILE HG2% A 26 VAL H 1.0 1.8 3.92 1331 1012 A 34 ILE HG2% A 34 ILE H 1.0 1.8 3.15 1332 1013 A 34 ILE HG2% A 34 ILE HG1x 1.0 1.8 3.04 1333 1013 A 34 ILE HG1y A 34 ILE HG2% 1.0 1.8 3.04 1334 1014 A 65 LEU H A 71 ILE HD1% 1.0 1.8 4.64 1335 1015 A 44 LEU H A 44 LEU HDx% 1.0 1.8 3.72 1336 1015 A 44 LEU H A 44 LEU HDy% 1.0 1.8 3.72 1337 1016 A 38 VAL H A 38 VAL HGy% 1.0 1.8 3.27 1338 1017 A 71 ILE HD1% A 66 PHE H 1.0 1.8 3.18 1339 1018 A 39 LYS H A 38 VAL HGy% 1.0 1.8 3.63 1340 1019 A 71 ILE HD1% A 69 GLN H 1.0 1.8 3.88 1341 1020 A 71 ILE HD1% A 75 HIS HE1 1.0 1.8 4.93 1342 1021 A 36 PHE HD% A 38 VAL HGy% 1.0 1.8 3.98 1343 1022 A 36 PHE HE2 A 38 VAL HGy% 1.0 1.8 4.34 1344 1023 A 29 GLN HE22 A 62 LEU HDx% 1.0 1.8 4.46 1345 1023 A 62 LEU HDy% A 29 GLN HE22 1.0 1.8 4.46 1346 1024 A 65 LEU HA A 71 ILE HD1% 1.0 1.8 3.18 1347 1025 A 76 THR HA A 44 LEU HDx% 1.0 1.8 3.48 1348 1025 A 44 LEU HDy% A 76 THR HA 1.0 1.8 3.48 1349 1026 A 38 VAL HA A 38 VAL HGy% 1.0 1.8 3.36 1350 1027 A 63 ARG HA A 62 LEU HDx% 1.0 1.8 3.61 1351 1027 A 62 LEU HDy% A 63 ARG HA 1.0 1.8 3.61 1352 1028 A 92 GLN HA A 62 LEU HDx% 1.0 1.8 3.44 1353 1028 A 92 GLN HA A 62 LEU HDy% 1.0 1.8 3.44 1354 1029 A 71 ILE HD1% A 70 ARG HA 1.0 1.8 3.41 1355 1030 A 77 PRO HA A 44 LEU HDx% 1.0 1.8 3.67 1356 1030 A 77 PRO HA A 44 LEU HDy% 1.0 1.8 3.67 1357 1031 A 44 LEU HA A 44 LEU HDx% 1.0 1.8 3.71 1358 1031 A 44 LEU HA A 44 LEU HDy% 1.0 1.8 3.71 1359 1032 A 44 LEU HDx% A 77 PRO HDx 1.0 1.8 3.44 1360 1032 A 44 LEU HDy% A 77 PRO HDx 1.0 1.8 3.44 1361 1032 A 77 PRO HDy A 44 LEU HDx% 1.0 1.8 3.44 1362 1032 A 77 PRO HDy A 44 LEU HDy% 1.0 1.8 3.44 1363 1033 A 34 ILE HG2% A 51 TYR HB2 1.0 1.8 4.36 1364 1034 A 71 ILE HD1% A 66 PHE HB2 1.0 1.8 3.29 1365 1035 A 75 HIS HB3 A 44 LEU HDx% 1.0 1.8 3.99 1366 1035 A 44 LEU HDy% A 75 HIS HB3 1.0 1.8 3.99 1367 1036 A 62 LEU HDy% A 92 GLN HGx 1.0 1.8 4.16 1368 1036 A 62 LEU HDx% A 92 GLN HGx 1.0 1.8 4.16 1369 1036 A 92 GLN HGy A 62 LEU HDx% 1.0 1.8 4.16 1370 1036 A 62 LEU HDy% A 92 GLN HGy 1.0 1.8 4.16 1371 1037 A 62 LEU HB2 A 62 LEU HDx% 1.0 1.8 3.00 1372 1037 A 62 LEU HDy% A 62 LEU HB2 1.0 1.8 3.00 1373 1038 A 38 VAL HGy% A 24 LEU HDx% 1.0 1.8 2.69 1374 1038 A 24 LEU HDy% A 38 VAL HGy% 1.0 1.8 2.69 1375 1039 A 71 ILE HG2% A 44 LEU HDx% 1.0 1.8 2.92 1376 1039 A 71 ILE HG2% A 44 LEU HDy% 1.0 1.8 2.92 1377 1040 A 71 ILE HD1% A 66 PHE HB3 1.0 1.8 3.59 1378 1041 A 34 ILE HD1% A 51 TYR H 1.0 1.8 4.55 1379 1042 A 34 ILE HD1% A 35 HIS H 1.0 1.8 3.92 1380 1043 A 34 ILE HD1% A 55 GLN HE21 1.0 1.8 4.48 1381 1044 A 57 VAL HGy% A 55 GLN HE21 1.0 1.8 4.99 1382 1045 A 62 LEU H A 62 LEU HB3 1.0 1.8 3.36 1383 1046 A 29 GLN HE22 A 62 LEU HB3 1.0 1.8 4.66 1384 1047 A 34 ILE HD1% A 55 GLN HE22 1.0 1.8 3.45 1385 1048 A 92 GLN HA A 62 LEU HB3 1.0 1.8 3.72 1386 1049 A 62 LEU HB3 A 61 SER HB2 1.0 1.8 4.61 1387 1050 A 34 ILE HD1% A 51 TYR HA 1.0 1.8 3.62 1388 1051 A 57 VAL HGy% A 52 CYS HA 1.0 1.8 3.00 1389 1052 A 57 VAL HGy% A 58 PRO HDx 1.0 1.8 3.63 1390 1052 A 57 VAL HGy% A 58 PRO HDy 1.0 1.8 3.63 1391 1053 A 57 VAL HGy% A 30 ASP HB3 1.0 1.8 5.18 1392 1054 A 34 ILE HD1% A 36 PHE HB3 1.0 1.8 5.08 1393 1055 A 62 LEU HB3 A 29 GLN HGx 1.0 1.8 4.83 1394 1055 A 62 LEU HB3 A 29 GLN HGy 1.0 1.8 4.83 1395 1056 A 34 ILE HD1% A 34 ILE HB 1.0 1.8 2.94 1396 1057 A 22 ILE HG2% A 22 ILE H 1.0 1.8 3.24 1397 1058 A 71 ILE H A 71 ILE HG2% 1.0 1.8 3.89 1398 1059 A 24 LEU H A 24 LEU HDx% 1.0 1.8 3.52 1399 1059 A 24 LEU HDy% A 24 LEU H 1.0 1.8 3.52 1400 1060 A 22 ILE HG2% A 84 GLU H 1.0 1.8 3.56 1401 1061 A 86 ASP H A 24 LEU HDx% 1.0 1.8 3.34 1402 1061 A 24 LEU HDy% A 86 ASP H 1.0 1.8 3.34 1403 1062 A 23 LYS HA A 24 LEU HDx% 1.0 1.8 3.76 1404 1062 A 24 LEU HDy% A 23 LYS HA 1.0 1.8 3.76 1405 1063 A 22 ILE HG2% A 21 TYR HA 1.0 1.8 3.94 1406 1064 A 24 LEU HA A 24 LEU HDx% 1.0 1.8 3.34 1407 1064 A 24 LEU HDy% A 24 LEU HA 1.0 1.8 3.34 1408 1065 A 22 ILE HG2% A 22 ILE HA 1.0 1.8 3.06 1409 1066 A 71 ILE HA A 71 ILE HG2% 1.0 1.8 2.95 1410 1067 A 22 ILE HG2% A 84 GLU HA 1.0 1.8 3.79 1411 1068 A 84 GLU HA A 24 LEU HDx% 1.0 1.8 4.15 1412 1068 A 24 LEU HDy% A 84 GLU HA 1.0 1.8 4.15 1413 1069 A 22 ILE HG2% A 40 MET HA 1.0 1.8 4.39 1414 1070 A 71 ILE HG2% A 75 HIS HB2 1.0 1.8 3.53 1415 1071 A 24 LEU HDy% A 86 ASP HBy 1.0 1.8 3.29 1416 1071 A 24 LEU HDx% A 86 ASP HBy 1.0 1.8 3.29 1417 1072 A 71 ILE HG2% A 75 HIS HB3 1.0 1.8 3.21 1418 1073 A 24 LEU HDy% A 86 ASP HBx 1.0 1.8 3.29 1419 1073 A 86 ASP HBx A 24 LEU HDx% 1.0 1.8 3.29 1420 1074 A 24 LEU HDx% A 77 PRO HBx 1.0 1.8 3.06 1421 1074 A 24 LEU HDy% A 77 PRO HBx 1.0 1.8 3.06 1422 1074 A 77 PRO HBy A 24 LEU HDx% 1.0 1.8 3.06 1423 1074 A 24 LEU HDy% A 77 PRO HBy 1.0 1.8 3.06 1424 1075 A 71 ILE HG2% A 71 ILE HG1x 1.0 1.8 3.46 1425 1075 A 71 ILE HG2% A 71 ILE HG1y 1.0 1.8 3.46 1426 1076 A 27 ILE HD1% A 27 ILE HB 1.0 1.8 2.81 1427 1077 A 24 LEU HB2 A 24 LEU HDx% 1.0 1.8 2.72 1428 1077 A 24 LEU HDy% A 24 LEU HB2 1.0 1.8 2.72 1429 1078 A 22 ILE HD1% A 24 LEU HDx% 1.0 1.8 2.55 1430 1078 A 24 LEU HDy% A 22 ILE HD1% 1.0 1.8 2.55 1431 1079 A 72 ALA HB% A 72 ALA H 1.0 1.8 3.06 1432 1080 A 71 ILE HG2% A 75 HIS H 1.0 1.8 3.21 1433 1081 A 73 ASP H A 71 ILE HG2% 1.0 1.8 3.16 1434 1082 A 71 ILE HG2% A 74 ASN H 1.0 1.8 3.17 1435 1083 A 27 ILE HA A 27 ILE HD1% 1.0 1.8 4.28 1436 1084 A 26 VAL HA A 88 ILE HG1x 1.0 1.8 4.53 1437 1084 A 26 VAL HA A 88 ILE HG1y 1.0 1.8 4.53 1438 1085 A 57 VAL HGx% A 57 VAL H 1.0 1.8 3.27 1439 1086 A 26 VAL HA A 26 VAL HGx% 1.0 1.8 3.21 1440 1087 A 57 VAL HGx% A 57 VAL HA 1.0 1.8 3.25 1441 1088 A 26 VAL HGx% A 25 LYS HA 1.0 1.8 3.68 1442 1089 A 57 VAL HGx% A 58 PRO HDx 1.0 1.8 3.38 1443 1089 A 57 VAL HGx% A 58 PRO HDy 1.0 1.8 3.38 1444 1090 A 26 VAL HGx% A 26 VAL H 1.0 1.8 3.26 1445 1091 A 15 ASP H A 13 LEU HDx% 1.0 1.8 4.78 1446 1092 A 26 VAL HGx% A 35 HIS HA 1.0 1.8 4.82 1447 1093 A 13 LEU H A 13 LEU HDx% 1.0 1.8 4.75 1448 1094 A 13 LEU HA A 13 LEU HDx% 1.0 1.8 4.17 1449 1095 A 38 VAL HGx% A 46 LYS H 1.0 1.8 5.49 1450 1096 A 38 VAL HGx% A 47 LEU H 1.0 1.8 4.47 1451 1097 A 57 VAL HGx% A 51 TYR HE2 1.0 1.8 4.80 1452 1098 A 65 LEU HA A 88 ILE HG2% 1.0 1.8 4.06 1453 1099 A 38 VAL HGx% A 46 LYS HEx 1.0 1.8 3.86 1454 1099 A 38 VAL HGx% A 46 LYS HEy 1.0 1.8 3.86 1455 1100 A 38 VAL HGx% A 38 VAL HA 1.0 1.8 2.92 1456 1101 A 38 VAL HGx% A 38 VAL H 1.0 1.8 3.45 1457 1102 A 88 ILE H A 88 ILE HG1x 1.0 1.8 3.40 1458 1102 A 88 ILE HG1y A 88 ILE H 1.0 1.8 3.40 1459 1103 A 62 LEU HG A 30 ASP H 1.0 1.8 5.32 1460 1104 A 65 LEU H A 88 ILE HG2% 1.0 1.8 3.73 1461 1105 A 88 ILE HG2% A 89 GLU H 1.0 1.8 3.29 1462 1106 A 62 LEU HG A 29 GLN HE21 1.0 1.8 4.46 1463 1107 A 66 PHE HD% A 88 ILE HG2% 1.0 1.8 4.17 1464 1108 A 64 PHE HD% A 88 ILE HG2% 1.0 1.8 3.26 1465 1109 A 66 PHE HA A 88 ILE HG2% 1.0 1.8 4.19 1466 1110 A 25 LYS HA A 25 LYS HG2 1.0 1.8 3.72 1467 1111 A 38 VAL HGx% A 36 PHE HB2 1.0 1.8 3.51 1468 1112 A 88 ILE HG2% A 66 PHE HB2 1.0 1.8 3.76 1469 1113 A 88 ILE HG2% A 66 PHE HB3 1.0 1.8 4.04 1470 1114 A 26 VAL HGx% A 88 ILE HB 1.0 1.8 3.03 1471 1115 A 28 GLY H A 27 ILE HG2% 1.0 1.8 3.31 1472 1116 A 27 ILE HG2% A 33 GLU HA 1.0 1.8 3.81 1473 1117 A 27 ILE HA A 27 ILE HG2% 1.0 1.8 3.02 1474 1118 A 27 ILE HG2% A 28 GLY HAx 1.0 1.8 3.93 1475 1118 A 27 ILE HG2% A 28 GLY HAy 1.0 1.8 3.93 1476 1119 A 27 ILE HG2% A 30 ASP HB3 1.0 1.8 5.65 1477 1120 A 27 ILE HG2% A 27 ILE HG1x 1.0 1.8 2.86 1478 1120 A 27 ILE HG2% A 27 ILE HG1y 1.0 1.8 2.86 1479 1121 A 44 LEU H A 76 THR HG2% 1.0 1.8 3.95 1480 1122 A 78 LYS H A 76 THR HG2% 1.0 1.8 4.20 1481 1123 A 80 LEU H A 76 THR HG2% 1.0 1.8 5.74 1482 1124 A 76 THR HG2% A 76 THR HA 1.0 1.8 3.23 1483 1125 A 42 THR HA A 76 THR HG2% 1.0 1.8 3.87 1484 1126 A 76 THR HG2% A 77 PRO HDx 1.0 1.8 3.54 1485 1126 A 77 PRO HDy A 76 THR HG2% 1.0 1.8 3.54 1486 1127 A 75 HIS HB2 A 76 THR HG2% 1.0 1.8 5.79 1487 1128 A 76 THR HG2% A 78 LYS HEx 1.0 1.8 5.06 1488 1128 A 78 LYS HEy A 76 THR HG2% 1.0 1.8 5.06 1489 1129 A 79 GLU HB2 A 76 THR HG2% 1.0 1.8 4.04 1490 1130 A 44 LEU HG A 76 THR HG2% 1.0 1.8 4.43 1491 1131 A 76 THR HG2% A 42 THR HG2% 1.0 1.8 4.25 1492 1132 A 88 ILE H A 87 VAL HGx% 1.0 1.8 3.50 1493 1132 A 87 VAL HGy% A 88 ILE H 1.0 1.8 3.50 1494 1133 A 87 VAL H A 87 VAL HGx% 1.0 1.8 3.20 1495 1133 A 87 VAL HGy% A 87 VAL H 1.0 1.8 3.20 1496 1134 A 33 GLU HA A 27 ILE HG1x 1.0 1.8 4.20 1497 1134 A 33 GLU HA A 27 ILE HG1y 1.0 1.8 4.20 1498 1135 A 27 ILE HA A 27 ILE HG1x 1.0 1.8 3.71 1499 1135 A 27 ILE HA A 27 ILE HG1y 1.0 1.8 3.71 1500 1136 A 87 VAL HA A 87 VAL HGx% 1.0 1.8 3.00 1501 1136 A 87 VAL HGy% A 87 VAL HA 1.0 1.8 3.00 1502 1137 A 31 SER HA A 27 ILE HG1x 1.0 1.8 5.81 1503 1137 A 31 SER HA A 27 ILE HG1y 1.0 1.8 5.81 1504 1138 A 27 ILE HG1y A 28 GLY HAx 1.0 1.8 5.33 1505 1138 A 28 GLY HAy A 27 ILE HG1x 1.0 1.8 5.33 1506 1138 A 28 GLY HAy A 27 ILE HG1y 1.0 1.8 5.33 1507 1138 A 27 ILE HG1x A 28 GLY HAx 1.0 1.8 5.33 1508 1139 A 27 ILE HG1y A 33 GLU HGx 1.0 1.8 4.46 1509 1139 A 27 ILE HG1x A 33 GLU HGx 1.0 1.8 4.46 1510 1139 A 33 GLU HGy A 27 ILE HG1x 1.0 1.8 4.46 1511 1139 A 33 GLU HGy A 27 ILE HG1y 1.0 1.8 4.46 1512 1140 A 89 GLU HG2 A 87 VAL HGx% 1.0 1.8 4.64 1513 1140 A 87 VAL HGy% A 89 GLU HG2 1.0 1.8 4.64 1514 1141 A 33 GLU HB2 A 27 ILE HG1x 1.0 1.8 3.50 1515 1141 A 27 ILE HG1y A 33 GLU HB2 1.0 1.8 3.50 1516 1142 A 67 GLU H A 67 GLU HG2 1.0 1.8 3.75 1517 1143 A 69 GLN H A 67 GLU HG2 1.0 1.8 4.60 1518 1144 A 41 THR HG2% A 41 THR H 1.0 1.8 3.30 1519 1145 A 66 PHE HA A 67 GLU HG2 1.0 1.8 4.38 1520 1146 A 41 THR HG2% A 78 LYS HEx 1.0 1.8 3.56 1521 1146 A 41 THR HG2% A 78 LYS HEy 1.0 1.8 3.56 1522 1147 A 67 GLU HG2 A 69 GLN HGx 1.0 1.8 4.13 1523 1147 A 67 GLU HG2 A 69 GLN HGy 1.0 1.8 4.13 1524 1148 A 41 THR HG2% A 40 MET HE% 1.0 1.8 3.59 1525 1149 A 41 THR HG2% A 78 LYS HB2 1.0 1.8 3.24 1526 1150 A 41 THR HG2% A 78 LYS HDx 1.0 1.8 2.99 1527 1150 A 41 THR HG2% A 78 LYS HDy 1.0 1.8 2.99 1528 1151 A 41 THR HG2% A 78 LYS HGx 1.0 1.8 2.70 1529 1151 A 41 THR HG2% A 78 LYS HGy 1.0 1.8 2.70 1530 1152 A 35 HIS H A 34 ILE HG1x 1.0 1.8 3.78 1531 1152 A 34 ILE HG1y A 35 HIS H 1.0 1.8 3.78 1532 1153 A 11 GLU H A 10 THR HG2% 1.0 1.8 4.07 1533 1154 A 46 LYS H A 45 LYS HG2 1.0 1.8 4.98 1534 1155 A 35 HIS HA A 34 ILE HG1x 1.0 1.8 4.35 1535 1155 A 34 ILE HG1y A 35 HIS HA 1.0 1.8 4.35 1536 1156 A 22 ILE HA A 23 LYS HGx 1.0 1.8 4.69 1537 1156 A 22 ILE HA A 23 LYS HGy 1.0 1.8 4.69 1538 1157 A 25 LYS HA A 34 ILE HG1x 1.0 1.8 5.49 1539 1157 A 34 ILE HG1y A 25 LYS HA 1.0 1.8 5.49 1540 1158 A 95 THR HG2% A 94 GLN HA 1.0 1.8 4.27 1541 1159 A 51 TYR HA A 34 ILE HG1x 1.0 1.8 4.17 1542 1159 A 34 ILE HG1y A 51 TYR HA 1.0 1.8 4.17 1543 1160 A 34 ILE HG1y A 50 SER HBx 1.0 1.8 4.48 1544 1160 A 34 ILE HG1x A 50 SER HBx 1.0 1.8 4.48 1545 1160 A 50 SER HBy A 34 ILE HG1x 1.0 1.8 4.48 1546 1160 A 34 ILE HG1y A 50 SER HBy 1.0 1.8 4.48 1547 1161 A 45 LYS HG2 A 45 LYS HEx 1.0 1.8 3.47 1548 1161 A 45 LYS HEy A 45 LYS HG2 1.0 1.8 3.47 1549 1162 A 23 LYS HEy A 23 LYS HGx 1.0 1.8 3.65 1550 1162 A 23 LYS HGy A 23 LYS HEx 1.0 1.8 3.65 1551 1162 A 23 LYS HEy A 23 LYS HGy 1.0 1.8 3.65 1552 1162 A 23 LYS HEx A 23 LYS HGx 1.0 1.8 3.65 1553 1163 A 66 PHE HB3 A 67 GLU HG2 1.0 1.8 4.36 1554 1164 A 45 LYS HG2 A 73 ASP HBx 1.0 1.8 3.75 1555 1164 A 73 ASP HBy A 45 LYS HG2 1.0 1.8 3.75 1556 1165 A 10 THR HG2% A 11 GLU HGx 1.0 1.8 4.59 1557 1165 A 11 GLU HGy A 10 THR HG2% 1.0 1.8 4.59 1558 1166 A 49 GLU HG3 A 45 LYS HG2 1.0 1.8 4.95 1559 1167 A 45 LYS HG2 A 45 LYS HDx 1.0 1.8 2.70 1560 1167 A 45 LYS HDy A 45 LYS HG2 1.0 1.8 2.70 1561 1168 A 45 LYS HG3 A 45 LYS H 1.0 1.8 4.62 1562 1169 A 90 VAL HB A 91 TYR H 1.0 1.8 4.97 1563 1170 A 90 VAL HB A 90 VAL H 1.0 1.8 3.57 1564 1171 A 90 VAL HB A 28 GLY HAx 1.0 1.8 3.94 1565 1171 A 90 VAL HB A 28 GLY HAy 1.0 1.8 3.94 1566 1172 A 22 ILE HG12 A 22 ILE H 1.0 1.8 4.14 1567 1173 A 80 LEU H A 78 LYS HGx 1.0 1.8 4.51 1568 1173 A 78 LYS HGy A 80 LEU H 1.0 1.8 4.51 1569 1174 A 75 HIS HD2 A 78 LYS HGx 1.0 1.8 5.80 1570 1174 A 78 LYS HGy A 75 HIS HD2 1.0 1.8 5.80 1571 1175 A 66 PHE HA A 67 GLU HB3 1.0 1.8 4.49 1572 1176 A 88 ILE HA A 67 GLU HB3 1.0 1.8 6.00 1573 1177 A 76 THR HB A 78 LYS HGx 1.0 1.8 4.39 1574 1177 A 78 LYS HGy A 76 THR HB 1.0 1.8 4.39 1575 1178 A 41 THR HA A 78 LYS HGx 1.0 1.8 4.48 1576 1178 A 78 LYS HGy A 41 THR HA 1.0 1.8 4.48 1577 1179 A 45 LYS HG3 A 73 ASP HBx 1.0 1.8 3.99 1578 1179 A 45 LYS HG3 A 73 ASP HBy 1.0 1.8 3.99 1579 1180 A 67 GLU HG3 A 69 GLN HGx 1.0 1.8 3.85 1580 1180 A 67 GLU HG3 A 69 GLN HGy 1.0 1.8 3.85 1581 1181 A 79 GLU HB2 A 78 LYS HGx 1.0 1.8 3.80 1582 1181 A 78 LYS HGy A 79 GLU HB2 1.0 1.8 3.80 1583 1182 A 79 GLU HB3 A 78 LYS HGx 1.0 1.8 4.07 1584 1182 A 78 LYS HGy A 79 GLU HB3 1.0 1.8 4.07 1585 1183 A 78 LYS HDx A 78 LYS HGx 1.0 1.8 2.78 1586 1183 A 78 LYS HDy A 78 LYS HGx 1.0 1.8 2.78 1587 1183 A 78 LYS HGy A 78 LYS HDx 1.0 1.8 2.78 1588 1183 A 78 LYS HGy A 78 LYS HDy 1.0 1.8 2.78 1589 1184 A 22 ILE HG2% A 22 ILE HG12 1.0 1.8 3.17 1590 1185 A 18 GLU H A 17 LYS HGx 1.0 1.8 4.56 1591 1185 A 17 LYS HGy A 18 GLU H 1.0 1.8 4.56 1592 1186 A 49 GLU H A 48 LYS HDx 1.0 1.8 5.22 1593 1186 A 49 GLU H A 48 LYS HDy 1.0 1.8 5.22 1594 1187 A 41 THR H A 42 THR HG2% 1.0 1.8 4.36 1595 1188 A 76 THR HA A 42 THR HG2% 1.0 1.8 5.19 1596 1189 A 76 THR HA A 80 LEU HG 1.0 1.8 5.82 1597 1190 A 42 THR HG2% A 38 VAL HA 1.0 1.8 4.14 1598 1191 A 76 THR HB A 42 THR HG2% 1.0 1.8 4.96 1599 1192 A 80 LEU HA A 80 LEU HG 1.0 1.8 3.09 1600 1193 A 42 THR HG2% A 77 PRO HDx 1.0 1.8 4.27 1601 1193 A 77 PRO HDy A 42 THR HG2% 1.0 1.8 4.27 1602 1194 A 42 THR HG2% A 38 VAL HB 1.0 1.8 3.82 1603 1195 A 42 THR HG2% A 39 LYS HBx 1.0 1.8 3.46 1604 1195 A 39 LYS HBy A 42 THR HG2% 1.0 1.8 3.46 1605 1196 A 38 VAL HGx% A 42 THR HG2% 1.0 1.8 3.18 1606 1197 A 47 LEU HDx% A 48 LYS HDx 1.0 1.8 3.60 1607 1197 A 47 LEU HDx% A 48 LYS HDy 1.0 1.8 3.60 1608 1198 A 78 LYS H A 80 LEU HG 1.0 1.8 5.34 1609 1199 A 7 LYS HA A 7 LYS HGx 1.0 1.8 3.74 1610 1199 A 7 LYS HGy A 7 LYS HA 1.0 1.8 3.74 1611 1200 A 79 GLU HB3 A 80 LEU HG 1.0 1.8 3.84 1612 1201 A 70 ARG HBx A 70 ARG HGx 1.0 1.8 2.82 1613 1201 A 70 ARG HGy A 70 ARG HBx 1.0 1.8 2.82 1614 1201 A 70 ARG HBy A 70 ARG HGy 1.0 1.8 2.82 1615 1201 A 70 ARG HBy A 70 ARG HGx 1.0 1.8 2.82 1616 1202 A 25 LYS HB3 A 25 LYS HEx 1.0 1.8 3.40 1617 1202 A 25 LYS HEy A 25 LYS HB3 1.0 1.8 3.40 1618 1203 A 36 PHE H A 24 LEU HB2 1.0 1.8 4.35 1619 1204 A 25 LYS HB3 A 26 VAL H 1.0 1.8 4.67 1620 1205 A 75 HIS HE1 A 70 ARG HGx 1.0 1.8 5.16 1621 1205 A 75 HIS HE1 A 70 ARG HGy 1.0 1.8 5.16 1622 1206 A 24 LEU HB2 A 35 HIS HA 1.0 1.8 5.44 1623 1207 A 26 VAL HA A 25 LYS HB3 1.0 1.8 4.85 1624 1208 A 63 ARG HA A 63 ARG HGx 1.0 1.8 4.23 1625 1208 A 63 ARG HGy A 63 ARG HA 1.0 1.8 4.23 1626 1209 A 71 ILE HA A 70 ARG HGx 1.0 1.8 4.52 1627 1209 A 71 ILE HA A 70 ARG HGy 1.0 1.8 4.52 1628 1210 A 65 LEU H A 65 LEU HG 1.0 1.8 3.81 1629 1211 A 65 LEU HA A 65 LEU HG 1.0 1.8 4.12 1630 1212 A 70 ARG HA A 70 ARG HGx 1.0 1.8 3.50 1631 1212 A 70 ARG HA A 70 ARG HGy 1.0 1.8 3.50 1632 1213 A 24 LEU HB2 A 24 LEU H 1.0 1.8 3.70 1633 1214 A 64 PHE H A 63 ARG HGx 1.0 1.8 4.22 1634 1214 A 63 ARG HGy A 64 PHE H 1.0 1.8 4.22 1635 1215 A 45 LYS HB3 A 45 LYS HG2 1.0 1.8 2.96 1636 1216 A 26 VAL H A 25 LYS HDx 1.0 1.8 3.58 1637 1216 A 25 LYS HDy A 26 VAL H 1.0 1.8 3.58 1638 1217 A 24 LEU H A 23 LYS HB3 1.0 1.8 4.05 1639 1218 A 25 LYS H A 25 LYS HB2 1.0 1.8 3.50 1640 1219 A 93 GLU H A 62 LEU HB2 1.0 1.8 4.48 1641 1220 A 62 LEU H A 62 LEU HB2 1.0 1.8 3.68 1642 1221 A 29 GLN HE22 A 62 LEU HB2 1.0 1.8 5.17 1643 1222 A 26 VAL HA A 25 LYS HDx 1.0 1.8 3.60 1644 1222 A 26 VAL HA A 25 LYS HDy 1.0 1.8 3.60 1645 1223 A 90 VAL HA A 62 LEU HB2 1.0 1.8 4.62 1646 1224 A 92 GLN HA A 62 LEU HB2 1.0 1.8 4.03 1647 1225 A 41 THR HA A 78 LYS HDx 1.0 1.8 4.33 1648 1225 A 78 LYS HDy A 41 THR HA 1.0 1.8 4.33 1649 1226 A 62 LEU HB2 A 28 GLY HAx 1.0 1.8 5.16 1650 1226 A 62 LEU HB2 A 28 GLY HAy 1.0 1.8 5.16 1651 1227 A 62 LEU HB2 A 63 ARG HDx 1.0 1.8 4.13 1652 1227 A 63 ARG HDy A 62 LEU HB2 1.0 1.8 4.13 1653 1228 A 49 GLU HG3 A 45 LYS HDx 1.0 1.8 3.40 1654 1228 A 49 GLU HG3 A 45 LYS HDy 1.0 1.8 3.40 1655 1229 A 16 LYS HBx A 16 LYS HGx 1.0 1.8 2.98 1656 1229 A 16 LYS HBy A 16 LYS HGx 1.0 1.8 2.98 1657 1229 A 16 LYS HGy A 16 LYS HBx 1.0 1.8 2.98 1658 1229 A 16 LYS HBy A 16 LYS HGy 1.0 1.8 2.98 1659 1230 A 27 ILE HD1% A 25 LYS HDx 1.0 1.8 2.71 1660 1230 A 27 ILE HD1% A 25 LYS HDy 1.0 1.8 2.71 1661 1231 A 71 ILE HB A 72 ALA H 1.0 1.8 4.58 1662 1232 A 65 LEU H A 71 ILE HB 1.0 1.8 5.17 1663 1233 A 41 THR H A 39 LYS HGx 1.0 1.8 4.83 1664 1233 A 41 THR H A 39 LYS HGy 1.0 1.8 4.83 1665 1234 A 75 HIS HB2 A 71 ILE HB 1.0 1.8 5.07 1666 1235 A 64 PHE HB3 A 71 ILE HB 1.0 1.8 3.74 1667 1236 A 79 GLU H A 78 LYS HB3 1.0 1.8 4.45 1668 1237 A 79 GLU H A 78 LYS HDx 1.0 1.8 4.68 1669 1237 A 78 LYS HDy A 79 GLU H 1.0 1.8 4.68 1670 1238 A 41 THR HB A 78 LYS HDx 1.0 1.8 4.14 1671 1238 A 78 LYS HDy A 41 THR HB 1.0 1.8 4.14 1672 1239 A 22 ILE HB A 22 ILE H 1.0 1.8 3.84 1673 1240 A 13 LEU HG A 15 ASP H 1.0 1.8 6.00 1674 1241 A 55 GLN HA A 55 GLN HBx 1.0 1.8 3.02 1675 1241 A 55 GLN HBy A 55 GLN HA 1.0 1.8 3.02 1676 1242 A 44 LEU HG A 74 ASN H 1.0 1.8 5.26 1677 1243 A 15 ASP HBy A 16 LYS HDx 1.0 1.8 4.50 1678 1243 A 15 ASP HBx A 16 LYS HDx 1.0 1.8 4.50 1679 1243 A 16 LYS HDy A 15 ASP HBx 1.0 1.8 4.50 1680 1243 A 15 ASP HBy A 16 LYS HDy 1.0 1.8 4.50 1681 1244 A 16 LYS HBx A 16 LYS HDx 1.0 1.8 3.29 1682 1244 A 16 LYS HBy A 16 LYS HDx 1.0 1.8 3.29 1683 1244 A 16 LYS HDy A 16 LYS HBx 1.0 1.8 3.29 1684 1244 A 16 LYS HBy A 16 LYS HDy 1.0 1.8 3.29 1685 1245 A 17 LYS HBx A 17 LYS HDx 1.0 1.8 3.34 1686 1245 A 17 LYS HBy A 17 LYS HDx 1.0 1.8 3.34 1687 1245 A 17 LYS HDy A 17 LYS HBx 1.0 1.8 3.34 1688 1245 A 17 LYS HDy A 17 LYS HBy 1.0 1.8 3.34 1689 1246 A 57 VAL HGy% A 55 GLN HBx 1.0 1.8 2.95 1690 1246 A 57 VAL HGy% A 55 GLN HBy 1.0 1.8 2.95 1691 1247 A 92 GLN H A 93 GLU HB3 1.0 1.8 5.49 1692 1248 A 14 GLY H A 13 LEU HBy 1.0 1.8 4.15 1693 1249 A 44 LEU HG A 76 THR HA 1.0 1.8 3.74 1694 1250 A 51 TYR HB2 A 55 GLN HBx 1.0 1.8 5.62 1695 1250 A 55 GLN HBy A 51 TYR HB2 1.0 1.8 5.62 1696 1251 A 13 LEU H A 13 LEU HBy 1.0 1.8 4.15 1697 1252 A 17 LYS H A 17 LYS HDx 1.0 1.8 4.55 1698 1252 A 17 LYS HDy A 17 LYS H 1.0 1.8 4.55 1699 1253 A 46 LYS H A 46 LYS HDx 1.0 1.8 4.43 1700 1253 A 46 LYS HDy A 46 LYS H 1.0 1.8 4.43 1701 1254 A 44 LEU HG A 75 HIS H 1.0 1.8 5.17 1702 1255 A 7 LYS HBx A 8 PRO HDx 1.0 1.8 4.50 1703 1256 A 52 CYS HB2 A 48 LYS HBx 1.0 1.8 5.97 1704 1256 A 48 LYS HBy A 52 CYS HB2 1.0 1.8 5.97 1705 1257 A 82 MET H A 82 MET HBx 1.0 1.8 3.84 1706 1257 A 82 MET H A 82 MET HBy 1.0 1.8 3.84 1707 1258 A 88 ILE H A 88 ILE HB 1.0 1.8 3.55 1708 1259 A 78 LYS H A 78 LYS HB2 1.0 1.8 3.69 1709 1260 A 66 PHE HD% A 82 MET HBx 1.0 1.8 4.59 1710 1260 A 66 PHE HD% A 82 MET HBy 1.0 1.8 4.59 1711 1261 A 27 ILE H A 27 ILE HB 1.0 1.8 3.40 1712 1262 A 55 GLN H A 54 ARG HGx 1.0 1.8 4.11 1713 1262 A 55 GLN H A 54 ARG HGy 1.0 1.8 4.11 1714 1263 A 41 THR H A 39 LYS HDx 1.0 1.8 4.66 1715 1263 A 39 LYS HDy A 41 THR H 1.0 1.8 4.66 1716 1264 A 26 VAL HA A 88 ILE HB 1.0 1.8 3.88 1717 1265 A 33 GLU HB3 A 33 GLU H 1.0 1.8 3.28 1718 1266 A 26 VAL HB A 88 ILE HB 1.0 1.8 3.67 1719 1267 A 70 ARG HBx A 70 ARG HDx 1.0 1.8 3.34 1720 1267 A 70 ARG HBy A 70 ARG HDx 1.0 1.8 3.34 1721 1267 A 70 ARG HDy A 70 ARG HBx 1.0 1.8 3.34 1722 1267 A 70 ARG HBy A 70 ARG HDy 1.0 1.8 3.34 1723 1268 A 66 PHE HE% A 67 GLU HB2 1.0 1.8 4.80 1724 1269 A 67 GLU HB2 A 68 GLY HA3 1.0 1.8 4.97 1725 1270 A 42 THR HA A 39 LYS HBx 1.0 1.8 5.05 1726 1270 A 39 LYS HBy A 42 THR HA 1.0 1.8 5.05 1727 1271 A 47 LEU HA A 46 LYS HBx 1.0 1.8 4.60 1728 1271 A 47 LEU HA A 46 LYS HBy 1.0 1.8 4.60 1729 1272 A 65 LEU HB2 A 67 GLU H 1.0 1.8 5.35 1730 1273 A 35 HIS HA A 34 ILE HB 1.0 1.8 5.92 1731 1274 A 65 LEU HB2 A 66 PHE HA 1.0 1.8 4.86 1732 1275 A 65 LEU HB2 A 64 PHE HA 1.0 1.8 4.77 1733 1276 A 34 ILE HB A 51 TYR HB2 1.0 1.8 5.01 1734 1277 A 65 LEU HDy% A 65 LEU HB2 1.0 1.8 3.34 1735 1278 A 83 GLU H A 82 MET HGx 1.0 1.8 4.17 1736 1278 A 82 MET HGy A 83 GLU H 1.0 1.8 4.17 1737 1279 A 82 MET HE% A 80 LEU H 1.0 1.8 5.13 1738 1280 A 66 PHE HE% A 82 MET HGx 1.0 1.8 4.06 1739 1280 A 66 PHE HE% A 82 MET HGy 1.0 1.8 4.06 1740 1281 A 84 GLU HB3 A 22 ILE HA 1.0 1.8 4.46 1741 1282 A 71 ILE HA A 71 ILE HG1x 1.0 1.8 3.51 1742 1282 A 71 ILE HA A 71 ILE HG1y 1.0 1.8 3.51 1743 1283 A 75 HIS HB3 A 71 ILE HG1x 1.0 1.8 4.09 1744 1283 A 75 HIS HB3 A 71 ILE HG1y 1.0 1.8 4.09 1745 1284 A 11 GLU HBy A 11 GLU HGx 1.0 1.8 2.93 1746 1284 A 11 GLU HBx A 11 GLU HGx 1.0 1.8 2.93 1747 1284 A 11 GLU HGy A 11 GLU HBx 1.0 1.8 2.93 1748 1284 A 11 GLU HBy A 11 GLU HGy 1.0 1.8 2.93 1749 1285 A 40 MET HE% A 78 LYS HB2 1.0 1.8 3.50 1750 1286 A 82 MET HE% A 82 MET HBx 1.0 1.8 3.88 1751 1286 A 82 MET HE% A 82 MET HBy 1.0 1.8 3.88 1752 1287 A 40 MET HE% A 78 LYS HB3 1.0 1.8 3.07 1753 1288 A 40 MET HE% A 22 ILE HG12 1.0 1.8 3.70 1754 1289 A 40 MET HE% A 78 LYS HGx 1.0 1.8 4.11 1755 1289 A 78 LYS HGy A 40 MET HE% 1.0 1.8 4.11 1756 1290 A 80 LEU HDx% A 82 MET HE% 1.0 1.8 4.38 1757 1291 A 85 GLU H A 84 GLU HB3 1.0 1.8 4.10 1758 1292 A 23 LYS H A 84 GLU HB3 1.0 1.8 3.53 1759 1293 A 65 LEU HA A 89 GLU HBx 1.0 1.8 5.71 1760 1293 A 65 LEU HA A 89 GLU HBy 1.0 1.8 5.71 1761 1294 A 27 ILE HA A 33 GLU HB2 1.0 1.8 4.35 1762 1295 A 84 GLU HB3 A 23 LYS HGx 1.0 1.8 4.35 1763 1295 A 84 GLU HB3 A 23 LYS HGy 1.0 1.8 4.35 1764 1296 A 88 ILE H A 87 VAL HB 1.0 1.8 4.35 1765 1297 A 87 VAL H A 87 VAL HB 1.0 1.8 3.28 1766 1298 A 7 LYS HEy A 8 PRO HGx 1.0 1.8 4.14 1767 1298 A 7 LYS HEx A 8 PRO HGx 1.0 1.8 4.14 1768 1298 A 8 PRO HGy A 7 LYS HEx 1.0 1.8 4.14 1769 1298 A 7 LYS HEy A 8 PRO HGy 1.0 1.8 4.14 1770 1299 A 45 LYS HB2 A 43 HIS HB2 1.0 1.8 4.50 1771 1300 A 79 GLU HB3 A 76 THR HA 1.0 1.8 5.00 1772 1301 A 63 ARG HE A 93 GLU HGx 1.0 1.8 4.89 1773 1301 A 93 GLU HGy A 63 ARG HE 1.0 1.8 4.89 1774 1302 A 63 ARG HDy A 93 GLU HGx 1.0 1.8 4.13 1775 1302 A 63 ARG HDx A 93 GLU HGx 1.0 1.8 4.13 1776 1302 A 93 GLU HGy A 63 ARG HDx 1.0 1.8 4.13 1777 1302 A 93 GLU HGy A 63 ARG HDy 1.0 1.8 4.13 1778 1303 A 41 THR HG2% A 40 MET HB3 1.0 1.8 4.46 1779 1304 A 22 ILE HG2% A 84 GLU HB2 1.0 1.8 3.49 1780 1305 A 84 GLU HB2 A 85 GLU H 1.0 1.8 3.64 1781 1306 A 89 GLU H A 89 GLU HG3 1.0 1.8 3.51 1782 1307 A 23 LYS H A 84 GLU HB2 1.0 1.8 3.80 1783 1308 A 57 VAL H A 55 GLN HGx 1.0 1.8 5.26 1784 1308 A 55 GLN HGy A 57 VAL H 1.0 1.8 5.26 1785 1309 A 59 MET HE% A 57 VAL H 1.0 1.8 5.56 1786 1310 A 64 PHE HD% A 59 MET HE% 1.0 1.8 5.20 1787 1311 A 42 THR H A 77 PRO HBx 1.0 1.8 5.18 1788 1311 A 77 PRO HBy A 42 THR H 1.0 1.8 5.18 1789 1312 A 33 GLU HA A 55 GLN HGx 1.0 1.8 5.18 1790 1312 A 55 GLN HGy A 33 GLU HA 1.0 1.8 5.18 1791 1313 A 57 VAL HA A 58 PRO HGx 1.0 1.8 4.18 1792 1313 A 57 VAL HA A 58 PRO HGy 1.0 1.8 4.18 1793 1314 A 89 GLU HA A 89 GLU HG3 1.0 1.8 3.72 1794 1315 A 59 MET HE% A 59 MET HA 1.0 1.8 3.07 1795 1316 A 52 CYS HB2 A 59 MET HBx 1.0 1.8 3.82 1796 1316 A 59 MET HBy A 52 CYS HB2 1.0 1.8 3.82 1797 1317 A 52 CYS HB3 A 59 MET HBx 1.0 1.8 3.64 1798 1317 A 59 MET HBy A 52 CYS HB3 1.0 1.8 3.64 1799 1318 A 84 GLU HB2 A 23 LYS HGx 1.0 1.8 3.48 1800 1318 A 84 GLU HB2 A 23 LYS HGy 1.0 1.8 3.48 1801 1319 A 62 LEU HG A 59 MET HE% 1.0 1.8 3.26 1802 1320 A 57 VAL HGy% A 59 MET HE% 1.0 1.8 3.24 1803 1321 A 48 LYS HGy A 59 MET HBx 1.0 1.8 4.10 1804 1321 A 48 LYS HGx A 59 MET HBx 1.0 1.8 4.10 1805 1321 A 59 MET HBy A 48 LYS HGx 1.0 1.8 4.10 1806 1321 A 48 LYS HGy A 59 MET HBy 1.0 1.8 4.10 1807 1322 A 55 GLN HA A 55 GLN HGx 1.0 1.8 3.16 1808 1322 A 55 GLN HGy A 55 GLN HA 1.0 1.8 3.16 1809 1323 A 66 PHE HA A 69 GLN HB2 1.0 1.8 4.38 1810 1324 A 69 GLN HB2 A 67 GLU HG2 1.0 1.8 4.13 1811 1325 A 80 LEU HDx% A 77 PRO HBx 1.0 1.8 3.96 1812 1325 A 80 LEU HDx% A 77 PRO HBy 1.0 1.8 3.96 1813 1326 A 84 GLU H A 83 GLU HGx 1.0 1.8 3.29 1814 1326 A 84 GLU H A 83 GLU HGy 1.0 1.8 3.29 1815 1327 A 29 GLN HE22 A 29 GLN HB3 1.0 1.8 5.37 1816 1328 A 76 THR HA A 77 PRO HGx 1.0 1.8 5.11 1817 1328 A 77 PRO HGy A 76 THR HA 1.0 1.8 5.11 1818 1329 A 83 GLU HA A 83 GLU HGx 1.0 1.8 3.39 1819 1329 A 83 GLU HGy A 83 GLU HA 1.0 1.8 3.39 1820 1330 A 57 VAL HB A 58 PRO HDx 1.0 1.8 3.41 1821 1330 A 57 VAL HB A 58 PRO HDy 1.0 1.8 3.41 1822 1331 A 69 GLN HB3 A 69 GLN HGx 1.0 1.8 2.85 1823 1331 A 69 GLN HB3 A 69 GLN HGy 1.0 1.8 2.85 1824 1332 A 66 PHE HD% A 69 GLN HB3 1.0 1.8 4.84 1825 1333 A 88 ILE HA A 26 VAL HB 1.0 1.8 5.25 1826 1334 A 89 GLU HA A 26 VAL HB 1.0 1.8 5.58 1827 1335 A 22 ILE HD1% A 77 PRO HGx 1.0 1.8 4.57 1828 1335 A 77 PRO HGy A 22 ILE HD1% 1.0 1.8 4.57 1829 1336 A 27 ILE H A 26 VAL HB 1.0 1.8 3.62 1830 1337 A 79 GLU HB2 A 76 THR HA 1.0 1.8 5.88 1831 1338 A 79 GLU HB2 A 78 LYS HEx 1.0 1.8 4.00 1832 1338 A 79 GLU HB2 A 78 LYS HEy 1.0 1.8 4.00 1833 1339 A 18 GLU HBx A 18 GLU HGx 1.0 1.8 2.86 1834 1339 A 18 GLU HBy A 18 GLU HGx 1.0 1.8 2.86 1835 1339 A 18 GLU HGy A 18 GLU HBx 1.0 1.8 2.86 1836 1339 A 18 GLU HBy A 18 GLU HGy 1.0 1.8 2.86 1837 1340 A 53 GLN HE2y A 53 GLN HBx 1.0 1.8 4.27 1838 1340 A 53 GLN HBy A 53 GLN HE2y 1.0 1.8 4.27 1839 1341 A 80 LEU HA A 79 GLU HGx 1.0 1.8 4.12 1840 1341 A 80 LEU HA A 79 GLU HGy 1.0 1.8 4.12 1841 1342 A 79 GLU HB3 A 79 GLU HGx 1.0 1.8 2.74 1842 1342 A 79 GLU HB3 A 79 GLU HGy 1.0 1.8 2.74 1843 1343 A 80 LEU HDx% A 79 GLU HGx 1.0 1.8 5.54 1844 1343 A 80 LEU HDx% A 79 GLU HGy 1.0 1.8 5.54 1845 1344 A 7 LYS HA A 8 PRO HB2 1.0 1.8 5.82 1846 1345 A 78 LYS HEy A 79 GLU HGx 1.0 1.8 5.26 1847 1345 A 78 LYS HEx A 79 GLU HGx 1.0 1.8 5.26 1848 1345 A 79 GLU HGy A 78 LYS HEx 1.0 1.8 5.26 1849 1345 A 78 LYS HEy A 79 GLU HGy 1.0 1.8 5.26 1850 1346 A 79 GLU HGx A 80 LEU HBx 1.0 1.8 5.24 1851 1346 A 79 GLU HGy A 80 LEU HBx 1.0 1.8 5.24 1852 1346 A 80 LEU HBy A 79 GLU HGx 1.0 1.8 5.24 1853 1346 A 80 LEU HBy A 79 GLU HGy 1.0 1.8 5.24 1854 1347 A 78 LYS HGx A 79 GLU HGx 1.0 1.8 5.15 1855 1347 A 78 LYS HGy A 79 GLU HGx 1.0 1.8 5.15 1856 1347 A 79 GLU HGy A 78 LYS HGx 1.0 1.8 5.15 1857 1347 A 78 LYS HGy A 79 GLU HGy 1.0 1.8 5.15 1858 1348 A 76 THR HG2% A 79 GLU HGx 1.0 1.8 5.05 1859 1348 A 76 THR HG2% A 79 GLU HGy 1.0 1.8 5.05 1860 1349 A 89 GLU HG2 A 88 ILE H 1.0 1.8 4.95 1861 1350 A 27 ILE H A 89 GLU HG2 1.0 1.8 5.02 1862 1351 A 9 SER H A 8 PRO HB2 1.0 1.8 3.75 1863 1352 A 91 TYR H A 91 TYR HB3 1.0 1.8 3.82 1864 1353 A 68 GLY H A 69 GLN HGx 1.0 1.8 4.86 1865 1353 A 68 GLY H A 69 GLN HGy 1.0 1.8 4.86 1866 1354 A 70 ARG H A 69 GLN HGx 1.0 1.8 5.12 1867 1354 A 70 ARG H A 69 GLN HGy 1.0 1.8 5.12 1868 1355 A 5 GLU H A 4 GLN HGx 1.0 1.8 3.90 1869 1355 A 5 GLU H A 4 GLN HGy 1.0 1.8 3.90 1870 1356 A 4 GLN HA A 4 GLN HGx 1.0 1.8 3.52 1871 1356 A 4 GLN HGy A 4 GLN HA 1.0 1.8 3.52 1872 1357 A 68 GLY HA3 A 69 GLN HGx 1.0 1.8 4.68 1873 1357 A 69 GLN HGy A 68 GLY HA3 1.0 1.8 4.68 1874 1358 A 69 GLN HB2 A 69 GLN HGx 1.0 1.8 2.51 1875 1358 A 69 GLN HB2 A 69 GLN HGy 1.0 1.8 2.51 1876 1359 A 66 PHE HB2 A 69 GLN HGx 1.0 1.8 4.66 1877 1359 A 69 GLN HGy A 66 PHE HB2 1.0 1.8 4.66 1878 1360 A 62 LEU HB3 A 91 TYR HB3 1.0 1.8 5.98 1879 1361 A 53 GLN HG3 A 51 TYR H 1.0 1.8 5.84 1880 1362 A 31 SER H A 29 GLN HGx 1.0 1.8 4.73 1881 1362 A 29 GLN HGy A 31 SER H 1.0 1.8 4.73 1882 1363 A 53 GLN HG3 A 53 GLN HE2y 1.0 1.8 4.08 1883 1364 A 64 PHE HD% A 48 LYS HEx 1.0 1.8 5.20 1884 1364 A 64 PHE HD% A 48 LYS HEy 1.0 1.8 5.20 1885 1365 A 62 LEU HA A 92 GLN HGx 1.0 1.8 4.70 1886 1365 A 62 LEU HA A 92 GLN HGy 1.0 1.8 4.70 1887 1366 A 57 VAL HA A 58 PRO HBx 1.0 1.8 4.61 1888 1366 A 58 PRO HBy A 57 VAL HA 1.0 1.8 4.61 1889 1367 A 53 GLN HG3 A 50 SER HA 1.0 1.8 4.33 1890 1368 A 45 LYS HA A 48 LYS HEx 1.0 1.8 4.17 1891 1368 A 48 LYS HEy A 45 LYS HA 1.0 1.8 4.17 1892 1369 A 53 GLN HG3 A 49 GLU HBx 1.0 1.8 3.17 1893 1369 A 49 GLU HBy A 53 GLN HG3 1.0 1.8 3.17 1894 1370 A 62 LEU HB3 A 92 GLN HGx 1.0 1.8 4.30 1895 1370 A 62 LEU HB3 A 92 GLN HGy 1.0 1.8 4.30 1896 1371 A 64 PHE HB3 A 88 ILE HG2% 1.0 1.8 3.59 1897 1372 A 44 LEU HDx% A 48 LYS HEx 1.0 1.8 3.75 1898 1372 A 48 LYS HEy A 44 LEU HDx% 1.0 1.8 3.75 1899 1372 A 48 LYS HEy A 44 LEU HDy% 1.0 1.8 3.75 1900 1372 A 44 LEU HDy% A 48 LYS HEx 1.0 1.8 3.75 1901 1373 A 41 THR HA A 40 MET HGx 1.0 1.8 4.34 1902 1373 A 41 THR HA A 40 MET HGy 1.0 1.8 4.34 1903 1374 A 47 LEU HA A 36 PHE HB3 1.0 1.8 5.14 1904 1375 A 36 PHE HB3 A 34 ILE HG1x 1.0 1.8 4.43 1905 1375 A 34 ILE HG1y A 36 PHE HB3 1.0 1.8 4.43 1906 1376 A 52 CYS HA A 53 GLN HG2 1.0 1.8 5.56 1907 1377 A 45 LYS HDy A 73 ASP HBx 1.0 1.8 3.79 1908 1377 A 45 LYS HDx A 73 ASP HBx 1.0 1.8 3.79 1909 1377 A 73 ASP HBy A 45 LYS HDx 1.0 1.8 3.79 1910 1377 A 45 LYS HDy A 73 ASP HBy 1.0 1.8 3.79 1911 1378 A 38 VAL HGx% A 36 PHE HB3 1.0 1.8 4.16 1912 1379 A 47 LEU HDx% A 36 PHE HB3 1.0 1.8 5.42 1913 1380 A 45 LYS HB2 A 73 ASP HBx 1.0 1.8 4.52 1914 1380 A 45 LYS HB2 A 73 ASP HBy 1.0 1.8 4.52 1915 1381 A 53 GLN HG2 A 56 GLY HAx 1.0 1.8 6.00 1916 1381 A 53 GLN HG2 A 56 GLY HAy 1.0 1.8 6.00 1917 1382 A 53 GLN HG2 A 52 CYS HB2 1.0 1.8 5.53 1918 1383 A 13 LEU HA A 12 ASP HBx 1.0 1.8 4.50 1919 1383 A 12 ASP HBy A 13 LEU HA 1.0 1.8 4.50 1920 1384 A 21 TYR HB3 A 39 LYS H 1.0 1.8 5.21 1921 1385 A 45 LYS HEx A 73 ASP HBx 1.0 1.8 4.26 1922 1385 A 45 LYS HEy A 73 ASP HBx 1.0 1.8 4.26 1923 1385 A 73 ASP HBy A 45 LYS HEx 1.0 1.8 4.26 1924 1385 A 45 LYS HEy A 73 ASP HBy 1.0 1.8 4.26 1925 1386 A 14 GLY H A 15 ASP HBx 1.0 1.8 5.18 1926 1386 A 14 GLY H A 15 ASP HBy 1.0 1.8 5.18 1927 1387 A 14 GLY HAx A 15 ASP HBx 1.0 1.8 4.87 1928 1387 A 14 GLY HAy A 15 ASP HBx 1.0 1.8 4.87 1929 1387 A 15 ASP HBy A 14 GLY HAx 1.0 1.8 4.87 1930 1387 A 15 ASP HBy A 14 GLY HAy 1.0 1.8 4.87 1931 1388 A 15 ASP HBy A 13 LEU HDy% 1.0 1.8 4.97 1932 1388 A 13 LEU HDy% A 15 ASP HBx 1.0 1.8 4.97 1933 1389 A 2 SER HBy A 3 ASP HBx 1.0 1.8 4.57 1934 1389 A 2 SER HBx A 3 ASP HBx 1.0 1.8 4.57 1935 1389 A 3 ASP HBy A 2 SER HBx 1.0 1.8 4.57 1936 1389 A 3 ASP HBy A 2 SER HBy 1.0 1.8 4.57 1937 1390 A 59 MET H A 59 MET HGx 1.0 1.8 3.84 1938 1390 A 59 MET H A 59 MET HGy 1.0 1.8 3.84 1939 1391 A 52 CYS H A 59 MET HGx 1.0 1.8 4.81 1940 1391 A 59 MET HGy A 52 CYS H 1.0 1.8 4.81 1941 1392 A 53 GLN H A 59 MET HGx 1.0 1.8 5.58 1942 1392 A 53 GLN H A 59 MET HGy 1.0 1.8 5.58 1943 1393 A 60 ASN HD21 A 59 MET HGx 1.0 1.8 5.28 1944 1393 A 59 MET HGy A 60 ASN HD21 1.0 1.8 5.28 1945 1394 A 48 LYS H A 59 MET HGx 1.0 1.8 6.00 1946 1394 A 59 MET HGy A 48 LYS H 1.0 1.8 6.00 1947 1395 A 65 LEU HA A 66 PHE HB3 1.0 1.8 4.57 1948 1396 A 52 CYS HB2 A 59 MET HGx 1.0 1.8 4.24 1949 1396 A 59 MET HGy A 52 CYS HB2 1.0 1.8 4.24 1950 1397 A 51 TYR HB2 A 59 MET HGx 1.0 1.8 5.06 1951 1397 A 59 MET HGy A 51 TYR HB2 1.0 1.8 5.06 1952 1398 A 52 CYS HB3 A 59 MET HGx 1.0 1.8 3.72 1953 1398 A 59 MET HGy A 52 CYS HB3 1.0 1.8 3.72 1954 1399 A 66 PHE HB3 A 69 GLN HGx 1.0 1.8 5.25 1955 1399 A 66 PHE HB3 A 69 GLN HGy 1.0 1.8 5.25 1956 1400 A 66 PHE HB3 A 71 ILE HG1x 1.0 1.8 4.36 1957 1400 A 66 PHE HB3 A 71 ILE HG1y 1.0 1.8 4.36 1958 1401 A 35 HIS HA A 25 LYS HEx 1.0 1.8 6.00 1959 1401 A 25 LYS HEy A 35 HIS HA 1.0 1.8 6.00 1960 1402 A 75 HIS HB3 A 76 THR HA 1.0 1.8 4.54 1961 1403 A 23 LYS H A 23 LYS HEx 1.0 1.8 4.68 1962 1403 A 23 LYS H A 23 LYS HEy 1.0 1.8 4.68 1963 1404 A 25 LYS H A 25 LYS HEx 1.0 1.8 5.11 1964 1404 A 25 LYS H A 25 LYS HEy 1.0 1.8 5.11 1965 1405 A 25 LYS HA A 25 LYS HEx 1.0 1.8 4.79 1966 1405 A 25 LYS HEy A 25 LYS HA 1.0 1.8 4.79 1967 1406 A 25 LYS HG2 A 25 LYS HEx 1.0 1.8 3.48 1968 1406 A 25 LYS HEy A 25 LYS HG2 1.0 1.8 3.48 1969 1407 A 87 VAL HA A 25 LYS HEx 1.0 1.8 4.26 1970 1407 A 25 LYS HEy A 87 VAL HA 1.0 1.8 4.26 1971 1408 A 71 ILE HA A 75 HIS HB3 1.0 1.8 4.85 1972 1409 A 49 GLU H A 45 LYS HEx 1.0 1.8 5.87 1973 1409 A 49 GLU H A 45 LYS HEy 1.0 1.8 5.87 1974 1410 A 46 LYS H A 45 LYS HEx 1.0 1.8 5.22 1975 1410 A 45 LYS HEy A 46 LYS H 1.0 1.8 5.22 1976 1411 A 41 THR HA A 78 LYS HEx 1.0 1.8 4.17 1977 1411 A 41 THR HA A 78 LYS HEy 1.0 1.8 4.17 1978 1412 A 74 ASN HA A 45 LYS HEx 1.0 1.8 6.00 1979 1412 A 45 LYS HEy A 74 ASN HA 1.0 1.8 6.00 1980 1413 A 46 LYS HA A 45 LYS HEx 1.0 1.8 4.77 1981 1413 A 45 LYS HEy A 46 LYS HA 1.0 1.8 4.77 1982 1414 A 77 PRO HGy A 78 LYS HEx 1.0 1.8 5.65 1983 1414 A 77 PRO HGx A 78 LYS HEx 1.0 1.8 5.65 1984 1414 A 78 LYS HEy A 77 PRO HGx 1.0 1.8 5.65 1985 1414 A 77 PRO HGy A 78 LYS HEy 1.0 1.8 5.65 1986 1415 A 79 GLU HB3 A 78 LYS HEx 1.0 1.8 4.97 1987 1415 A 79 GLU HB3 A 78 LYS HEy 1.0 1.8 4.97 1988 1416 A 45 LYS HB2 A 45 LYS HEx 1.0 1.8 4.22 1989 1416 A 45 LYS HEy A 45 LYS HB2 1.0 1.8 4.22 1990 1417 A 78 LYS HB2 A 78 LYS HEx 1.0 1.8 3.93 1991 1417 A 78 LYS HEy A 78 LYS HB2 1.0 1.8 3.93 1992 1418 A 78 LYS HDx A 78 LYS HEx 1.0 1.8 2.68 1993 1418 A 78 LYS HDy A 78 LYS HEx 1.0 1.8 2.68 1994 1418 A 78 LYS HEy A 78 LYS HDx 1.0 1.8 2.68 1995 1418 A 78 LYS HDy A 78 LYS HEy 1.0 1.8 2.68 1996 1419 A 78 LYS HEy A 78 LYS HGx 1.0 1.8 3.09 1997 1419 A 78 LYS HEx A 78 LYS HGx 1.0 1.8 3.09 1998 1419 A 78 LYS HGy A 78 LYS HEx 1.0 1.8 3.09 1999 1419 A 78 LYS HGy A 78 LYS HEy 1.0 1.8 3.09 2000 1420 A 62 LEU H A 60 ASN HB3 1.0 1.8 5.21 2001 1421 A 66 PHE H A 66 PHE HB2 1.0 1.8 3.96 2002 1422 A 66 PHE HB2 A 71 ILE HG1x 1.0 1.8 4.18 2003 1422 A 71 ILE HG1y A 66 PHE HB2 1.0 1.8 4.18 2004 1423 A 51 TYR HB3 A 48 LYS HGx 1.0 1.8 5.51 2005 1423 A 51 TYR HB3 A 48 LYS HGy 1.0 1.8 5.51 2006 1424 A 64 PHE HB2 A 48 LYS HGx 1.0 1.8 5.72 2007 1424 A 64 PHE HB2 A 48 LYS HGy 1.0 1.8 5.72 2008 1425 A 18 GLU H A 17 LYS HEx 1.0 1.8 4.75 2009 1425 A 18 GLU H A 17 LYS HEy 1.0 1.8 4.75 2010 1426 A 17 LYS H A 17 LYS HEx 1.0 1.8 4.77 2011 1426 A 17 LYS H A 17 LYS HEy 1.0 1.8 4.77 2012 1427 A 17 LYS HA A 17 LYS HEx 1.0 1.8 4.67 2013 1427 A 17 LYS HA A 17 LYS HEy 1.0 1.8 4.67 2014 1428 A 8 PRO HB2 A 7 LYS HEx 1.0 1.8 5.65 2015 1428 A 7 LYS HEy A 8 PRO HB2 1.0 1.8 5.65 2016 1429 A 7 LYS HEy A 7 LYS HGx 1.0 1.8 3.50 2017 1429 A 7 LYS HEx A 7 LYS HGx 1.0 1.8 3.50 2018 1429 A 7 LYS HGy A 7 LYS HEx 1.0 1.8 3.50 2019 1429 A 7 LYS HGy A 7 LYS HEy 1.0 1.8 3.50 2020 1430 A 17 LYS HEy A 17 LYS HGx 1.0 1.8 3.88 2021 1430 A 17 LYS HEx A 17 LYS HGx 1.0 1.8 3.88 2022 1430 A 17 LYS HGy A 17 LYS HEx 1.0 1.8 3.88 2023 1430 A 17 LYS HGy A 17 LYS HEy 1.0 1.8 3.88 2024 1431 A 46 LYS HEy A 46 LYS HGx 1.0 1.8 3.98 2025 1431 A 46 LYS HEx A 46 LYS HGx 1.0 1.8 3.98 2026 1431 A 46 LYS HGy A 46 LYS HEx 1.0 1.8 3.98 2027 1431 A 46 LYS HGy A 46 LYS HEy 1.0 1.8 3.98 2028 1432 A 83 GLU H A 86 ASP HBy 1.0 1.8 4.72 2029 1433 A 46 LYS H A 46 LYS HEx 1.0 1.8 5.76 2030 1433 A 46 LYS HEy A 46 LYS H 1.0 1.8 5.76 2031 1434 A 51 TYR HB3 A 51 TYR HE2 1.0 1.8 4.87 2032 1435 A 63 ARG HA A 63 ARG HDx 1.0 1.8 3.90 2033 1435 A 63 ARG HDy A 63 ARG HA 1.0 1.8 3.90 2034 1436 A 9 SER HA A 7 LYS HEx 1.0 1.8 4.59 2035 1436 A 7 LYS HEy A 9 SER HA 1.0 1.8 4.59 2036 1437 A 17 LYS HEx A 18 GLU HGx 1.0 1.8 5.19 2037 1437 A 17 LYS HEy A 18 GLU HGx 1.0 1.8 5.19 2038 1437 A 18 GLU HGy A 17 LYS HEx 1.0 1.8 5.19 2039 1437 A 18 GLU HGy A 17 LYS HEy 1.0 1.8 5.19 2040 1438 A 17 LYS HBy A 17 LYS HEx 1.0 1.8 4.11 2041 1438 A 17 LYS HBx A 17 LYS HEx 1.0 1.8 4.11 2042 1438 A 17 LYS HEy A 17 LYS HBx 1.0 1.8 4.11 2043 1438 A 17 LYS HBy A 17 LYS HEy 1.0 1.8 4.11 2044 1439 A 57 VAL HGy% A 30 ASP HB2 1.0 1.8 4.25 2045 1440 A 36 PHE H A 35 HIS HB2 1.0 1.8 3.98 2046 1441 A 35 HIS HB2 A 34 ILE HG1x 1.0 1.8 4.44 2047 1441 A 34 ILE HG1y A 35 HIS HB2 1.0 1.8 4.44 2048 1442 A 42 THR HG2% A 43 HIS HB3 1.0 1.8 5.21 2049 1443 A 43 HIS HB3 A 74 ASN HA 1.0 1.8 5.17 2050 1444 A 47 LEU HA A 48 LYS HA 1.0 1.8 4.91 2051 1445 A 45 LYS HA A 43 HIS HB3 1.0 1.8 5.19 2052 1446 A 45 LYS HA A 48 LYS HA 1.0 1.8 5.67 2053 1447 A 48 LYS HA A 48 LYS HEx 1.0 1.8 4.56 2054 1447 A 48 LYS HEy A 48 LYS HA 1.0 1.8 4.56 2055 1448 A 48 LYS HA A 48 LYS HDx 1.0 1.8 4.01 2056 1448 A 48 LYS HDy A 48 LYS HA 1.0 1.8 4.01 2057 1449 A 48 LYS HA A 48 LYS HGx 1.0 1.8 3.90 2058 1449 A 48 LYS HA A 48 LYS HGy 1.0 1.8 3.90 2059 1450 A 71 ILE H A 70 ARG HDx 1.0 1.8 5.24 2060 1450 A 71 ILE H A 70 ARG HDy 1.0 1.8 5.24 2061 1451 A 43 HIS HB2 A 43 HIS H 1.0 1.8 3.91 2062 1452 A 43 HIS HB2 A 42 THR HG2% 1.0 1.8 4.57 2063 1453 A 75 HIS HB2 A 80 LEU HG 1.0 1.8 5.20 2064 1454 A 75 HIS HB2 A 44 LEU HDx% 1.0 1.8 5.41 2065 1454 A 75 HIS HB2 A 44 LEU HDy% 1.0 1.8 5.41 2066 1455 A 80 LEU HDx% A 75 HIS HB2 1.0 1.8 4.29 2067 1456 A 75 HIS HB2 A 76 THR H 1.0 1.8 4.21 2068 1457 A 26 VAL HGx% A 51 TYR HB2 1.0 1.8 5.57 2069 1458 A 34 ILE HD1% A 51 TYR HB2 1.0 1.8 5.15 2070 1459 A 49 GLU HA A 52 CYS HB2 1.0 1.8 4.58 2071 1460 A 65 LEU HB3 A 68 GLY HA3 1.0 1.8 5.36 2072 1461 A 66 PHE HD% A 67 GLU HA 1.0 1.8 4.64 2073 1462 A 66 PHE HE% A 67 GLU HA 1.0 1.8 5.51 2074 1463 A 68 GLY HA2 A 67 GLU HA 1.0 1.8 4.78 2075 1464 A 67 GLU HG2 A 67 GLU HA 1.0 1.8 3.98 2076 1465 A 45 LYS HA A 73 ASP HA 1.0 1.8 3.74 2077 1466 A 45 LYS HA A 48 LYS HDx 1.0 1.8 3.92 2078 1466 A 45 LYS HA A 48 LYS HDy 1.0 1.8 3.92 2079 1467 A 45 LYS HA A 48 LYS HGx 1.0 1.8 4.65 2080 1467 A 45 LYS HA A 48 LYS HGy 1.0 1.8 4.65 2081 1468 A 61 SER HB2 A 58 PRO HDx 1.0 1.8 4.83 2082 1468 A 61 SER HB2 A 58 PRO HDy 1.0 1.8 4.83 2083 1469 A 52 CYS HA A 58 PRO HDx 1.0 1.8 6.00 2084 1469 A 52 CYS HA A 58 PRO HDy 1.0 1.8 6.00 2085 1470 A 56 GLY HAy A 58 PRO HDx 1.0 1.8 6.00 2086 1470 A 56 GLY HAx A 58 PRO HDx 1.0 1.8 6.00 2087 1470 A 58 PRO HDy A 56 GLY HAx 1.0 1.8 6.00 2088 1470 A 56 GLY HAy A 58 PRO HDy 1.0 1.8 6.00 2089 1471 A 45 LYS HA A 48 LYS HBx 1.0 1.8 4.24 2090 1471 A 48 LYS HBy A 45 LYS HA 1.0 1.8 4.24 2091 1472 A 23 LYS H A 85 GLU HA 1.0 1.8 5.84 2092 1473 A 47 LEU HA A 36 PHE HE1 1.0 1.8 5.19 2093 1474 A 84 GLU HA A 85 GLU HA 1.0 1.8 4.70 2094 1475 A 29 GLN HA A 28 GLY HAx 1.0 1.8 4.26 2095 1475 A 29 GLN HA A 28 GLY HAy 1.0 1.8 4.26 2096 1476 A 26 VAL HB A 28 GLY HAx 1.0 1.8 5.98 2097 1476 A 26 VAL HB A 28 GLY HAy 1.0 1.8 5.98 2098 1477 A 47 LEU HA A 49 GLU HBx 1.0 1.8 5.49 2099 1477 A 47 LEU HA A 49 GLU HBy 1.0 1.8 5.49 2100 1478 A 27 ILE HB A 28 GLY HAx 1.0 1.8 4.51 2101 1478 A 28 GLY HAy A 27 ILE HB 1.0 1.8 4.51 2102 1479 A 47 LEU HA A 47 LEU HDx% 1.0 1.8 3.79 2103 1480 A 27 ILE H A 28 GLY HAx 1.0 1.8 5.25 2104 1480 A 27 ILE H A 28 GLY HAy 1.0 1.8 5.25 2105 1481 A 92 GLN H A 28 GLY HAx 1.0 1.8 6.00 2106 1481 A 92 GLN H A 28 GLY HAy 1.0 1.8 6.00 2107 1482 A 27 ILE HA A 28 GLY HAx 1.0 1.8 4.34 2108 1482 A 27 ILE HA A 28 GLY HAy 1.0 1.8 4.34 2109 1483 A 73 ASP HA A 44 LEU H 1.0 1.8 5.62 2110 1484 A 80 LEU H A 77 PRO HDx 1.0 1.8 5.50 2111 1484 A 77 PRO HDy A 80 LEU H 1.0 1.8 5.50 2112 1485 A 62 LEU HA A 61 SER HB3 1.0 1.8 5.24 2113 1486 A 41 THR HB A 77 PRO HDx 1.0 1.8 5.04 2114 1486 A 77 PRO HDy A 41 THR HB 1.0 1.8 5.04 2115 1487 A 76 THR HB A 77 PRO HDx 1.0 1.8 3.47 2116 1487 A 77 PRO HDy A 76 THR HB 1.0 1.8 3.47 2117 1488 A 41 THR HA A 77 PRO HDx 1.0 1.8 3.38 2118 1488 A 41 THR HA A 77 PRO HDy 1.0 1.8 3.38 2119 1489 A 71 ILE HG2% A 73 ASP HA 1.0 1.8 4.01 2120 1490 A 80 LEU HDx% A 77 PRO HDx 1.0 1.8 4.26 2121 1490 A 80 LEU HDx% A 77 PRO HDy 1.0 1.8 4.26 2122 1491 A 21 TYR HA A 39 LYS HA 1.0 1.8 4.91 2123 1492 A 15 ASP HA A 14 GLY HAx 1.0 1.8 4.35 2124 1492 A 14 GLY HAy A 15 ASP HA 1.0 1.8 4.35 2125 1493 A 52 CYS HA A 59 MET HGx 1.0 1.8 4.50 2126 1493 A 52 CYS HA A 59 MET HGy 1.0 1.8 4.50 2127 1494 A 13 LEU HA A 14 GLY HAx 1.0 1.8 4.62 2128 1494 A 14 GLY HAy A 13 LEU HA 1.0 1.8 4.62 2129 1495 A 53 GLN HA A 56 GLY HAx 1.0 1.8 3.97 2130 1495 A 53 GLN HA A 56 GLY HAy 1.0 1.8 3.97 2131 1496 A 78 LYS HA A 81 GLY H 1.0 1.8 4.12 2132 1497 A 79 GLU HA A 81 GLY H 1.0 1.8 4.43 2133 1498 A 42 THR HB A 39 LYS HBx 1.0 1.8 4.70 2134 1498 A 39 LYS HBy A 42 THR HB 1.0 1.8 4.70 2135 1499 A 42 THR HB A 76 THR HG2% 1.0 1.8 5.51 2136 1500 A 30 ASP HA A 31 SER HBx 1.0 1.8 5.27 2137 1500 A 30 ASP HA A 31 SER HBy 1.0 1.8 5.27 2138 1501 A 49 GLU HA A 52 CYS HB3 1.0 1.8 4.25 2139 1502 A 49 GLU HA A 49 GLU HG3 1.0 1.8 4.07 2140 1503 A 54 ARG HA A 53 GLN HBx 1.0 1.8 4.51 2141 1503 A 53 GLN HBy A 54 ARG HA 1.0 1.8 4.51 2142 1504 A 27 ILE HG2% A 31 SER HBx 1.0 1.8 5.28 2143 1504 A 27 ILE HG2% A 31 SER HBy 1.0 1.8 5.28 2144 1505 A 36 PHE HB3 A 50 SER HBx 1.0 1.8 4.99 2145 1505 A 50 SER HBy A 36 PHE HB3 1.0 1.8 4.99 2146 1506 A 54 ARG HA A 54 ARG HGx 1.0 1.8 3.53 2147 1506 A 54 ARG HGy A 54 ARG HA 1.0 1.8 3.53 2148 1507 A 51 TYR HA A 34 ILE HB 1.0 1.8 3.63 2149 1508 A 28 GLY H A 31 SER HA 1.0 1.8 5.21 2150 1509 A 49 GLU H A 50 SER HBx 1.0 1.8 5.52 2151 1509 A 49 GLU H A 50 SER HBy 1.0 1.8 5.52 2152 1510 A 31 SER HA A 30 ASP HA 1.0 1.8 5.15 2153 1511 A 51 TYR HA A 51 TYR HE2 1.0 1.8 5.30 2154 1512 A 51 TYR HA A 55 GLN HBx 1.0 1.8 4.13 2155 1512 A 55 GLN HBy A 51 TYR HA 1.0 1.8 4.13 2156 1513 A 51 TYR HA A 34 ILE HG2% 1.0 1.8 3.68 2157 1514 A 53 GLN HA A 52 CYS H 1.0 1.8 5.39 2158 1515 A 32 SER H A 29 GLN HA 1.0 1.8 5.92 2159 1516 A 78 LYS H A 40 MET HA 1.0 1.8 6.00 2160 1517 A 53 GLN HA A 52 CYS HB3 1.0 1.8 4.72 2161 1518 A 49 GLU HG2 A 46 LYS HA 1.0 1.8 5.07 2162 1519 A 40 MET HA A 42 THR HG2% 1.0 1.8 5.90 2163 1520 A 68 GLY HA2 A 67 GLU HG3 1.0 1.8 6.00 2164 1521 A 22 ILE HG13 A 40 MET HA 1.0 1.8 4.76 2165 1522 A 5 GLU HA A 4 GLN HGx 1.0 1.8 4.98 2166 1522 A 4 GLN HGy A 5 GLU HA 1.0 1.8 4.98 2167 1523 A 80 LEU HA A 69 GLN HGx 1.0 1.8 5.41 2168 1523 A 80 LEU HA A 69 GLN HGy 1.0 1.8 5.41 2169 1524 A 84 GLU HA A 85 GLU HBx 1.0 1.8 5.74 2170 1524 A 84 GLU HA A 85 GLU HBy 1.0 1.8 5.74 2171 1525 A 80 LEU HA A 79 GLU HB3 1.0 1.8 4.44 2172 1526 A 42 THR HA A 42 THR HG2% 1.0 1.8 4.23 2173 1527 A 80 LEU HA A 75 HIS HD2 1.0 1.8 5.55 2174 1528 A 77 PRO HA A 76 THR HB 1.0 1.8 4.91 2175 1529 A 84 GLU HA A 83 GLU HA 1.0 1.8 5.42 2176 1530 A 42 THR HA A 43 HIS HA 1.0 1.8 5.77 2177 1531 A 74 ASN HA A 43 HIS HA 1.0 1.8 6.00 2178 1532 A 11 GLU HA A 12 ASP HBx 1.0 1.8 5.03 2179 1532 A 11 GLU HA A 12 ASP HBy 1.0 1.8 5.03 2180 1533 A 45 LYS HG3 A 74 ASN HA 1.0 1.8 5.86 2181 1534 A 57 VAL HGx% A 55 GLN HA 1.0 1.8 4.56 2182 1535 A 7 LYS HA A 6 ALA HA 1.0 1.8 5.53 2183 1536 A 11 GLU HA A 12 ASP HA 1.0 1.8 5.57 2184 1537 A 22 ILE HD1% A 77 PRO HA 1.0 1.8 5.33 2185 1538 A 18 GLU HA A 19 GLY HAx 1.0 1.8 4.31 2186 1538 A 19 GLY HAy A 18 GLU HA 1.0 1.8 4.31 2187 1539 A 20 GLU HA A 19 GLY HAx 1.0 1.8 4.61 2188 1539 A 19 GLY HAy A 20 GLU HA 1.0 1.8 4.61 2189 1540 A 21 TYR HA A 20 GLU HA 1.0 1.8 4.54 2190 1541 A 4 GLN HA A 3 ASP HBx 1.0 1.8 5.68 2191 1541 A 3 ASP HBy A 4 GLN HA 1.0 1.8 5.68 2192 1542 A 16 LYS HA A 15 ASP HBx 1.0 1.8 6.00 2193 1542 A 15 ASP HBy A 16 LYS HA 1.0 1.8 6.00 2194 1543 A 53 GLN HA A 50 SER HA 1.0 1.8 5.60 2195 1544 A 53 GLN HG2 A 50 SER HA 1.0 1.8 5.00 2196 1545 A 17 LYS HA A 17 LYS HDx 1.0 1.8 5.20 2197 1545 A 17 LYS HDy A 17 LYS HA 1.0 1.8 5.20 2198 1546 A 41 THR HA A 76 THR HB 1.0 1.8 4.59 2199 1547 A 33 GLU HA A 32 SER HA 1.0 1.8 5.69 2200 1548 A 33 GLU HA A 34 ILE HA 1.0 1.8 6.00 2201 1549 A 69 GLN HB3 A 70 ARG HA 1.0 1.8 4.93 2202 1550 A 65 LEU HA A 70 ARG HA 1.0 1.8 5.05 2203 1551 A 80 LEU HDx% A 76 THR HB 1.0 1.8 5.91 2204 1552 A 92 GLN HA A 62 LEU HA 1.0 1.8 5.27 2205 1553 A 21 TYR HA A 22 ILE HA 1.0 1.8 4.62 2206 1554 A 38 VAL H A 23 LYS HA 1.0 1.8 4.52 2207 1555 A 35 HIS HA A 25 LYS HA 1.0 1.8 4.12 2208 1556 A 35 HIS HA A 36 PHE HB3 1.0 1.8 5.12 2209 1557 A 47 LEU HDy% A 48 LYS HEx 1.0 1.8 3.88 2210 1557 A 47 LEU HDy% A 48 LYS HEy 1.0 1.8 3.88 2211 1558 A 80 LEU HDy% A 70 ARG HA 1.0 1.8 5.45 2212 1559 A 80 LEU HDy% A 79 GLU HGx 1.0 1.8 4.24 2213 1559 A 80 LEU HDy% A 79 GLU HGy 1.0 1.8 4.24 2214 1560 A 69 GLN HB3 A 80 LEU HDy% 1.0 1.8 3.75 2215 1561 A 80 LEU HDy% A 80 LEU HBx 1.0 1.8 3.18 2216 1561 A 80 LEU HBy A 80 LEU HDy% 1.0 1.8 3.18 2217 1562 A 71 ILE HD1% A 80 LEU HDy% 1.0 1.8 2.83 2218 1563 A 80 LEU HDx% A 69 GLN HB3 1.0 1.8 4.35 2219 1564 A 80 LEU HDx% A 71 ILE HG1x 1.0 1.8 3.79 2220 1564 A 80 LEU HDx% A 71 ILE HG1y 1.0 1.8 3.79 2221 1565 A 65 LEU HDy% A 91 TYR H 1.0 1.8 4.90 2222 1566 A 88 ILE HD1% A 87 VAL HGx% 1.0 1.8 4.20 2223 1566 A 88 ILE HD1% A 87 VAL HGy% 1.0 1.8 4.20 2224 1567 A 71 ILE HD1% A 69 GLN HA 1.0 1.8 4.07 2225 1568 A 34 ILE HG2% A 36 PHE HB3 1.0 1.8 4.66 2226 1569 A 65 LEU HDx% A 91 TYR HB3 1.0 1.8 4.11 2227 1570 A 71 ILE HD1% A 69 GLN HGx 1.0 1.8 4.36 2228 1570 A 71 ILE HD1% A 69 GLN HGy 1.0 1.8 4.36 2229 1571 A 42 THR HG2% A 38 VAL HGy% 1.0 1.8 3.42 2230 1572 A 42 THR HG2% A 44 LEU HDx% 1.0 1.8 3.76 2231 1572 A 44 LEU HDy% A 42 THR HG2% 1.0 1.8 3.76 2232 1573 A 65 LEU HDx% A 65 LEU HB3 1.0 1.8 2.94 2233 1574 A 76 THR HG2% A 44 LEU HDx% 1.0 1.8 4.31 2234 1574 A 44 LEU HDy% A 76 THR HG2% 1.0 1.8 4.31 2235 1575 A 22 ILE HD1% A 38 VAL HGy% 1.0 1.8 3.19 2236 1576 A 57 VAL HGy% A 32 SER H 1.0 1.8 5.82 2237 1577 A 34 ILE HD1% A 54 ARG HBx 1.0 1.8 3.65 2238 1577 A 34 ILE HD1% A 54 ARG HBy 1.0 1.8 3.65 2239 1578 A 36 PHE HD% A 24 LEU HDx% 1.0 1.8 4.17 2240 1578 A 24 LEU HDy% A 36 PHE HD% 1.0 1.8 4.17 2241 1579 A 36 PHE HE2 A 24 LEU HDx% 1.0 1.8 4.40 2242 1579 A 24 LEU HDy% A 36 PHE HE2 1.0 1.8 4.40 2243 1580 A 34 ILE H A 25 LYS HG2 1.0 1.8 4.00 2244 1581 A 25 LYS HG2 A 33 GLU HGx 1.0 1.8 4.05 2245 1581 A 25 LYS HG2 A 33 GLU HGy 1.0 1.8 4.05 2246 1582 A 25 LYS HG2 A 33 GLU HB2 1.0 1.8 3.65 2247 1583 A 25 LYS HG2 A 25 LYS HDx 1.0 1.8 2.90 2248 1583 A 25 LYS HDy A 25 LYS HG2 1.0 1.8 2.90 2249 1584 A 42 THR H A 76 THR HG2% 1.0 1.8 4.22 2250 1585 A 76 THR HG2% A 78 LYS HGx 1.0 1.8 4.26 2251 1585 A 78 LYS HGy A 76 THR HG2% 1.0 1.8 4.26 2252 1586 A 89 GLU HG3 A 87 VAL HGx% 1.0 1.8 3.91 2253 1586 A 87 VAL HGy% A 89 GLU HG3 1.0 1.8 3.91 2254 1587 A 41 THR HG2% A 40 MET HA 1.0 1.8 3.99 2255 1588 A 67 GLU HG2 A 68 GLY HA3 1.0 1.8 5.70 2256 1589 A 67 GLU HG2 A 66 PHE HB2 1.0 1.8 4.72 2257 1590 A 26 VAL H A 34 ILE HG1x 1.0 1.8 5.42 2258 1590 A 34 ILE HG1y A 26 VAL H 1.0 1.8 5.42 2259 1591 A 24 LEU H A 23 LYS HGx 1.0 1.8 4.80 2260 1591 A 24 LEU H A 23 LYS HGy 1.0 1.8 4.80 2261 1592 A 55 GLN HE22 A 34 ILE HG1x 1.0 1.8 4.22 2262 1592 A 55 GLN HE22 A 34 ILE HG1y 1.0 1.8 4.22 2263 1593 A 45 LYS HG3 A 43 HIS HB2 1.0 1.8 6.00 2264 1594 A 65 LEU HB3 A 70 ARG HDx 1.0 1.8 6.00 2265 1594 A 65 LEU HB3 A 70 ARG HDy 1.0 1.8 6.00 2266 1595 A 88 ILE HG2% A 65 LEU HB3 1.0 1.8 5.35 2267 1596 A 81 GLY H A 78 LYS HGx 1.0 1.8 5.38 2268 1596 A 78 LYS HGy A 81 GLY H 1.0 1.8 5.38 2269 1597 A 22 ILE HG12 A 40 MET HA 1.0 1.8 4.13 2270 1598 A 22 ILE HG12 A 77 PRO HBx 1.0 1.8 4.57 2271 1598 A 22 ILE HG12 A 77 PRO HBy 1.0 1.8 4.57 2272 1599 A 69 GLN HB2 A 67 GLU HG3 1.0 1.8 4.87 2273 1600 A 80 LEU H A 80 LEU HG 1.0 1.8 3.89 2274 1601 A 17 LYS HA A 17 LYS HGx 1.0 1.8 3.48 2275 1601 A 17 LYS HGy A 17 LYS HA 1.0 1.8 3.48 2276 1602 A 80 LEU HG A 71 ILE HG1x 1.0 1.8 3.88 2277 1602 A 80 LEU HG A 71 ILE HG1y 1.0 1.8 3.88 2278 1603 A 24 LEU HB2 A 22 ILE HD1% 1.0 1.8 4.52 2279 1604 A 33 GLU HB2 A 25 LYS HDx 1.0 1.8 3.27 2280 1604 A 25 LYS HDy A 33 GLU HB2 1.0 1.8 3.27 2281 1605 A 65 LEU HDy% A 71 ILE HB 1.0 1.8 4.21 2282 1606 A 75 HIS H A 71 ILE HB 1.0 1.8 5.82 2283 1607 A 25 LYS HDy A 33 GLU HGx 1.0 1.8 4.24 2284 1607 A 25 LYS HDx A 33 GLU HGx 1.0 1.8 4.24 2285 1607 A 33 GLU HGy A 25 LYS HDx 1.0 1.8 4.24 2286 1607 A 25 LYS HDy A 33 GLU HGy 1.0 1.8 4.24 2287 1608 A 71 ILE HD1% A 71 ILE HB 1.0 1.8 3.25 2288 1609 A 23 LYS H A 23 LYS HDx 1.0 1.8 4.18 2289 1609 A 23 LYS H A 23 LYS HDy 1.0 1.8 4.18 2290 1610 A 64 PHE HA A 63 ARG HBx 1.0 1.8 4.43 2291 1610 A 64 PHE HA A 63 ARG HBy 1.0 1.8 4.43 2292 1611 A 7 LYS H A 7 LYS HDx 1.0 1.8 4.23 2293 1611 A 7 LYS H A 7 LYS HDy 1.0 1.8 4.23 2294 1612 A 64 PHE H A 63 ARG HBx 1.0 1.8 3.82 2295 1612 A 63 ARG HBy A 64 PHE H 1.0 1.8 3.82 2296 1613 A 23 LYS H A 22 ILE HB 1.0 1.8 3.53 2297 1614 A 13 LEU HG A 12 ASP HBx 1.0 1.8 4.89 2298 1614 A 12 ASP HBy A 13 LEU HG 1.0 1.8 4.89 2299 1615 A 93 GLU HB3 A 91 TYR HB3 1.0 1.8 4.65 2300 1616 A 22 ILE HB A 84 GLU HGx 1.0 1.8 4.14 2301 1616 A 22 ILE HB A 84 GLU HGy 1.0 1.8 4.14 2302 1617 A 49 GLU H A 48 LYS HBx 1.0 1.8 4.07 2303 1617 A 48 LYS HBy A 49 GLU H 1.0 1.8 4.07 2304 1618 A 50 SER H A 46 LYS HDx 1.0 1.8 5.03 2305 1618 A 50 SER H A 46 LYS HDy 1.0 1.8 5.03 2306 1619 A 50 SER H A 48 LYS HBx 1.0 1.8 5.32 2307 1619 A 48 LYS HBy A 50 SER H 1.0 1.8 5.32 2308 1620 A 36 PHE HD% A 46 LYS HDx 1.0 1.8 4.43 2309 1620 A 46 LYS HDy A 36 PHE HD% 1.0 1.8 4.43 2310 1621 A 47 LEU HA A 46 LYS HDx 1.0 1.8 4.48 2311 1621 A 47 LEU HA A 46 LYS HDy 1.0 1.8 4.48 2312 1622 A 47 LEU HG A 48 LYS HBx 1.0 1.8 4.33 2313 1622 A 47 LEU HG A 48 LYS HBy 1.0 1.8 4.33 2314 1623 A 51 TYR HB2 A 48 LYS HBx 1.0 1.8 5.47 2315 1623 A 48 LYS HBy A 51 TYR HB2 1.0 1.8 5.47 2316 1624 A 69 GLN H A 67 GLU HB2 1.0 1.8 6.00 2317 1625 A 69 GLN H A 70 ARG HBx 1.0 1.8 6.00 2318 1625 A 69 GLN H A 70 ARG HBy 1.0 1.8 6.00 2319 1626 A 45 LYS H A 46 LYS HBx 1.0 1.8 5.27 2320 1626 A 45 LYS H A 46 LYS HBy 1.0 1.8 5.27 2321 1627 A 65 LEU HB2 A 91 TYR H 1.0 1.8 5.69 2322 1628 A 65 LEU HB2 A 66 PHE H 1.0 1.8 3.77 2323 1629 A 21 TYR HA A 20 GLU HBx 1.0 1.8 4.83 2324 1629 A 20 GLU HBy A 21 TYR HA 1.0 1.8 4.83 2325 1630 A 34 ILE HB A 33 GLU HA 1.0 1.8 5.19 2326 1631 A 90 VAL HA A 65 LEU HB2 1.0 1.8 4.84 2327 1632 A 82 MET HE% A 86 ASP HBx 1.0 1.8 4.84 2328 1633 A 64 PHE HB3 A 71 ILE HG1x 1.0 1.8 4.55 2329 1633 A 64 PHE HB3 A 71 ILE HG1y 1.0 1.8 4.55 2330 1634 A 82 MET HE% A 80 LEU HBx 1.0 1.8 3.71 2331 1634 A 80 LEU HBy A 82 MET HE% 1.0 1.8 3.71 2332 1635 A 24 LEU HB2 A 82 MET HE% 1.0 1.8 4.44 2333 1636 A 84 GLU HB3 A 22 ILE H 1.0 1.8 5.53 2334 1637 A 26 VAL H A 33 GLU HB2 1.0 1.8 4.61 2335 1638 A 78 LYS H A 82 MET HGx 1.0 1.8 5.05 2336 1638 A 78 LYS H A 82 MET HGy 1.0 1.8 5.05 2337 1639 A 22 ILE HG2% A 84 GLU HB3 1.0 1.8 3.44 2338 1640 A 80 LEU H A 82 MET HGx 1.0 1.8 5.49 2339 1640 A 82 MET HGy A 80 LEU H 1.0 1.8 5.49 2340 1641 A 28 GLY HAx A 89 GLU HBx 1.0 1.8 5.15 2341 1641 A 89 GLU HBy A 28 GLY HAx 1.0 1.8 5.15 2342 1641 A 89 GLU HBy A 28 GLY HAy 1.0 1.8 5.15 2343 1641 A 28 GLY HAy A 89 GLU HBx 1.0 1.8 5.15 2344 1642 A 51 TYR HB2 A 54 ARG HBx 1.0 1.8 5.58 2345 1642 A 54 ARG HBy A 51 TYR HB2 1.0 1.8 5.58 2346 1643 A 18 GLU HBx A 19 GLY HAx 1.0 1.8 4.07 2347 1643 A 19 GLY HAy A 18 GLU HBx 1.0 1.8 4.07 2348 1643 A 18 GLU HBy A 19 GLY HAy 1.0 1.8 4.07 2349 1643 A 18 GLU HBy A 19 GLY HAx 1.0 1.8 4.07 2350 1644 A 87 VAL HB A 25 LYS HEx 1.0 1.8 4.11 2351 1644 A 25 LYS HEy A 87 VAL HB 1.0 1.8 4.11 2352 1645 A 75 HIS HA A 79 GLU HB3 1.0 1.8 4.53 2353 1646 A 60 ASN HA A 59 MET HBx 1.0 1.8 4.23 2354 1646 A 59 MET HBy A 60 ASN HA 1.0 1.8 4.23 2355 1647 A 61 SER HB2 A 58 PRO HGx 1.0 1.8 3.71 2356 1647 A 61 SER HB2 A 58 PRO HGy 1.0 1.8 3.71 2357 1648 A 52 CYS HA A 59 MET HE% 1.0 1.8 4.03 2358 1649 A 59 MET HE% A 51 TYR HB2 1.0 1.8 4.61 2359 1650 A 29 GLN HB2 A 29 GLN HGx 1.0 1.8 2.78 2360 1650 A 29 GLN HGy A 29 GLN HB2 1.0 1.8 2.78 2361 1651 A 59 MET HE% A 62 LEU HDx% 1.0 1.8 3.31 2362 1651 A 62 LEU HDy% A 59 MET HE% 1.0 1.8 3.31 2363 1652 A 66 PHE HD% A 69 GLN HB2 1.0 1.8 5.04 2364 1653 A 65 LEU HA A 69 GLN HB3 1.0 1.8 5.09 2365 1654 A 53 GLN HBx A 54 ARG HDx 1.0 1.8 5.30 2366 1654 A 53 GLN HBy A 54 ARG HDx 1.0 1.8 5.30 2367 1654 A 54 ARG HDy A 53 GLN HBx 1.0 1.8 5.30 2368 1654 A 54 ARG HDy A 53 GLN HBy 1.0 1.8 5.30 2369 1655 A 26 VAL HB A 88 ILE H 1.0 1.8 4.50 2370 1656 A 88 ILE HG2% A 26 VAL HB 1.0 1.8 3.55 2371 1657 A 81 GLY H A 79 GLU HGx 1.0 1.8 5.03 2372 1657 A 81 GLY H A 79 GLU HGy 1.0 1.8 5.03 2373 1658 A 75 HIS HB3 A 79 GLU HGx 1.0 1.8 5.83 2374 1658 A 75 HIS HB3 A 79 GLU HGy 1.0 1.8 5.83 2375 1659 A 80 LEU HG A 79 GLU HGx 1.0 1.8 4.22 2376 1659 A 79 GLU HGy A 80 LEU HG 1.0 1.8 4.22 2377 1660 A 69 GLN HGy A 80 LEU HBx 1.0 1.8 3.83 2378 1660 A 80 LEU HBy A 69 GLN HGx 1.0 1.8 3.83 2379 1660 A 80 LEU HBy A 69 GLN HGy 1.0 1.8 3.83 2380 1660 A 69 GLN HGx A 80 LEU HBx 1.0 1.8 3.83 2381 1661 A 86 ASP HA A 85 GLU HGx 1.0 1.8 5.22 2382 1661 A 85 GLU HGy A 86 ASP HA 1.0 1.8 5.22 2383 1662 A 91 TYR HA A 29 GLN HGx 1.0 1.8 5.40 2384 1662 A 29 GLN HGy A 91 TYR HA 1.0 1.8 5.40 2385 1663 A 61 SER HA A 58 PRO HBx 1.0 1.8 4.59 2386 1663 A 58 PRO HBy A 61 SER HA 1.0 1.8 4.59 2387 1664 A 23 LYS HEy A 85 GLU HGx 1.0 1.8 4.09 2388 1664 A 23 LYS HEx A 85 GLU HGx 1.0 1.8 4.09 2389 1664 A 85 GLU HGy A 23 LYS HEx 1.0 1.8 4.09 2390 1664 A 23 LYS HEy A 85 GLU HGy 1.0 1.8 4.09 2391 1665 A 53 GLN HG2 A 52 CYS HB3 1.0 1.8 4.43 2392 1666 A 74 ASN HA A 73 ASP HBx 1.0 1.8 5.49 2393 1666 A 73 ASP HBy A 74 ASN HA 1.0 1.8 5.49 2394 1667 A 66 PHE HB3 A 80 LEU HBx 1.0 1.8 4.40 2395 1667 A 80 LEU HBy A 66 PHE HB3 1.0 1.8 4.40 2396 1668 A 57 VAL HGy% A 59 MET HGx 1.0 1.8 4.41 2397 1668 A 57 VAL HGy% A 59 MET HGy 1.0 1.8 4.41 2398 1669 A 88 ILE HD1% A 66 PHE HB3 1.0 1.8 4.31 2399 1670 A 25 LYS HEx A 33 GLU HGx 1.0 1.8 5.80 2400 1670 A 25 LYS HEy A 33 GLU HGx 1.0 1.8 5.80 2401 1670 A 33 GLU HGy A 25 LYS HEx 1.0 1.8 5.80 2402 1670 A 25 LYS HEy A 33 GLU HGy 1.0 1.8 5.80 2403 1671 A 44 LEU HG A 75 HIS HB3 1.0 1.8 4.33 2404 1672 A 53 GLN H A 51 TYR HB3 1.0 1.8 4.88 2405 1673 A 90 VAL HA A 64 PHE HB2 1.0 1.8 5.68 2406 1674 A 24 LEU H A 36 PHE HB2 1.0 1.8 5.43 2407 1675 A 93 GLU HB2 A 63 ARG HDx 1.0 1.8 4.52 2408 1675 A 63 ARG HDy A 93 GLU HB2 1.0 1.8 4.52 2409 1676 A 30 ASP HB2 A 28 GLY HAx 1.0 1.8 5.12 2410 1676 A 30 ASP HB2 A 28 GLY HAy 1.0 1.8 5.12 2411 1677 A 47 LEU HA A 46 LYS HEx 1.0 1.8 5.36 2412 1677 A 47 LEU HA A 46 LYS HEy 1.0 1.8 5.36 2413 1678 A 19 GLY H A 17 LYS HEx 1.0 1.8 6.00 2414 1678 A 19 GLY H A 17 LYS HEy 1.0 1.8 6.00 2415 1679 A 28 GLY H A 30 ASP HB2 1.0 1.8 6.00 2416 1680 A 32 SER H A 30 ASP HB2 1.0 1.8 4.56 2417 1681 A 7 LYS HEy A 9 SER HBx 1.0 1.8 5.07 2418 1681 A 7 LYS HEx A 9 SER HBx 1.0 1.8 5.07 2419 1681 A 9 SER HBy A 7 LYS HEx 1.0 1.8 5.07 2420 1681 A 7 LYS HEy A 9 SER HBy 1.0 1.8 5.07 2421 1682 A 48 LYS HA A 51 TYR HB2 1.0 1.8 3.97 2422 1683 A 45 LYS HB3 A 43 HIS HB3 1.0 1.8 4.67 2423 1684 A 21 TYR HE% A 39 LYS HEx 1.0 1.8 5.18 2424 1684 A 39 LYS HEy A 21 TYR HE% 1.0 1.8 5.18 2425 1685 A 45 LYS HA A 46 LYS HA 1.0 1.8 5.03 2426 1686 A 45 LYS HA A 73 ASP HBx 1.0 1.8 4.38 2427 1686 A 45 LYS HA A 73 ASP HBy 1.0 1.8 4.38 2428 1687 A 45 LYS HG3 A 45 LYS HA 1.0 1.8 3.87 2429 1688 A 47 LEU HA A 50 SER HA 1.0 1.8 5.36 2430 1689 A 40 MET HA A 39 LYS HA 1.0 1.8 4.47 2431 1690 A 57 VAL HGx% A 56 GLY HAx 1.0 1.8 4.06 2432 1690 A 57 VAL HGx% A 56 GLY HAy 1.0 1.8 4.06 2433 1691 A 49 GLU HA A 52 CYS H 1.0 1.8 4.52 2434 1692 A 40 MET HE% A 40 MET HA 1.0 1.8 3.87 2435 1693 A 9 SER HA A 10 THR HB 1.0 1.8 5.33 2436 1694 A 64 PHE HA A 63 ARG HA 1.0 1.8 5.23 2437 1695 A 24 LEU HB3 A 23 LYS HA 1.0 1.8 5.54 2438 1696 A 36 PHE HE1 A 25 LYS HA 1.0 1.8 5.07 2439 1697 A 64 PHE HE1 A 59 MET HA 1.0 1.8 5.68 2440 1698 A 75 HIS HB3 A 76 THR H 1.0 1.8 3.89 2441 1699 A 64 PHE HD% A 88 ILE HB 1.0 1.8 4.17 2442 1700 A 66 PHE HE% A 87 VAL HGx% 1.0 1.8 3.62 2443 1700 A 66 PHE HE% A 87 VAL HGy% 1.0 1.8 3.62 2444 1701 A 64 PHE HE1 A 62 LEU HDx% 1.0 1.8 4.63 2445 1701 A 62 LEU HDy% A 64 PHE HE1 1.0 1.8 4.63 2446 1702 A 76 THR H A 44 LEU HDx% 1.0 1.8 5.07 2447 1702 A 44 LEU HDy% A 76 THR H 1.0 1.8 5.07 2448 1703 A 80 LEU H A 77 PRO HBx 1.0 1.8 5.27 2449 1703 A 77 PRO HBy A 80 LEU H 1.0 1.8 5.27 2450 1704 A 47 LEU HDx% A 46 LYS H 1.0 1.8 6.00 2451 1705 A 47 LEU HDy% A 46 LYS H 1.0 1.8 5.04 2452 1706 A 56 GLY H A 55 GLN HE21 1.0 1.8 5.20 2453 1707 A 48 LYS H A 47 LEU HBy 1.0 1.8 4.20 2454 1708 A 90 VAL H A 89 GLU HBx 1.0 1.8 3.67 2455 1708 A 89 GLU HBy A 90 VAL H 1.0 1.8 3.67 2456 1709 A 90 VAL H A 29 GLN H 1.0 1.8 4.99 2457 1710 A 51 TYR HB2 A 54 ARG H 1.0 1.8 5.90 2458 1711 A 69 GLN HB3 A 69 GLN H 1.0 1.8 3.77 2459 1712 A 54 ARG H A 55 GLN HBx 1.0 1.8 4.39 2460 1712 A 55 GLN HBy A 54 ARG H 1.0 1.8 4.39 2461 1713 A 56 GLY H A 54 ARG H 1.0 1.8 3.91 2462 1714 A 78 LYS H A 79 GLU HB2 1.0 1.8 4.64 2463 1715 A 78 LYS H A 80 LEU HBx 1.0 1.8 5.16 2464 1715 A 80 LEU HBy A 78 LYS H 1.0 1.8 5.16 2465 1716 A 50 SER H A 53 GLN H 1.0 1.8 5.12 2466 1717 A 53 GLN H A 53 GLN HBx 1.0 1.8 3.54 2467 1717 A 53 GLN HBy A 53 GLN H 1.0 1.8 3.54 2468 1718 A 84 GLU H A 84 GLU HGx 1.0 1.8 3.81 2469 1718 A 84 GLU H A 84 GLU HGy 1.0 1.8 3.81 2470 1719 A 23 LYS H A 84 GLU H 1.0 1.8 5.78 2471 1720 A 16 LYS H A 16 LYS HGx 1.0 1.8 5.22 2472 1720 A 16 LYS H A 16 LYS HGy 1.0 1.8 5.22 2473 1721 A 17 LYS H A 16 LYS HGx 1.0 1.8 5.90 2474 1721 A 17 LYS H A 16 LYS HGy 1.0 1.8 5.90 2475 1722 A 93 GLU H A 61 SER HB3 1.0 1.8 4.94 2476 1723 A 49 GLU H A 45 LYS HA 1.0 1.8 4.34 2477 1724 A 95 THR HB A 96 GLY H 1.0 1.8 4.63 2478 1725 A 45 LYS H A 74 ASN HA 1.0 1.8 5.04 2479 1726 A 39 LYS H A 42 THR HG2% 1.0 1.8 4.14 2480 1727 A 25 LYS H A 26 VAL H 1.0 1.8 4.36 2481 1728 A 25 LYS H A 26 VAL HA 1.0 1.8 4.84 2482 1729 A 9 SER H A 8 PRO HDy 1.0 1.8 5.43 2483 1730 A 23 LYS H A 23 LYS HB3 1.0 1.8 3.34 2484 1731 A 59 MET H A 52 CYS H 1.0 1.8 5.63 2485 1732 A 26 VAL HGx% A 34 ILE H 1.0 1.8 4.47 2486 1733 A 92 GLN H A 29 GLN HB3 1.0 1.8 4.78 2487 1734 A 94 GLN H A 92 GLN HE22 1.0 1.8 5.12 2488 1735 A 73 ASP H A 44 LEU HDx% 1.0 1.8 5.53 2489 1735 A 73 ASP H A 44 LEU HDy% 1.0 1.8 5.53 2490 1736 A 43 HIS H A 43 HIS HD2 1.0 1.8 4.95 2491 1737 A 70 ARG H A 69 GLN HE22 1.0 1.8 4.95 2492 1738 A 90 VAL HA A 89 GLU H 1.0 1.8 5.12 2493 1739 A 64 PHE H A 63 ARG HDx 1.0 1.8 4.96 2494 1739 A 63 ARG HDy A 64 PHE H 1.0 1.8 4.96 2495 1740 A 24 LEU H A 36 PHE HB3 1.0 1.8 5.60 2496 1741 A 66 PHE H A 69 GLN HA 1.0 1.8 4.57 2497 1742 A 80 LEU HDx% A 66 PHE H 1.0 1.8 5.36 2498 1743 A 63 ARG H A 63 ARG HGx 1.0 1.8 3.70 2499 1743 A 63 ARG H A 63 ARG HGy 1.0 1.8 3.70 2500 1744 A 90 VAL HB A 63 ARG H 1.0 1.8 6.00 2501 1745 A 27 ILE H A 27 ILE HG2% 1.0 1.8 3.95 2502 1746 A 26 VAL H A 33 GLU HA 1.0 1.8 4.50 2503 1747 A 26 VAL H A 25 LYS HEx 1.0 1.8 4.78 2504 1747 A 25 LYS HEy A 26 VAL H 1.0 1.8 4.78 2505 1748 A 36 PHE H A 34 ILE HG1x 1.0 1.8 4.86 2506 1748 A 36 PHE H A 34 ILE HG1y 1.0 1.8 4.86 2507 1749 A 22 ILE H A 77 PRO HBx 1.0 1.8 6.00 2508 1749 A 77 PRO HBy A 22 ILE H 1.0 1.8 6.00 2509 1750 A 88 ILE H A 89 GLU HG3 1.0 1.8 6.00 2510 1751 A 65 LEU HA A 67 GLU H 1.0 1.8 6.00 2511 1752 A 67 GLU H A 68 GLY HA3 1.0 1.8 5.55 2512 1753 A 61 SER H A 60 ASN HD22 1.0 1.8 6.00 2513 1754 A 92 GLN HE22 A 61 SER H 1.0 1.8 6.00 2514 1755 A 55 GLN HE22 A 54 ARG HDx 1.0 1.8 4.91 2515 1755 A 54 ARG HDy A 55 GLN HE22 1.0 1.8 4.91 2516 1756 A 55 GLN HE22 A 34 ILE HA 1.0 1.8 5.29 2517 1757 A 92 GLN HE22 A 93 GLU HA 1.0 1.8 5.47 2518 1758 A 33 GLU HB3 A 32 SER H 1.0 1.8 5.54 2519 1759 A 35 HIS H A 36 PHE HD% 1.0 1.8 4.37 2520 1760 A 62 LEU H A 58 PRO HBx 1.0 1.8 5.10 2521 1760 A 58 PRO HBy A 62 LEU H 1.0 1.8 5.10 2522 1761 A 62 LEU H A 58 PRO HGx 1.0 1.8 5.48 2523 1761 A 62 LEU H A 58 PRO HGy 1.0 1.8 5.48 2524 1762 A 50 SER H A 47 LEU H 1.0 1.8 5.71 2525 1763 A 75 HIS HA A 75 HIS H 1.0 1.8 2.81 2526 1764 A 79 GLU HA A 75 HIS HD2 1.0 1.8 5.06 2527 1765 A 73 ASP HA A 75 HIS H 1.0 1.8 4.55 2528 1766 A 76 THR HG2% A 75 HIS HD2 1.0 1.8 4.68 2529 1767 A 80 LEU HDy% A 75 HIS HD2 1.0 1.8 3.64 2530 1768 A 41 THR HG2% A 42 THR H 1.0 1.8 4.31 2531 1769 A 65 LEU HDx% A 63 ARG HE 1.0 1.8 4.87 2532 1770 A 47 LEU HDy% A 36 PHE HE2 1.0 1.8 3.70 2533 1771 A 76 THR H A 75 HIS HE1 1.0 1.8 6.00 2534 1772 A 76 THR H A 74 ASN H 1.0 1.8 6.00 2535 1773 A 90 VAL HGy% A 64 PHE HE1 1.0 1.8 4.37 2536 1774 A 90 VAL HGy% A 64 PHE HE2 1.0 1.8 4.69 2537 1775 A 81 GLY H A 80 LEU H 1.0 1.8 3.45 2538 1776 A 79 GLU HA A 80 LEU H 1.0 1.8 3.56 2539 1777 A 69 GLN HE21 A 70 ARG H 1.0 1.8 4.69 2540 1778 A 50 SER H A 48 LYS H 1.0 1.8 4.79 2541 1779 A 55 GLN HE21 A 54 ARG H 1.0 1.8 5.09 2542 1780 A 55 GLN H A 55 GLN HE21 1.0 1.8 4.46 2543 1781 A 61 SER HA A 92 GLN HE21 1.0 1.8 5.09 2544 1782 A 92 GLN HA A 92 GLN HE21 1.0 1.8 5.30 2545 1783 A 61 SER HB3 A 92 GLN HE21 1.0 1.8 4.69 2546 1784 A 55 GLN HE21 A 59 MET HGx 1.0 1.8 5.74 2547 1784 A 59 MET HGy A 55 GLN HE21 1.0 1.8 5.74 2548 1785 A 66 PHE HB3 A 69 GLN HE21 1.0 1.8 6.00 2549 1786 A 69 GLN HE21 A 69 GLN HGx 1.0 1.8 3.41 2550 1786 A 69 GLN HE21 A 69 GLN HGy 1.0 1.8 3.41 2551 1787 A 60 ASN HD21 A 60 ASN HA 1.0 1.8 4.02 2552 1788 A 66 PHE HD% A 82 MET H 1.0 1.8 5.44 2553 1789 A 29 GLN HA A 29 GLN HE21 1.0 1.8 4.55 2554 1790 A 29 GLN HE21 A 62 LEU HDx% 1.0 1.8 4.14 2555 1790 A 62 LEU HDy% A 29 GLN HE21 1.0 1.8 4.14 2556 1791 A 75 HIS H A 74 ASN H 1.0 1.8 3.52 2557 1792 A 74 ASN H A 74 ASN HD22 1.0 1.8 5.03 2558 1793 A 75 HIS HA A 74 ASN H 1.0 1.8 4.86 2559 1794 A 91 TYR HE% A 90 VAL H 1.0 1.8 4.99 2560 1795 A 26 VAL HGy% A 90 VAL H 1.0 1.8 5.39 2561 1796 A 90 VAL HGx% A 90 VAL H 1.0 1.8 3.89 2562 1797 A 51 TYR HA A 55 GLN H 1.0 1.8 3.88 2563 1798 A 53 GLN H A 56 GLY H 1.0 1.8 4.62 2564 1799 A 56 GLY H A 55 GLN H 1.0 1.8 3.49 2565 1800 A 56 GLY H A 57 VAL H 1.0 1.8 3.34 2566 1801 A 51 TYR HD% A 56 GLY H 1.0 1.8 5.16 2567 1802 A 62 LEU HA A 61 SER H 1.0 1.8 5.51 2568 1803 A 61 SER H A 60 ASN HB3 1.0 1.8 4.45 2569 1804 A 61 SER H A 62 LEU HDx% 1.0 1.8 4.37 2570 1804 A 62 LEU HDy% A 61 SER H 1.0 1.8 4.37 2571 1805 A 30 ASP HA A 31 SER H 1.0 1.8 3.41 2572 1806 A 27 ILE HG2% A 31 SER H 1.0 1.8 3.95 2573 1807 A 28 GLY H A 31 SER H 1.0 1.8 5.07 2574 1808 A 96 GLY H A 97 GLY H 1.0 1.8 5.36 2575 1809 A 31 SER H A 32 SER HA 1.0 1.8 5.44 2576 1810 A 78 LYS H A 76 THR HA 1.0 1.8 4.53 2577 1811 A 27 ILE HA A 32 SER H 1.0 1.8 4.94 2578 1812 A 27 ILE HG2% A 32 SER H 1.0 1.8 4.13 2579 1813 A 2 SER H A 2 SER HBx 1.0 1.8 3.45 2580 1813 A 2 SER H A 2 SER HBy 1.0 1.8 3.45 2581 1814 A 2 SER H A 1 MET HGx 1.0 1.8 4.98 2582 1814 A 2 SER H A 1 MET HGy 1.0 1.8 4.98 2583 1815 A 82 MET HE% A 86 ASP H 1.0 1.8 5.20 2584 1816 A 22 ILE HD1% A 86 ASP H 1.0 1.8 4.29 2585 1817 A 20 GLU H A 21 TYR HD% 1.0 1.8 4.66 2586 1818 A 15 ASP H A 13 LEU HDy% 1.0 1.8 4.78 2587 1819 A 9 SER H A 10 THR H 1.0 1.8 4.47 2588 1820 A 4 GLN H A 3 ASP HA 1.0 1.8 3.05 2589 1821 A 4 GLN H A 4 GLN HGx 1.0 1.8 3.32 2590 1821 A 4 GLN H A 4 GLN HGy 1.0 1.8 3.32 2591 1822 A 6 ALA HB% A 6 ALA H 1.0 1.8 2.80 2592 1823 A 7 LYS H A 7 LYS HBy 1.0 1.8 3.84 2593 1824 A 30 ASP H A 29 GLN H 1.0 1.8 3.57 2594 1825 A 51 TYR HD% A 53 GLN H 1.0 1.8 5.08 2595 1826 A 55 GLN HE22 A 53 GLN H 1.0 1.8 6.00 2596 1827 A 5 GLU H A 4 GLN HA 1.0 1.8 2.68 2597 1828 A 7 LYS H A 6 ALA HA 1.0 1.8 2.80 2598 1829 A 27 ILE HG2% A 30 ASP H 1.0 1.8 4.84 2599 1830 A 30 ASP H A 62 LEU HDx% 1.0 1.8 5.17 2600 1830 A 62 LEU HDy% A 30 ASP H 1.0 1.8 5.17 2601 1831 A 17 LYS H A 18 GLU H 1.0 1.8 4.83 2602 1832 A 11 GLU H A 10 THR HA 1.0 1.8 3.19 2603 1833 A 94 GLN H A 93 GLU H 1.0 1.8 4.30 2604 1834 A 62 LEU H A 60 ASN H 1.0 1.8 4.04 2605 1835 A 21 TYR H A 21 TYR HE% 1.0 1.8 4.98 2606 1836 A 95 THR H A 94 GLN HA 1.0 1.8 2.88 2607 1837 A 12 ASP H A 12 ASP HBx 1.0 1.8 3.06 2608 1837 A 12 ASP H A 12 ASP HBy 1.0 1.8 3.06 2609 1838 A 95 THR H A 95 THR HG2% 1.0 1.8 3.76 2610 1839 A 61 SER H A 60 ASN H 1.0 1.8 3.71 2611 1840 A 14 GLY H A 14 GLY HAx 1.0 1.8 2.92 2612 1840 A 14 GLY H A 14 GLY HAy 1.0 1.8 2.92 2613 1841 A 28 GLY H A 29 GLN H 1.0 1.8 4.52 2614 1842 A 28 GLY H A 90 VAL H 1.0 1.8 4.95 2615 1843 A 28 GLY H A 27 ILE HG1x 1.0 1.8 4.11 2616 1843 A 28 GLY H A 27 ILE HG1y 1.0 1.8 4.11 2617 1844 A 28 GLY H A 90 VAL HGx% 1.0 1.8 5.17 2618 1845 A 49 GLU H A 47 LEU HDx% 1.0 1.8 5.50 2619 1846 A 45 LYS H A 43 HIS H 1.0 1.8 5.05 2620 1847 A 47 LEU H A 45 LYS H 1.0 1.8 5.07 2621 1848 A 91 TYR HE% A 91 TYR H 1.0 1.8 4.69 2622 1849 A 41 THR HG2% A 40 MET H 1.0 1.8 4.62 2623 1850 A 25 LYS H A 24 LEU H 1.0 1.8 4.42 2624 1851 A 23 LYS H A 84 GLU HA 1.0 1.8 3.67 2625 1852 A 9 SER H A 9 SER HBx 1.0 1.8 3.57 2626 1852 A 9 SER H A 9 SER HBy 1.0 1.8 3.57 2627 1853 A 34 ILE H A 35 HIS HD2 1.0 1.8 4.38 2628 1854 A 35 HIS H A 35 HIS HD2 1.0 1.8 4.67 2629 1855 A 35 HIS H A 34 ILE HA 1.0 1.8 3.02 2630 1856 A 52 CYS H A 50 SER HA 1.0 1.8 4.87 2631 1857 A 92 GLN H A 91 TYR H 1.0 1.8 4.51 2632 1858 A 93 GLU H A 92 GLN H 1.0 1.8 4.58 2633 1859 A 92 GLN H A 91 TYR HD% 1.0 1.8 4.15 2634 1860 A 90 VAL HGx% A 92 GLN H 1.0 1.8 4.80 2635 1861 A 31 SER H A 29 GLN H 1.0 1.8 4.53 2636 1862 A 29 GLN HE21 A 29 GLN H 1.0 1.8 4.86 2637 1863 A 90 VAL HGy% A 29 GLN H 1.0 1.8 5.03 2638 1864 A 42 THR HA A 43 HIS H 1.0 1.8 3.14 2639 1865 A 42 THR HG2% A 43 HIS H 1.0 1.8 3.40 2640 1866 A 76 THR HG2% A 43 HIS H 1.0 1.8 4.61 2641 1867 A 47 LEU H A 51 TYR H 1.0 1.8 6.00 2642 1868 A 70 ARG H A 69 GLN HA 1.0 1.8 2.85 2643 1869 A 65 LEU HDy% A 70 ARG H 1.0 1.8 4.25 2644 1870 A 63 ARG HA A 64 PHE H 1.0 1.8 3.22 2645 1871 A 35 HIS HA A 24 LEU H 1.0 1.8 4.65 2646 1872 A 66 PHE H A 67 GLU HA 1.0 1.8 5.75 2647 1873 A 65 LEU HA A 71 ILE H 1.0 1.8 3.99 2648 1874 A 59 MET H A 58 PRO HA 1.0 1.8 3.03 2649 1875 A 59 MET H A 59 MET HBx 1.0 1.8 3.24 2650 1875 A 59 MET H A 59 MET HBy 1.0 1.8 3.24 2651 1876 A 65 LEU HDy% A 71 ILE H 1.0 1.8 3.67 2652 1877 A 36 PHE H A 35 HIS HA 1.0 1.8 3.14 2653 1878 A 27 ILE H A 89 GLU HA 1.0 1.8 4.61 2654 1879 A 26 VAL HGy% A 27 ILE H 1.0 1.8 3.49 2655 1880 A 26 VAL H A 25 LYS HA 1.0 1.8 3.18 2656 1881 A 26 VAL H A 34 ILE HA 1.0 1.8 5.13 2657 1882 A 26 VAL H A 34 ILE HB 1.0 1.8 5.56 2658 1883 A 22 ILE H A 21 TYR HD% 1.0 1.8 4.69 2659 1884 A 83 GLU H A 86 ASP HA 1.0 1.8 4.96 2660 1885 A 85 GLU H A 84 GLU H 1.0 1.8 4.71 2661 1886 A 90 VAL HA A 65 LEU H 1.0 1.8 4.31 2662 1887 A 65 LEU H A 70 ARG HA 1.0 1.8 6.00 2663 1888 A 65 LEU H A 88 ILE HB 1.0 1.8 5.71 2664 1889 A 51 TYR HD% A 51 TYR HE1 1.0 1.8 2.69 2665 1890 A 91 TYR HE% A 65 LEU HDx% 1.0 1.8 2.89 2666 1891 A 90 VAL HGy% A 51 TYR HE1 1.0 1.8 3.81 2667 1892 A 55 GLN HE22 A 55 GLN HGx 1.0 1.8 3.51 2668 1892 A 55 GLN HE22 A 55 GLN HGy 1.0 1.8 3.51 2669 1893 A 64 PHE HA A 91 TYR HD% 1.0 1.8 4.79 2670 1894 A 65 LEU HDx% A 91 TYR HD% 1.0 1.8 2.91 2671 1895 A 28 GLY H A 29 GLN HE22 1.0 1.8 6.00 2672 1896 A 62 LEU H A 29 GLN HE22 1.0 1.8 5.92 2673 1897 A 29 GLN HE22 A 29 GLN HA 1.0 1.8 5.42 2674 1898 A 71 ILE HA A 72 ALA H 1.0 1.8 3.21 2675 1899 A 51 TYR HD% A 51 TYR HE2 1.0 1.8 3.59 2676 1900 A 51 TYR HD% A 51 TYR HA 1.0 1.8 3.08 2677 1901 A 51 TYR HD% A 59 MET HGx 1.0 1.8 5.21 2678 1901 A 51 TYR HD% A 59 MET HGy 1.0 1.8 5.21 2679 1902 A 51 TYR HD% A 48 LYS HDx 1.0 1.8 5.43 2680 1902 A 51 TYR HD% A 48 LYS HDy 1.0 1.8 5.43 2681 1903 A 66 PHE HD% A 69 GLN H 1.0 1.8 4.77 2682 1904 A 88 ILE HA A 66 PHE HD% 1.0 1.8 4.42 2683 1905 A 90 VAL HGy% A 90 VAL H 1.0 1.8 3.42 2684 1906 A 90 VAL HGy% A 51 TYR HD% 1.0 1.8 4.37 2685 1907 A 90 VAL HGx% A 29 GLN HE21 1.0 1.8 4.84 2686 1908 A 90 VAL HGx% A 59 MET HGx 1.0 1.8 5.62 2687 1908 A 90 VAL HGx% A 59 MET HGy 1.0 1.8 5.62 2688 1909 A 80 LEU HDy% A 75 HIS HE1 1.0 1.8 3.69 2689 1910 A 80 LEU HDy% A 69 GLN HE22 1.0 1.8 4.18 2690 1911 A 80 LEU HA A 80 LEU HDy% 1.0 1.8 2.65 2691 1912 A 47 LEU HG A 44 LEU HA 1.0 1.8 4.22 2692 1913 A 47 LEU HG A 45 LYS HA 1.0 1.8 5.10 2693 1914 A 22 ILE HD1% A 22 ILE HA 1.0 1.8 4.02 2694 1915 A 80 LEU HDx% A 79 GLU H 1.0 1.8 4.55 2695 1916 A 65 LEU HDy% A 91 TYR HD% 1.0 1.8 4.10 2696 1917 A 65 LEU HDy% A 70 ARG HA 1.0 1.8 3.00 2697 1918 A 35 HIS HA A 34 ILE HG2% 1.0 1.8 4.14 2698 1919 A 34 ILE HG2% A 34 ILE HA 1.0 1.8 3.37 2699 1920 A 60 ASN H A 62 LEU HDx% 1.0 1.8 3.56 2700 1920 A 62 LEU HDy% A 60 ASN H 1.0 1.8 3.56 2701 1921 A 71 ILE HD1% A 72 ALA H 1.0 1.8 5.06 2702 1922 A 57 VAL HGy% A 56 GLY H 1.0 1.8 4.02 2703 1923 A 57 VAL HGy% A 55 GLN H 1.0 1.8 4.84 2704 1924 A 35 HIS HA A 25 LYS HG3 1.0 1.8 4.89 2705 1925 A 57 VAL HGy% A 57 VAL HA 1.0 1.8 3.30 2706 1926 A 34 ILE HD1% A 34 ILE HA 1.0 1.8 3.36 2707 1927 A 34 ILE HD1% A 50 SER HA 1.0 1.8 4.74 2708 1928 A 57 VAL HGy% A 55 GLN HA 1.0 1.8 5.00 2709 1929 A 51 TYR HD% A 26 VAL HGx% 1.0 1.8 4.29 2710 1930 A 47 LEU HDy% A 38 VAL HGx% 1.0 1.8 3.35 2711 1931 A 90 VAL HGy% A 26 VAL HGx% 1.0 1.8 4.13 2712 1932 A 90 VAL HGy% A 88 ILE HG2% 1.0 1.8 3.23 2713 1933 A 27 ILE HG2% A 90 VAL H 1.0 1.8 5.00 2714 1934 A 35 HIS HA A 25 LYS HG2 1.0 1.8 4.87 2715 1935 A 25 LYS HG2 A 34 ILE HA 1.0 1.8 5.53 2716 1936 A 27 ILE HG2% A 32 SER HA 1.0 1.8 5.75 2717 1937 A 27 ILE HD1% A 27 ILE HG2% 1.0 1.8 2.56 2718 1938 A 76 THR HG2% A 43 HIS HD2 1.0 1.8 3.06 2719 1939 A 80 LEU HDy% A 76 THR HG2% 1.0 1.8 6.00 2720 1940 A 90 VAL H A 27 ILE HG1x 1.0 1.8 6.00 2721 1940 A 90 VAL H A 27 ILE HG1y 1.0 1.8 6.00 2722 1941 A 90 VAL H A 87 VAL HGx% 1.0 1.8 6.00 2723 1941 A 87 VAL HGy% A 90 VAL H 1.0 1.8 6.00 2724 1942 A 41 THR HG2% A 78 LYS H 1.0 1.8 4.29 2725 1943 A 41 THR HG2% A 41 THR HA 1.0 1.8 2.79 2726 1944 A 51 TYR H A 34 ILE HG1x 1.0 1.8 5.44 2727 1944 A 34 ILE HG1y A 51 TYR H 1.0 1.8 5.44 2728 1945 A 36 PHE HA A 34 ILE HG1x 1.0 1.8 4.93 2729 1945 A 34 ILE HG1y A 36 PHE HA 1.0 1.8 4.93 2730 1946 A 10 THR HG2% A 10 THR HA 1.0 1.8 3.07 2731 1947 A 34 ILE HA A 34 ILE HG1x 1.0 1.8 3.24 2732 1947 A 34 ILE HG1y A 34 ILE HA 1.0 1.8 3.24 2733 1948 A 73 ASP HA A 45 LYS HG2 1.0 1.8 4.02 2734 1949 A 45 LYS HA A 45 LYS HG2 1.0 1.8 3.70 2735 1950 A 65 LEU HB3 A 70 ARG HA 1.0 1.8 4.60 2736 1951 A 45 LYS HG3 A 73 ASP HA 1.0 1.8 4.37 2737 1952 A 67 GLU H A 67 GLU HB3 1.0 1.8 3.42 2738 1953 A 21 TYR HA A 22 ILE HG12 1.0 1.8 4.98 2739 1954 A 41 THR HB A 78 LYS HGx 1.0 1.8 3.87 2740 1954 A 78 LYS HGy A 41 THR HB 1.0 1.8 3.87 2741 1955 A 77 PRO HDy A 78 LYS HGx 1.0 1.8 5.05 2742 1955 A 77 PRO HDx A 78 LYS HGx 1.0 1.8 5.05 2743 1955 A 78 LYS HGy A 77 PRO HDx 1.0 1.8 5.05 2744 1955 A 78 LYS HGy A 77 PRO HDy 1.0 1.8 5.05 2745 1956 A 67 GLU HG3 A 68 GLY HA3 1.0 1.8 4.39 2746 1957 A 91 TYR HE% A 65 LEU HG 1.0 1.8 3.99 2747 1958 A 90 VAL HGy% A 63 ARG HGx 1.0 1.8 5.99 2748 1958 A 90 VAL HGy% A 63 ARG HGy 1.0 1.8 5.99 2749 1959 A 90 VAL HGy% A 65 LEU HG 1.0 1.8 6.00 2750 1960 A 93 GLU H A 63 ARG HGx 1.0 1.8 5.34 2751 1960 A 93 GLU H A 63 ARG HGy 1.0 1.8 5.34 2752 1961 A 90 VAL HA A 63 ARG HGx 1.0 1.8 4.55 2753 1961 A 90 VAL HA A 63 ARG HGy 1.0 1.8 4.55 2754 1962 A 25 LYS HB2 A 35 HIS HA 1.0 1.8 4.28 2755 1963 A 63 ARG HBx A 63 ARG HDx 1.0 1.8 3.64 2756 1963 A 63 ARG HDy A 63 ARG HBx 1.0 1.8 3.64 2757 1963 A 63 ARG HDy A 63 ARG HBy 1.0 1.8 3.64 2758 1963 A 63 ARG HBy A 63 ARG HDx 1.0 1.8 3.64 2759 1964 A 51 TYR HD% A 55 GLN HBx 1.0 1.8 4.09 2760 1964 A 51 TYR HD% A 55 GLN HBy 1.0 1.8 4.09 2761 1965 A 22 ILE HB A 86 ASP H 1.0 1.8 5.64 2762 1966 A 7 LYS H A 7 LYS HBx 1.0 1.8 3.84 2763 1967 A 46 LYS HA A 46 LYS HDx 1.0 1.8 4.03 2764 1967 A 46 LYS HDy A 46 LYS HA 1.0 1.8 4.03 2765 1968 A 28 GLY H A 27 ILE HB 1.0 1.8 3.90 2766 1969 A 7 LYS HBy A 8 PRO HDy 1.0 1.8 4.50 2767 1970 A 7 LYS HBy A 8 PRO HDx 1.0 1.8 4.50 2768 1971 A 15 ASP H A 16 LYS HBx 1.0 1.8 6.00 2769 1971 A 16 LYS HBy A 15 ASP H 1.0 1.8 6.00 2770 1972 A 51 TYR HD% A 34 ILE HB 1.0 1.8 3.69 2771 1973 A 55 GLN HE22 A 34 ILE HB 1.0 1.8 3.96 2772 1974 A 78 LYS HA A 40 MET HE% 1.0 1.8 2.89 2773 1975 A 91 TYR HD% A 89 GLU HBx 1.0 1.8 3.81 2774 1975 A 89 GLU HBy A 91 TYR HD% 1.0 1.8 3.81 2775 1976 A 90 VAL HGx% A 89 GLU HBx 1.0 1.8 5.59 2776 1976 A 90 VAL HGx% A 89 GLU HBy 1.0 1.8 5.59 2777 1977 A 92 GLN HB2 A 62 LEU HDx% 1.0 1.8 4.42 2778 1977 A 62 LEU HDy% A 92 GLN HB2 1.0 1.8 4.42 2779 1978 A 62 LEU HA A 92 GLN HB2 1.0 1.8 4.86 2780 1979 A 78 LYS H A 79 GLU HB3 1.0 1.8 4.52 2781 1980 A 79 GLU HB3 A 75 HIS HE1 1.0 1.8 5.83 2782 1981 A 79 GLU HB3 A 81 GLY H 1.0 1.8 4.90 2783 1982 A 29 GLN HB2 A 28 GLY HAx 1.0 1.8 5.29 2784 1982 A 28 GLY HAy A 29 GLN HB2 1.0 1.8 5.29 2785 1983 A 80 LEU HDx% A 79 GLU HB3 1.0 1.8 4.59 2786 1984 A 93 GLU HA A 93 GLU HGx 1.0 1.8 3.50 2787 1984 A 93 GLU HGy A 93 GLU HA 1.0 1.8 3.50 2788 1985 A 63 ARG HGy A 93 GLU HGx 1.0 1.8 5.58 2789 1985 A 63 ARG HGx A 93 GLU HGx 1.0 1.8 5.58 2790 1985 A 93 GLU HGy A 63 ARG HGx 1.0 1.8 5.58 2791 1985 A 93 GLU HGy A 63 ARG HGy 1.0 1.8 5.58 2792 1986 A 51 TYR HD% A 59 MET HE% 1.0 1.8 4.28 2793 1987 A 51 TYR HE2 A 55 GLN HGx 1.0 1.8 4.22 2794 1987 A 55 GLN HGy A 51 TYR HE2 1.0 1.8 4.22 2795 1988 A 91 TYR HE% A 89 GLU HG3 1.0 1.8 4.26 2796 1989 A 59 MET HBx A 59 MET HGx 1.0 1.8 2.89 2797 1989 A 59 MET HBy A 59 MET HGx 1.0 1.8 2.89 2798 1989 A 59 MET HGy A 59 MET HBx 1.0 1.8 2.89 2799 1989 A 59 MET HGy A 59 MET HBy 1.0 1.8 2.89 2800 1990 A 59 MET HE% A 59 MET HGx 1.0 1.8 3.17 2801 1990 A 59 MET HE% A 59 MET HGy 1.0 1.8 3.17 2802 1991 A 90 VAL HGx% A 59 MET HE% 1.0 1.8 4.05 2803 1992 A 90 VAL HGx% A 29 GLN HB3 1.0 1.8 4.88 2804 1993 A 79 GLU HB2 A 75 HIS HD2 1.0 1.8 4.27 2805 1994 A 76 THR H A 79 GLU HGx 1.0 1.8 4.12 2806 1994 A 76 THR H A 79 GLU HGy 1.0 1.8 4.12 2807 1995 A 18 GLU HA A 18 GLU HGx 1.0 1.8 3.74 2808 1995 A 18 GLU HGy A 18 GLU HA 1.0 1.8 3.74 2809 1996 A 20 GLU HA A 20 GLU HGx 1.0 1.8 3.99 2810 1996 A 20 GLU HGy A 20 GLU HA 1.0 1.8 3.99 2811 1997 A 79 GLU HA A 79 GLU HGx 1.0 1.8 3.21 2812 1997 A 79 GLU HA A 79 GLU HGy 1.0 1.8 3.21 2813 1998 A 75 HIS HB2 A 79 GLU HGx 1.0 1.8 6.00 2814 1998 A 75 HIS HB2 A 79 GLU HGy 1.0 1.8 6.00 2815 1999 A 89 GLU HG2 A 90 VAL H 1.0 1.8 5.33 2816 2000 A 91 TYR HE% A 89 GLU HG2 1.0 1.8 5.14 2817 2001 A 75 HIS HA A 79 GLU HGx 1.0 1.8 4.56 2818 2001 A 75 HIS HA A 79 GLU HGy 1.0 1.8 4.56 2819 2002 A 66 PHE HA A 89 GLU HG2 1.0 1.8 5.08 2820 2003 A 66 PHE HD% A 69 GLN HGx 1.0 1.8 4.65 2821 2003 A 66 PHE HD% A 69 GLN HGy 1.0 1.8 4.65 2822 2004 A 69 GLN HA A 69 GLN HGx 1.0 1.8 3.07 2823 2004 A 69 GLN HA A 69 GLN HGy 1.0 1.8 3.07 2824 2005 A 94 GLN HA A 94 GLN HGx 1.0 1.8 3.50 2825 2005 A 94 GLN HGy A 94 GLN HA 1.0 1.8 3.50 2826 2006 A 92 GLN H A 91 TYR HB3 1.0 1.8 3.82 2827 2007 A 86 ASP HA A 85 GLU HBx 1.0 1.8 4.57 2828 2007 A 85 GLU HBy A 86 ASP HA 1.0 1.8 4.57 2829 2008 A 86 ASP H A 85 GLU HGx 1.0 1.8 4.63 2830 2008 A 85 GLU HGy A 86 ASP H 1.0 1.8 4.63 2831 2009 A 29 GLN HE21 A 29 GLN HGx 1.0 1.8 3.06 2832 2009 A 29 GLN HGy A 29 GLN HE21 1.0 1.8 3.06 2833 2010 A 29 GLN HE22 A 29 GLN HGx 1.0 1.8 3.48 2834 2010 A 29 GLN HE22 A 29 GLN HGy 1.0 1.8 3.48 2835 2011 A 53 GLN HG3 A 53 GLN HE2x 1.0 1.8 4.08 2836 2012 A 61 SER HB2 A 58 PRO HBx 1.0 1.8 4.06 2837 2012 A 58 PRO HBy A 61 SER HB2 1.0 1.8 4.06 2838 2013 A 90 VAL HA A 64 PHE HB3 1.0 1.8 5.18 2839 2014 A 47 LEU HG A 48 LYS HEx 1.0 1.8 4.98 2840 2014 A 47 LEU HG A 48 LYS HEy 1.0 1.8 4.98 2841 2015 A 49 GLU HA A 49 GLU HG2 1.0 1.8 3.60 2842 2016 A 74 ASN H A 74 ASN HB3 1.0 1.8 3.56 2843 2017 A 53 GLN HG2 A 54 ARG H 1.0 1.8 4.79 2844 2018 A 53 GLN HA A 53 GLN HG2 1.0 1.8 3.42 2845 2019 A 1 MET HA A 1 MET HGx 1.0 1.8 3.16 2846 2019 A 1 MET HGy A 1 MET HA 1.0 1.8 3.16 2847 2020 A 74 ASN H A 74 ASN HB2 1.0 1.8 4.17 2848 2021 A 15 ASP HBy A 16 LYS HBx 1.0 1.8 4.69 2849 2021 A 15 ASP HBx A 16 LYS HBx 1.0 1.8 4.69 2850 2021 A 16 LYS HBy A 15 ASP HBx 1.0 1.8 4.69 2851 2021 A 15 ASP HBy A 16 LYS HBy 1.0 1.8 4.69 2852 2022 A 76 THR HG2% A 74 ASN HB2 1.0 1.8 5.85 2853 2023 A 3 ASP H A 3 ASP HBx 1.0 1.8 3.83 2854 2023 A 3 ASP HBy A 3 ASP H 1.0 1.8 3.83 2855 2024 A 59 MET HA A 59 MET HGx 1.0 1.8 3.14 2856 2024 A 59 MET HGy A 59 MET HA 1.0 1.8 3.14 2857 2025 A 21 TYR H A 21 TYR HB2 1.0 1.8 3.80 2858 2026 A 35 HIS HD2 A 25 LYS HEx 1.0 1.8 5.30 2859 2026 A 25 LYS HEy A 35 HIS HD2 1.0 1.8 5.30 2860 2027 A 60 ASN HA A 60 ASN HB3 1.0 1.8 3.00 2861 2028 A 77 PRO HDx A 78 LYS HEx 1.0 1.8 4.79 2862 2028 A 77 PRO HDy A 78 LYS HEx 1.0 1.8 4.79 2863 2028 A 78 LYS HEy A 77 PRO HDx 1.0 1.8 4.79 2864 2028 A 77 PRO HDy A 78 LYS HEy 1.0 1.8 4.79 2865 2029 A 45 LYS HA A 45 LYS HEx 1.0 1.8 4.66 2866 2029 A 45 LYS HEy A 45 LYS HA 1.0 1.8 4.66 2867 2030 A 60 ASN H A 60 ASN HB3 1.0 1.8 3.73 2868 2031 A 49 GLU H A 51 TYR HB3 1.0 1.8 5.78 2869 2032 A 47 LEU HDy% A 36 PHE HB2 1.0 1.8 5.52 2870 2033 A 90 VAL HGx% A 64 PHE HB2 1.0 1.8 6.00 2871 2034 A 90 VAL HGy% A 64 PHE HB2 1.0 1.8 4.51 2872 2035 A 67 GLU H A 66 PHE HB2 1.0 1.8 4.33 2873 2036 A 51 TYR HB3 A 55 GLN H 1.0 1.8 5.62 2874 2037 A 51 TYR HB3 A 55 GLN HE21 1.0 1.8 4.93 2875 2038 A 65 LEU HA A 66 PHE HB2 1.0 1.8 4.70 2876 2039 A 30 ASP HB2 A 57 VAL HB 1.0 1.8 5.08 2877 2040 A 90 VAL HGy% A 51 TYR HB3 1.0 1.8 6.00 2878 2041 A 90 VAL HGy% A 63 ARG HDx 1.0 1.8 6.00 2879 2041 A 90 VAL HGy% A 63 ARG HDy 1.0 1.8 6.00 2880 2042 A 30 ASP HA A 30 ASP HB2 1.0 1.8 2.72 2881 2043 A 62 LEU HA A 91 TYR HB2 1.0 1.8 5.59 2882 2044 A 54 ARG HA A 54 ARG HDx 1.0 1.8 3.64 2883 2044 A 54 ARG HDy A 54 ARG HA 1.0 1.8 3.64 2884 2045 A 70 ARG HA A 70 ARG HDx 1.0 1.8 4.23 2885 2045 A 70 ARG HDy A 70 ARG HA 1.0 1.8 4.23 2886 2046 A 71 ILE HA A 75 HIS HB2 1.0 1.8 5.03 2887 2047 A 51 TYR HB2 A 50 SER HA 1.0 1.8 6.00 2888 2048 A 75 HIS HB2 A 74 ASN HA 1.0 1.8 6.00 2889 2049 A 51 TYR HE1 A 51 TYR HB2 1.0 1.8 4.65 2890 2050 A 59 MET H A 52 CYS HB2 1.0 1.8 4.98 2891 2051 A 53 GLN H A 52 CYS HB2 1.0 1.8 4.30 2892 2052 A 52 CYS HB2 A 59 MET HA 1.0 1.8 4.79 2893 2053 A 51 TYR HB3 A 52 CYS HB2 1.0 1.8 4.28 2894 2054 A 69 GLN H A 67 GLU HA 1.0 1.8 4.62 2895 2055 A 66 PHE HA A 67 GLU HA 1.0 1.8 4.48 2896 2056 A 61 SER H A 58 PRO HDx 1.0 1.8 5.43 2897 2056 A 61 SER H A 58 PRO HDy 1.0 1.8 5.43 2898 2057 A 57 VAL HA A 58 PRO HDx 1.0 1.8 3.51 2899 2057 A 57 VAL HA A 58 PRO HDy 1.0 1.8 3.51 2900 2058 A 7 LYS HA A 8 PRO HDx 1.0 1.8 3.01 2901 2059 A 47 LEU HA A 47 LEU HG 1.0 1.8 3.67 2902 2060 A 7 LYS HA A 8 PRO HDy 1.0 1.8 3.01 2903 2061 A 8 PRO HDy A 7 LYS HBx 1.0 1.8 4.50 2904 2062 A 82 MET HA A 81 GLY HAx 1.0 1.8 4.43 2905 2062 A 81 GLY HAy A 82 MET HA 1.0 1.8 4.43 2906 2063 A 52 CYS HA A 51 TYR H 1.0 1.8 5.38 2907 2064 A 52 CYS HA A 51 TYR HB3 1.0 1.8 4.09 2908 2065 A 79 GLU HA A 78 LYS HEx 1.0 1.8 4.67 2909 2065 A 79 GLU HA A 78 LYS HEy 1.0 1.8 4.67 2910 2066 A 71 ILE HG2% A 44 LEU HA 1.0 1.8 5.35 2911 2067 A 42 THR HA A 42 THR HB 1.0 1.8 2.99 2912 2068 A 49 GLU HA A 51 TYR HB3 1.0 1.8 5.66 2913 2069 A 51 TYR HB3 A 50 SER HBx 1.0 1.8 6.00 2914 2069 A 51 TYR HB3 A 50 SER HBy 1.0 1.8 6.00 2915 2070 A 49 GLU HA A 59 MET HGx 1.0 1.8 4.45 2916 2070 A 49 GLU HA A 59 MET HGy 1.0 1.8 4.45 2917 2071 A 31 SER HA A 32 SER HA 1.0 1.8 5.18 2918 2072 A 53 GLN HG3 A 50 SER HBx 1.0 1.8 5.38 2919 2072 A 53 GLN HG3 A 50 SER HBy 1.0 1.8 5.38 2920 2073 A 47 LEU HG A 50 SER HBx 1.0 1.8 5.88 2921 2073 A 47 LEU HG A 50 SER HBy 1.0 1.8 5.88 2922 2074 A 26 VAL HGy% A 51 TYR HA 1.0 1.8 6.00 2923 2075 A 41 THR HA A 40 MET HA 1.0 1.8 4.63 2924 2076 A 65 LEU HDy% A 68 GLY HA2 1.0 1.8 5.12 2925 2077 A 6 ALA H A 5 GLU HA 1.0 1.8 3.37 2926 2078 A 84 GLU HA A 23 LYS HGx 1.0 1.8 4.94 2927 2078 A 84 GLU HA A 23 LYS HGy 1.0 1.8 4.94 2928 2079 A 21 TYR HE% A 20 GLU HA 1.0 1.8 5.08 2929 2080 A 15 ASP H A 13 LEU HA 1.0 1.8 5.78 2930 2081 A 15 ASP H A 16 LYS HA 1.0 1.8 6.00 2931 2082 A 95 THR HA A 94 GLN HGx 1.0 1.8 4.54 2932 2082 A 94 GLN HGy A 95 THR HA 1.0 1.8 4.54 2933 2083 A 13 LEU HA A 13 LEU HDy% 1.0 1.8 4.17 2934 2084 A 41 THR HA A 76 THR HG2% 1.0 1.8 4.48 2935 2085 A 34 ILE HA A 54 ARG HBx 1.0 1.8 6.00 2936 2085 A 54 ARG HBy A 34 ILE HA 1.0 1.8 6.00 2937 2086 A 41 THR HA A 40 MET HB2 1.0 1.8 6.00 2938 2087 A 92 GLN HB2 A 93 GLU HA 1.0 1.8 6.00 2939 2088 A 22 ILE HD1% A 83 GLU HA 1.0 1.8 5.06 2940 2089 A 9 SER HA A 7 LYS HDx 1.0 1.8 5.86 2941 2089 A 7 LYS HDy A 9 SER HA 1.0 1.8 5.86 2942 2090 A 92 GLN HA A 93 GLU HB3 1.0 1.8 6.00 2943 2091 A 61 SER HA A 62 LEU HDx% 1.0 1.8 5.61 2944 2091 A 62 LEU HDy% A 61 SER HA 1.0 1.8 5.61 2945 2092 A 30 ASP HA A 28 GLY HAx 1.0 1.8 5.74 2946 2092 A 30 ASP HA A 28 GLY HAy 1.0 1.8 5.74 2947 2093 A 22 ILE HA A 84 GLU H 1.0 1.8 5.76 2948 2094 A 35 HIS HA A 35 HIS HD2 1.0 1.8 4.51 2949 2095 A 35 HIS HA A 34 ILE HA 1.0 1.8 5.22 2950 2096 A 47 LEU HDy% A 48 LYS HGx 1.0 1.8 5.06 2951 2096 A 47 LEU HDy% A 48 LYS HGy 1.0 1.8 5.06 2952 2097 A 4 GLN H A 4 GLN HBy 1.0 1.8 3.44 2953 2097 A 4 GLN H A 4 GLN HBx 1.0 1.8 3.44 2954 2098 A 4 GLN H A 4 GLN HE2y 1.0 1.8 5.81 2955 2098 A 4 GLN H A 4 GLN HE2x 1.0 1.8 5.81 2956 2099 A 4 GLN HBx A 4 GLN HE2y 1.0 1.8 4.35 2957 2099 A 4 GLN HBy A 4 GLN HE2y 1.0 1.8 4.35 2958 2099 A 4 GLN HE2x A 4 GLN HBy 1.0 1.8 4.35 2959 2099 A 4 GLN HBx A 4 GLN HE2x 1.0 1.8 4.35 2960 2100 A 4 GLN HE2x A 4 GLN HGx 1.0 1.8 3.03 2961 2100 A 4 GLN HE2y A 4 GLN HGx 1.0 1.8 3.03 2962 2100 A 4 GLN HGy A 4 GLN HE2y 1.0 1.8 3.03 2963 2100 A 4 GLN HGy A 4 GLN HE2x 1.0 1.8 3.03 2964 2101 A 7 LYS H A 7 LYS HBx 1.0 1.8 3.11 2965 2101 A 7 LYS H A 7 LYS HBy 1.0 1.8 3.11 2966 2102 A 7 LYS H A 8 PRO HDx 1.0 1.8 4.58 2967 2102 A 7 LYS H A 8 PRO HDy 1.0 1.8 4.58 2968 2103 A 7 LYS HBy A 7 LYS HEx 1.0 1.8 3.74 2969 2103 A 7 LYS HBx A 7 LYS HEx 1.0 1.8 3.74 2970 2103 A 7 LYS HEy A 7 LYS HBx 1.0 1.8 3.74 2971 2103 A 7 LYS HEy A 7 LYS HBy 1.0 1.8 3.74 2972 2104 A 7 LYS HBy A 8 PRO HDx 1.0 1.8 3.11 2973 2104 A 7 LYS HBx A 8 PRO HDx 1.0 1.8 3.11 2974 2104 A 8 PRO HDy A 7 LYS HBx 1.0 1.8 3.11 2975 2104 A 7 LYS HBy A 8 PRO HDy 1.0 1.8 3.11 2976 2105 A 7 LYS HGy A 8 PRO HDx 1.0 1.8 4.42 2977 2105 A 7 LYS HGx A 8 PRO HDx 1.0 1.8 4.42 2978 2105 A 8 PRO HDy A 7 LYS HGx 1.0 1.8 4.42 2979 2105 A 7 LYS HGy A 8 PRO HDy 1.0 1.8 4.42 2980 2106 A 7 LYS HEx A 8 PRO HDx 1.0 1.8 4.95 2981 2106 A 8 PRO HDy A 7 LYS HEx 1.0 1.8 4.95 2982 2106 A 7 LYS HEy A 8 PRO HDy 1.0 1.8 4.95 2983 2106 A 7 LYS HEy A 8 PRO HDx 1.0 1.8 4.95 2984 2107 A 9 SER H A 8 PRO HDx 1.0 1.8 4.74 2985 2107 A 9 SER H A 8 PRO HDy 1.0 1.8 4.74 2986 2108 A 12 ASP HA A 13 LEU HDy% 1.0 1.8 4.95 2987 2108 A 12 ASP HA A 13 LEU HDx% 1.0 1.8 4.95 2988 2109 A 12 ASP HBy A 13 LEU HDy% 1.0 1.8 5.49 2989 2109 A 12 ASP HBx A 13 LEU HDy% 1.0 1.8 5.49 2990 2109 A 13 LEU HDx% A 12 ASP HBx 1.0 1.8 5.49 2991 2109 A 12 ASP HBy A 13 LEU HDx% 1.0 1.8 5.49 2992 2110 A 13 LEU H A 13 LEU HBx 1.0 1.8 3.41 2993 2110 A 13 LEU H A 13 LEU HBy 1.0 1.8 3.41 2994 2111 A 13 LEU H A 13 LEU HDy% 1.0 1.8 3.72 2995 2111 A 13 LEU H A 13 LEU HDx% 1.0 1.8 3.72 2996 2112 A 13 LEU HBy A 13 LEU HDy% 1.0 1.8 2.82 2997 2112 A 13 LEU HBx A 13 LEU HDy% 1.0 1.8 2.82 2998 2112 A 13 LEU HDx% A 13 LEU HBx 1.0 1.8 2.82 2999 2112 A 13 LEU HDx% A 13 LEU HBy 1.0 1.8 2.82 3000 2113 A 14 GLY H A 13 LEU HBx 1.0 1.8 3.31 3001 2113 A 14 GLY H A 13 LEU HBy 1.0 1.8 3.31 3002 2114 A 13 LEU HBy A 14 GLY HAx 1.0 1.8 4.46 3003 2114 A 13 LEU HBx A 14 GLY HAx 1.0 1.8 4.46 3004 2114 A 14 GLY HAy A 13 LEU HBx 1.0 1.8 4.46 3005 2114 A 14 GLY HAy A 13 LEU HBy 1.0 1.8 4.46 3006 2115 A 15 ASP H A 13 LEU HBx 1.0 1.8 4.44 3007 2115 A 15 ASP H A 13 LEU HBy 1.0 1.8 4.44 3008 2116 A 13 LEU HBy A 15 ASP HBx 1.0 1.8 4.95 3009 2116 A 13 LEU HBx A 15 ASP HBx 1.0 1.8 4.95 3010 2116 A 15 ASP HBy A 13 LEU HBx 1.0 1.8 4.95 3011 2116 A 15 ASP HBy A 13 LEU HBy 1.0 1.8 4.95 3012 2117 A 14 GLY H A 13 LEU HDy% 1.0 1.8 4.10 3013 2117 A 14 GLY H A 13 LEU HDx% 1.0 1.8 4.10 3014 2118 A 13 LEU HDy% A 14 GLY HAx 1.0 1.8 4.77 3015 2118 A 13 LEU HDx% A 14 GLY HAx 1.0 1.8 4.77 3016 2118 A 14 GLY HAy A 13 LEU HDy% 1.0 1.8 4.77 3017 2118 A 14 GLY HAy A 13 LEU HDx% 1.0 1.8 4.77 3018 2119 A 15 ASP H A 13 LEU HDy% 1.0 1.8 4.15 3019 2119 A 15 ASP H A 13 LEU HDx% 1.0 1.8 4.15 3020 2120 A 13 LEU HDx% A 15 ASP HBx 1.0 1.8 3.76 3021 2120 A 13 LEU HDy% A 15 ASP HBx 1.0 1.8 3.76 3022 2120 A 15 ASP HBy A 13 LEU HDy% 1.0 1.8 3.76 3023 2120 A 15 ASP HBy A 13 LEU HDx% 1.0 1.8 3.76 3024 2121 A 22 ILE HD1% A 86 ASP HBy 1.0 1.8 4.47 3025 2121 A 22 ILE HD1% A 86 ASP HBx 1.0 1.8 4.47 3026 2122 A 24 LEU H A 86 ASP HBy 1.0 1.8 5.81 3027 2122 A 24 LEU H A 86 ASP HBx 1.0 1.8 5.81 3028 2123 A 24 LEU HB2 A 86 ASP HBy 1.0 1.8 4.26 3029 2123 A 24 LEU HB2 A 86 ASP HBx 1.0 1.8 4.26 3030 2124 A 24 LEU HB3 A 86 ASP HBy 1.0 1.8 3.44 3031 2124 A 24 LEU HB3 A 86 ASP HBx 1.0 1.8 3.44 3032 2125 A 24 LEU HG A 86 ASP HBy 1.0 1.8 4.16 3033 2125 A 24 LEU HG A 86 ASP HBx 1.0 1.8 4.16 3034 2126 A 24 LEU HDy% A 86 ASP HBy 1.0 1.8 2.85 3035 2126 A 24 LEU HDx% A 86 ASP HBy 1.0 1.8 2.85 3036 2126 A 86 ASP HBx A 24 LEU HDx% 1.0 1.8 2.85 3037 2126 A 24 LEU HDy% A 86 ASP HBx 1.0 1.8 2.85 3038 2127 A 25 LYS H A 86 ASP HBy 1.0 1.8 4.64 3039 2127 A 25 LYS H A 86 ASP HBx 1.0 1.8 4.64 3040 2128 A 27 ILE HG2% A 32 SER HBy 1.0 1.8 5.05 3041 2128 A 27 ILE HG2% A 32 SER HBx 1.0 1.8 5.05 3042 2129 A 30 ASP H A 32 SER HBy 1.0 1.8 4.54 3043 2129 A 30 ASP H A 32 SER HBx 1.0 1.8 4.54 3044 2130 A 30 ASP HB2 A 32 SER HBy 1.0 1.8 4.23 3045 2130 A 30 ASP HB2 A 32 SER HBx 1.0 1.8 4.23 3046 2131 A 30 ASP HB3 A 32 SER HBy 1.0 1.8 5.03 3047 2131 A 30 ASP HB3 A 32 SER HBx 1.0 1.8 5.03 3048 2132 A 31 SER H A 32 SER HBy 1.0 1.8 4.91 3049 2132 A 31 SER H A 32 SER HBx 1.0 1.8 4.91 3050 2133 A 32 SER H A 32 SER HBy 1.0 1.8 3.33 3051 2133 A 32 SER H A 32 SER HBx 1.0 1.8 3.33 3052 2134 A 33 GLU H A 32 SER HBy 1.0 1.8 3.29 3053 2134 A 33 GLU H A 32 SER HBx 1.0 1.8 3.29 3054 2135 A 57 VAL HGy% A 32 SER HBy 1.0 1.8 4.88 3055 2135 A 57 VAL HGy% A 32 SER HBx 1.0 1.8 4.88 3056 2136 A 36 PHE HB3 A 47 LEU HBy 1.0 1.8 4.48 3057 2136 A 36 PHE HB3 A 47 LEU HBx 1.0 1.8 4.48 3058 2137 A 36 PHE HD% A 47 LEU HBy 1.0 1.8 3.92 3059 2137 A 36 PHE HD% A 47 LEU HBx 1.0 1.8 3.92 3060 2138 A 47 LEU H A 47 LEU HBy 1.0 1.8 3.19 3061 2138 A 47 LEU H A 47 LEU HBx 1.0 1.8 3.19 3062 2139 A 47 LEU HDy% A 47 LEU HBy 1.0 1.8 3.22 3063 2139 A 47 LEU HDy% A 47 LEU HBx 1.0 1.8 3.22 3064 2140 A 48 LYS H A 47 LEU HBy 1.0 1.8 3.69 3065 2140 A 48 LYS H A 47 LEU HBx 1.0 1.8 3.69 3066 2141 A 53 GLN HA A 53 GLN HE2y 1.0 1.8 4.49 3067 2141 A 53 GLN HA A 53 GLN HE2x 1.0 1.8 4.49 3068 2142 A 53 GLN HE2x A 53 GLN HBx 1.0 1.8 3.53 3069 2142 A 53 GLN HE2y A 53 GLN HBx 1.0 1.8 3.53 3070 2142 A 53 GLN HBy A 53 GLN HE2y 1.0 1.8 3.53 3071 2142 A 53 GLN HBy A 53 GLN HE2x 1.0 1.8 3.53 3072 2143 A 53 GLN HG2 A 53 GLN HE2y 1.0 1.8 3.42 3073 2143 A 53 GLN HG2 A 53 GLN HE2x 1.0 1.8 3.42 3074 2144 A 53 GLN HG3 A 53 GLN HE2y 1.0 1.8 3.36 3075 2144 A 53 GLN HG3 A 53 GLN HE2x 1.0 1.8 3.36 3076 2145 A 82 MET HBx A 86 ASP HBy 1.0 1.8 4.92 3077 2145 A 82 MET HBy A 86 ASP HBy 1.0 1.8 4.92 3078 2145 A 86 ASP HBx A 82 MET HBx 1.0 1.8 4.92 3079 2145 A 82 MET HBy A 86 ASP HBx 1.0 1.8 4.92 3080 2146 A 82 MET HGx A 86 ASP HBy 1.0 1.8 4.20 3081 2146 A 82 MET HGy A 86 ASP HBy 1.0 1.8 4.20 3082 2146 A 86 ASP HBx A 82 MET HGx 1.0 1.8 4.20 3083 2146 A 82 MET HGy A 86 ASP HBx 1.0 1.8 4.20 3084 2147 A 82 MET HE% A 86 ASP HBy 1.0 1.8 4.18 3085 2147 A 82 MET HE% A 86 ASP HBx 1.0 1.8 4.18 3086 2148 A 83 GLU H A 83 GLU HBx 1.0 1.8 3.42 3087 2148 A 83 GLU H A 83 GLU HBy 1.0 1.8 3.42 3088 2149 A 83 GLU H A 86 ASP HBy 1.0 1.8 4.07 3089 2149 A 83 GLU H A 86 ASP HBx 1.0 1.8 4.07 3090 2150 A 84 GLU H A 83 GLU HBx 1.0 1.8 2.98 3091 2150 A 84 GLU H A 83 GLU HBy 1.0 1.8 2.98 3092 2151 A 84 GLU HA A 86 ASP HBy 1.0 1.8 4.75 3093 2151 A 84 GLU HA A 86 ASP HBx 1.0 1.8 4.75 3094 2152 A 85 GLU H A 86 ASP HBy 1.0 1.8 5.02 3095 2152 A 85 GLU H A 86 ASP HBx 1.0 1.8 5.02 3096 2153 A 85 GLU HA A 86 ASP HBy 1.0 1.8 5.07 3097 2153 A 85 GLU HA A 86 ASP HBx 1.0 1.8 5.07 3098 2154 A 86 ASP H A 86 ASP HBy 1.0 1.8 3.08 3099 2154 A 86 ASP H A 86 ASP HBx 1.0 1.8 3.08 3100 2155 A 86 ASP HBy A 88 ILE HG1x 1.0 1.8 4.48 3101 2155 A 86 ASP HBx A 88 ILE HG1x 1.0 1.8 4.48 3102 2155 A 88 ILE HG1y A 86 ASP HBy 1.0 1.8 4.48 3103 2155 A 88 ILE HG1y A 86 ASP HBx 1.0 1.8 4.48 3104 2156 A 94 GLN H A 94 GLN HBx 1.0 1.8 3.04 3105 2156 A 94 GLN H A 94 GLN HBy 1.0 1.8 3.04 3106 2157 A 94 GLN HBy A 94 GLN HGx 1.0 1.8 2.42 3107 2157 A 94 GLN HBx A 94 GLN HGx 1.0 1.8 2.42 3108 2157 A 94 GLN HGy A 94 GLN HBx 1.0 1.8 2.42 3109 2157 A 94 GLN HGy A 94 GLN HBy 1.0 1.8 2.42 3110 2158 A 94 GLN HBx A 94 GLN HE2y 1.0 1.8 4.22 3111 2158 A 94 GLN HBy A 94 GLN HE2y 1.0 1.8 4.22 3112 2158 A 94 GLN HE2x A 94 GLN HBx 1.0 1.8 4.22 3113 2158 A 94 GLN HBy A 94 GLN HE2x 1.0 1.8 4.22 3114 2159 A 95 THR H A 94 GLN HBx 1.0 1.8 3.71 3115 2159 A 95 THR H A 94 GLN HBy 1.0 1.8 3.71 3116 2160 A 95 THR HA A 94 GLN HBx 1.0 1.8 4.81 3117 2160 A 95 THR HA A 94 GLN HBy 1.0 1.8 4.81 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 48 LYS H A 44 LEU O 1.0 1.8 2.22 2 2 A 44 LEU O A 48 LYS N 1.0 1.8 3.13 3 3 A 49 GLU H A 45 LYS O 1.0 1.8 2.22 4 4 A 45 LYS O A 49 GLU N 1.0 1.8 3.13 5 5 A 50 SER H A 46 LYS O 1.0 1.8 2.22 6 6 A 46 LYS O A 50 SER N 1.0 1.8 3.13 7 7 A 51 TYR H A 47 LEU O 1.0 1.8 2.22 8 8 A 47 LEU O A 51 TYR N 1.0 1.8 3.13 9 9 A 52 CYS H A 48 LYS O 1.0 1.8 2.22 10 10 A 48 LYS O A 52 CYS N 1.0 1.8 3.13 11 11 A 53 GLN H A 49 GLU O 1.0 1.8 2.22 12 12 A 49 GLU O A 53 GLN N 1.0 1.8 3.13 13 13 A 54 ARG H A 50 SER O 1.0 1.8 2.22 14 14 A 50 SER O A 54 ARG N 1.0 1.8 3.13 15 15 A 55 GLN H A 51 TYR O 1.0 1.8 2.22 16 16 A 51 TYR O A 55 GLN N 1.0 1.8 3.13 17 17 A 22 ILE H A 38 VAL O 1.0 1.8 2.12 18 18 A 38 VAL O A 22 ILE N 1.0 1.8 3.05 19 19 A 38 VAL H A 22 ILE O 1.0 1.8 2.12 20 20 A 22 ILE O A 38 VAL N 1.0 1.8 3.05 21 21 A 24 LEU H A 36 PHE O 1.0 1.8 2.12 22 22 A 36 PHE O A 24 LEU N 1.0 1.8 3.05 23 23 A 36 PHE H A 24 LEU O 1.0 1.8 2.12 24 24 A 24 LEU O A 36 PHE N 1.0 1.8 3.05 25 25 A 26 VAL H A 34 ILE O 1.0 1.8 2.12 26 26 A 34 ILE O A 26 VAL N 1.0 1.8 3.05 27 27 A 34 ILE H A 26 VAL O 1.0 1.8 2.12 28 28 A 26 VAL O A 34 ILE N 1.0 1.8 3.05 29 29 A 28 GLY H A 32 SER O 1.0 1.8 2.12 30 30 A 32 SER O A 28 GLY N 1.0 1.8 3.05 31 31 A 31 SER H A 28 GLY O 1.0 1.8 2.12 32 32 A 28 GLY O A 31 SER N 1.0 1.8 3.05 33 33 A 85 GLU H A 23 LYS O 1.0 1.8 2.12 34 34 A 23 LYS O A 85 GLU N 1.0 1.8 3.05 35 35 A 25 LYS H A 86 ASP O 1.0 1.8 2.12 36 36 A 86 ASP O A 25 LYS N 1.0 1.8 3.05 37 37 A 88 ILE H A 25 LYS O 1.0 1.8 2.12 38 38 A 25 LYS O A 88 ILE N 1.0 1.8 3.05 39 39 A 27 ILE H A 88 ILE O 1.0 1.8 2.12 40 40 A 88 ILE O A 27 ILE N 1.0 1.8 3.05 41 41 A 90 VAL H A 27 ILE O 1.0 1.8 2.12 42 42 A 27 ILE O A 90 VAL N 1.0 1.8 3.05 43 43 A 69 GLN H A 66 PHE O 1.0 1.8 2.12 44 44 A 66 PHE O A 69 GLN N 1.0 1.8 3.05 45 45 A 66 PHE H A 69 GLN O 1.0 1.8 2.12 46 46 A 69 GLN O A 66 PHE N 1.0 1.8 3.05 47 47 A 71 ILE H A 64 PHE O 1.0 1.8 2.12 48 48 A 64 PHE O A 71 ILE N 1.0 1.8 3.05 49 49 A 93 GLU H A 61 SER O 1.0 1.8 2.12 50 50 A 61 SER O A 93 GLU N 1.0 1.8 3.05 51 51 A 91 TYR H A 63 ARG O 1.0 1.8 2.12 52 52 A 63 ARG O A 91 TYR N 1.0 1.8 3.05 53 53 A 63 ARG H A 91 TYR O 1.0 1.8 2.12 54 54 A 91 TYR O A 63 ARG N 1.0 1.8 3.05 55 55 A 65 LEU H A 89 GLU O 1.0 1.8 2.12 56 56 A 89 GLU O A 65 LEU N 1.0 1.8 3.05 57 57 A 89 GLU H A 65 LEU O 1.0 1.8 2.12 58 58 A 65 LEU O A 89 GLU N 1.0 1.8 3.05 stop_ save_ save_CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 19 GLY C A 20 GLU N A 20 GLU CA A 20 GLU C 1.0 -158.5 -63.8 PHI 2 2 A 20 GLU N A 20 GLU CA A 20 GLU C A 21 TYR N 1.0 110.0 179.8 PSI 3 3 A 20 GLU C A 21 TYR N A 21 TYR CA A 21 TYR C 1.0 -154.0 -87.2 PHI 4 4 A 21 TYR N A 21 TYR CA A 21 TYR C A 22 ILE N 1.0 126.7 176.5 PSI 5 5 A 21 TYR C A 22 ILE N A 22 ILE CA A 22 ILE C 1.0 -159.9 -108.3 PHI 6 6 A 22 ILE N A 22 ILE CA A 22 ILE C A 23 LYS N 1.0 134.2 182.2 PSI 7 7 A 22 ILE C A 23 LYS N A 23 LYS CA A 23 LYS C 1.0 -147.1 -70.8 PHI 8 8 A 23 LYS N A 23 LYS CA A 23 LYS C A 24 LEU N 1.0 92.5 175.4 PSI 9 9 A 23 LYS C A 24 LEU N A 24 LEU CA A 24 LEU C 1.0 -156.2 -76.4 PHI 10 10 A 24 LEU N A 24 LEU CA A 24 LEU C A 25 LYS N 1.0 109.8 179.6 PSI 11 11 A 24 LEU C A 25 LYS N A 25 LYS CA A 25 LYS C 1.0 -155.2 -61.6 PHI 12 12 A 25 LYS N A 25 LYS CA A 25 LYS C A 26 VAL N 1.0 91.1 169.1 PSI 13 13 A 25 LYS C A 26 VAL N A 26 VAL CA A 26 VAL C 1.0 -137.0 -84.3 PHI 14 14 A 26 VAL N A 26 VAL CA A 26 VAL C A 27 ILE N 1.0 93.9 140.4 PSI 15 15 A 26 VAL C A 27 ILE N A 27 ILE CA A 27 ILE C 1.0 -148.4 -55.2 PHI 16 16 A 27 ILE N A 27 ILE CA A 27 ILE C A 28 GLY N 1.0 80.1 182.6 PSI 17 17 A 27 ILE C A 28 GLY N A 28 GLY CA A 28 GLY C 1.0 -133.5 -55.4 PHI 18 18 A 28 GLY N A 28 GLY CA A 28 GLY C A 29 GLN N 1.0 69.9 242.3 PSI 19 19 A 28 GLY C A 29 GLN N A 29 GLN CA A 29 GLN C 1.0 -82.1 -49.9 PHI 20 20 A 29 GLN N A 29 GLN CA A 29 GLN C A 30 ASP N 1.0 -53.9 9.1 PSI 21 21 A 29 GLN C A 30 ASP N A 30 ASP CA A 30 ASP C 1.0 -112.0 -83.6 PHI 22 22 A 30 ASP N A 30 ASP CA A 30 ASP C A 31 SER N 1.0 -9.1 31.5 PSI 23 23 A 30 ASP C A 31 SER N A 31 SER CA A 31 SER C 1.0 45.8 78.9 PHI 24 24 A 31 SER N A 31 SER CA A 31 SER C A 32 SER N 1.0 5.8 53.2 PSI 25 25 A 31 SER C A 32 SER N A 32 SER CA A 32 SER C 1.0 -194.8 5.0 PHI 26 26 A 32 SER N A 32 SER CA A 32 SER C A 33 GLU N 1.0 40.3 222.1 PSI 27 27 A 32 SER C A 33 GLU N A 33 GLU CA A 33 GLU C 1.0 -155.6 -68.5 PHI 28 28 A 33 GLU N A 33 GLU CA A 33 GLU C A 34 ILE N 1.0 90.4 163.2 PSI 29 29 A 33 GLU C A 34 ILE N A 34 ILE CA A 34 ILE C 1.0 -155.7 -55.9 PHI 30 30 A 34 ILE N A 34 ILE CA A 34 ILE C A 35 HIS N 1.0 89.6 159.5 PSI 31 31 A 34 ILE C A 35 HIS N A 35 HIS CA A 35 HIS C 1.0 -134.8 -74.4 PHI 32 32 A 35 HIS N A 35 HIS CA A 35 HIS C A 36 PHE N 1.0 102.8 162.3 PSI 33 33 A 35 HIS C A 36 PHE N A 36 PHE CA A 36 PHE C 1.0 -156.9 -88.7 PHI 34 34 A 38 VAL N A 38 VAL CA A 38 VAL C A 39 LYS N 1.0 97.3 226.1 PSI 35 35 A 38 VAL C A 39 LYS N A 39 LYS CA A 39 LYS C 1.0 -158.0 11.2 PHI 36 36 A 39 LYS N A 39 LYS CA A 39 LYS C A 40 MET N 1.0 61.7 219.8 PSI 37 37 A 39 LYS C A 40 MET N A 40 MET CA A 40 MET C 1.0 -135.5 -28.3 PHI 38 38 A 40 MET N A 40 MET CA A 40 MET C A 41 THR N 1.0 -73.3 26.4 PSI 39 39 A 40 MET C A 41 THR N A 41 THR CA A 41 THR C 1.0 -186.6 -49.2 PHI 40 40 A 41 THR N A 41 THR CA A 41 THR C A 42 THR N 1.0 122.7 180.7 PSI 41 41 A 41 THR C A 42 THR N A 42 THR CA A 42 THR C 1.0 -169.9 -49.2 PHI 42 42 A 42 THR N A 42 THR CA A 42 THR C A 43 HIS N 1.0 80.6 175.9 PSI 43 43 A 43 HIS C A 44 LEU N A 44 LEU CA A 44 LEU C 1.0 -78.7 -50.0 PHI 44 44 A 44 LEU N A 44 LEU CA A 44 LEU C A 45 LYS N 1.0 -56.9 -11.1 PSI 45 45 A 44 LEU C A 45 LYS N A 45 LYS CA A 45 LYS C 1.0 -74.5 -50.2 PHI 46 46 A 45 LYS N A 45 LYS CA A 45 LYS C A 46 LYS N 1.0 -62.4 -9.0 PSI 47 47 A 45 LYS C A 46 LYS N A 46 LYS CA A 46 LYS C 1.0 -97.2 -38.9 PHI 48 48 A 46 LYS N A 46 LYS CA A 46 LYS C A 47 LEU N 1.0 -60.3 2.3 PSI 49 49 A 46 LYS C A 47 LEU N A 47 LEU CA A 47 LEU C 1.0 -87.1 -46.6 PHI 50 50 A 47 LEU N A 47 LEU CA A 47 LEU C A 48 LYS N 1.0 -61.0 -16.5 PSI 51 51 A 47 LEU C A 48 LYS N A 48 LYS CA A 48 LYS C 1.0 -72.5 -52.1 PHI 52 52 A 48 LYS N A 48 LYS CA A 48 LYS C A 49 GLU N 1.0 -60.8 -12.4 PSI 53 53 A 48 LYS C A 49 GLU N A 49 GLU CA A 49 GLU C 1.0 -74.1 -49.9 PHI 54 54 A 49 GLU N A 49 GLU CA A 49 GLU C A 50 SER N 1.0 -52.2 -32.2 PSI 55 55 A 49 GLU C A 50 SER N A 50 SER CA A 50 SER C 1.0 -81.9 -48.2 PHI 56 56 A 50 SER N A 50 SER CA A 50 SER C A 51 TYR N 1.0 -63.1 -19.8 PSI 57 57 A 50 SER C A 51 TYR N A 51 TYR CA A 51 TYR C 1.0 -73.2 -53.2 PHI 58 58 A 51 TYR N A 51 TYR CA A 51 TYR C A 52 CYS N 1.0 -52.3 -32.3 PSI 59 59 A 51 TYR C A 52 CYS N A 52 CYS CA A 52 CYS C 1.0 -71.8 -51.8 PHI 60 60 A 52 CYS N A 52 CYS CA A 52 CYS C A 53 GLN N 1.0 -51.5 -28.3 PSI 61 61 A 52 CYS C A 53 GLN N A 53 GLN CA A 53 GLN C 1.0 -71.9 -51.9 PHI 62 62 A 53 GLN N A 53 GLN CA A 53 GLN C A 54 ARG N 1.0 -56.8 -32.0 PSI 63 63 A 53 GLN C A 54 ARG N A 54 ARG CA A 54 ARG C 1.0 -95.4 -46.6 PHI 64 64 A 54 ARG N A 54 ARG CA A 54 ARG C A 55 GLN N 1.0 -51.8 -0.2 PSI 65 65 A 54 ARG C A 55 GLN N A 55 GLN CA A 55 GLN C 1.0 -111.0 -62.2 PHI 66 66 A 55 GLN N A 55 GLN CA A 55 GLN C A 56 GLY N 1.0 -13.8 18.9 PSI 67 67 A 55 GLN C A 56 GLY N A 56 GLY CA A 56 GLY C 1.0 38.3 109.0 PHI 68 68 A 56 GLY N A 56 GLY CA A 56 GLY C A 57 VAL N 1.0 6.3 59.9 PSI 69 69 A 56 GLY C A 57 VAL N A 57 VAL CA A 57 VAL C 1.0 -171.7 -56.5 PHI 70 70 A 57 VAL N A 57 VAL CA A 57 VAL C A 58 PRO N 1.0 70.0 214.9 PSI 71 71 A 58 PRO C A 59 MET N A 59 MET CA A 59 MET C 1.0 -79.8 -39.1 PHI 72 72 A 59 MET N A 59 MET CA A 59 MET C A 60 ASN N 1.0 -52.3 -11.7 PSI 73 73 A 61 SER C A 62 LEU N A 62 LEU CA A 62 LEU C 1.0 -153.8 -100.0 PHI 74 74 A 62 LEU N A 62 LEU CA A 62 LEU C A 63 ARG N 1.0 123.2 191.3 PSI 75 75 A 62 LEU C A 63 ARG N A 63 ARG CA A 63 ARG C 1.0 -173.7 -75.9 PHI 76 76 A 63 ARG N A 63 ARG CA A 63 ARG C A 64 PHE N 1.0 106.5 180.6 PSI 77 77 A 63 ARG C A 64 PHE N A 64 PHE CA A 64 PHE C 1.0 -128.1 -95.7 PHI 78 78 A 64 PHE N A 64 PHE CA A 64 PHE C A 65 LEU N 1.0 102.3 152.7 PSI 79 79 A 64 PHE C A 65 LEU N A 65 LEU CA A 65 LEU C 1.0 -161.1 -74.7 PHI 80 80 A 65 LEU N A 65 LEU CA A 65 LEU C A 66 PHE N 1.0 99.2 185.4 PSI 81 81 A 65 LEU C A 66 PHE N A 66 PHE CA A 66 PHE C 1.0 -147.8 -66.2 PHI 82 82 A 66 PHE N A 66 PHE CA A 66 PHE C A 67 GLU N 1.0 94.3 142.1 PSI 83 83 A 66 PHE C A 67 GLU N A 67 GLU CA A 67 GLU C 1.0 40.5 69.2 PHI 84 84 A 67 GLU N A 67 GLU CA A 67 GLU C A 68 GLY N 1.0 27.5 54.9 PSI 85 85 A 67 GLU C A 68 GLY N A 68 GLY CA A 68 GLY C 1.0 57.2 104.5 PHI 86 86 A 68 GLY N A 68 GLY CA A 68 GLY C A 69 GLN N 1.0 -33.6 31.9 PSI 87 87 A 68 GLY C A 69 GLN N A 69 GLN CA A 69 GLN C 1.0 -138.3 -80.3 PHI 88 88 A 69 GLN N A 69 GLN CA A 69 GLN C A 70 ARG N 1.0 88.4 168.7 PSI 89 89 A 69 GLN C A 70 ARG N A 70 ARG CA A 70 ARG C 1.0 -120.7 -66.9 PHI 90 90 A 70 ARG N A 70 ARG CA A 70 ARG C A 71 ILE N 1.0 96.6 140.8 PSI 91 91 A 70 ARG C A 71 ILE N A 71 ILE CA A 71 ILE C 1.0 -115.1 -68.4 PHI 92 92 A 71 ILE N A 71 ILE CA A 71 ILE C A 72 ALA N 1.0 94.2 140.5 PSI 93 93 A 71 ILE C A 72 ALA N A 72 ALA CA A 72 ALA C 1.0 -136.3 -48.2 PHI 94 94 A 72 ALA N A 72 ALA CA A 72 ALA C A 73 ASP N 1.0 80.6 182.4 PSI 95 95 A 72 ALA C A 73 ASP N A 73 ASP CA A 73 ASP C 1.0 42.9 62.9 PHI 96 96 A 73 ASP N A 73 ASP CA A 73 ASP C A 74 ASN N 1.0 21.4 69.2 PSI 97 97 A 74 ASN C A 75 HIS N A 75 HIS CA A 75 HIS C 1.0 -161.1 -61.1 PHI 98 98 A 75 HIS N A 75 HIS CA A 75 HIS C A 76 THR N 1.0 122.7 175.9 PSI 99 99 A 75 HIS C A 76 THR N A 76 THR CA A 76 THR C 1.0 -167.7 -45.0 PHI 100 100 A 76 THR N A 76 THR CA A 76 THR C A 77 PRO N 1.0 73.1 202.5 PSI 101 101 A 77 PRO C A 78 LYS N A 78 LYS CA A 78 LYS C 1.0 -97.7 -40.3 PHI 102 102 A 78 LYS N A 78 LYS CA A 78 LYS C A 79 GLU N 1.0 -58.9 16.8 PSI 103 103 A 78 LYS C A 79 GLU N A 79 GLU CA A 79 GLU C 1.0 -96.5 -47.0 PHI 104 104 A 79 GLU N A 79 GLU CA A 79 GLU C A 80 LEU N 1.0 -53.0 -2.3 PSI 105 105 A 79 GLU C A 80 LEU N A 80 LEU CA A 80 LEU C 1.0 -113.1 -63.2 PHI 106 106 A 80 LEU N A 80 LEU CA A 80 LEU C A 81 GLY N 1.0 -12.0 20.6 PSI 107 107 A 80 LEU C A 81 GLY N A 81 GLY CA A 81 GLY C 1.0 77.5 106.9 PHI 108 108 A 81 GLY N A 81 GLY CA A 81 GLY C A 82 MET N 1.0 -20.3 14.2 PSI 109 109 A 81 GLY C A 82 MET N A 82 MET CA A 82 MET C 1.0 -123.1 -61.4 PHI 110 110 A 82 MET N A 82 MET CA A 82 MET C A 83 GLU N 1.0 64.2 208.0 PSI 111 111 A 82 MET C A 83 GLU N A 83 GLU CA A 83 GLU C 1.0 -158.7 -65.9 PHI 112 112 A 83 GLU N A 83 GLU CA A 83 GLU C A 84 GLU N 1.0 129.0 199.2 PSI 113 113 A 84 GLU C A 85 GLU N A 85 GLU CA A 85 GLU C 1.0 45.8 124.4 PHI 114 114 A 85 GLU N A 85 GLU CA A 85 GLU C A 86 ASP N 1.0 -35.9 42.0 PSI 115 115 A 85 GLU C A 86 ASP N A 86 ASP CA A 86 ASP C 1.0 -108.7 -68.6 PHI 116 116 A 86 ASP N A 86 ASP CA A 86 ASP C A 87 VAL N 1.0 56.9 213.8 PSI 117 117 A 86 ASP C A 87 VAL N A 87 VAL CA A 87 VAL C 1.0 -238.9 8.1 PHI 118 118 A 87 VAL N A 87 VAL CA A 87 VAL C A 88 ILE N 1.0 90.2 173.2 PSI 119 119 A 87 VAL C A 88 ILE N A 88 ILE CA A 88 ILE C 1.0 -131.3 -98.9 PHI 120 120 A 88 ILE N A 88 ILE CA A 88 ILE C A 89 GLU N 1.0 100.1 148.1 PSI 121 121 A 88 ILE C A 89 GLU N A 89 GLU CA A 89 GLU C 1.0 -147.1 -87.1 PHI 122 122 A 89 GLU N A 89 GLU CA A 89 GLU C A 90 VAL N 1.0 111.1 161.7 PSI 123 123 A 89 GLU C A 90 VAL N A 90 VAL CA A 90 VAL C 1.0 -165.7 -85.0 PHI 124 124 A 90 VAL N A 90 VAL CA A 90 VAL C A 91 TYR N 1.0 106.2 172.5 PSI 125 125 A 90 VAL C A 91 TYR N A 91 TYR CA A 91 TYR C 1.0 -255.3 -1.1 PHI 126 126 A 91 TYR N A 91 TYR CA A 91 TYR C A 92 GLN N 1.0 98.4 223.0 PSI 127 127 A 91 TYR C A 92 GLN N A 92 GLN CA A 92 GLN C 1.0 -144.6 -55.4 PHI 128 128 A 92 GLN N A 92 GLN CA A 92 GLN C A 93 GLU N 1.0 84.3 157.5 PSI stop_ save_ save_CNS/XPLOR_dipolar_coupling_4 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_4 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 2 SER N A 2 SER H 1.0 . . . 2 2 A 4 GLN N A 4 GLN H 1.0 . . . 3 3 A 6 ALA N A 6 ALA H 1.0 . . . 4 4 A 9 SER N A 9 SER H 1.0 . . . 5 5 A 10 THR N A 10 THR H 1.0 . . . 6 6 A 13 LEU N A 13 LEU H 1.0 . . . 7 7 A 14 GLY N A 14 GLY H 1.0 . . . 8 8 A 15 ASP N A 15 ASP H 1.0 . . . 9 9 A 19 GLY N A 19 GLY H 1.0 . . . 10 10 A 20 GLU N A 20 GLU H 1.0 . . . 11 11 A 22 ILE N A 22 ILE H 1.0 . . . 12 12 A 25 LYS N A 25 LYS H 1.0 . . . 13 13 A 26 VAL N A 26 VAL H 1.0 . . . 14 14 A 27 ILE N A 27 ILE H 1.0 . . . 15 15 A 31 SER N A 31 SER H 1.0 . . . 16 16 A 33 GLU N A 33 GLU H 1.0 . . . 17 17 A 34 ILE N A 34 ILE H 1.0 . . . 18 18 A 39 LYS N A 39 LYS H 1.0 . . . 19 19 A 41 THR N A 41 THR H 1.0 . . . 20 20 A 44 LEU N A 44 LEU H 1.0 . . . 21 21 A 47 LEU N A 47 LEU H 1.0 . . . 22 22 A 48 LYS N A 48 LYS H 1.0 . . . 23 23 A 49 GLU N A 49 GLU H 1.0 . . . 24 24 A 51 TYR N A 51 TYR H 1.0 . . . 25 25 A 52 CYS N A 52 CYS H 1.0 . . . 26 26 A 59 MET N A 59 MET H 1.0 . . . 27 27 A 61 SER N A 61 SER H 1.0 . . . 28 28 A 64 PHE N A 64 PHE H 1.0 . . . 29 29 A 65 LEU N A 65 LEU H 1.0 . . . 30 30 A 70 ARG N A 70 ARG H 1.0 . . . 31 31 A 71 ILE N A 71 ILE H 1.0 . . . 32 32 A 76 THR N A 76 THR H 1.0 . . . 33 33 A 82 MET N A 82 MET H 1.0 . . . 34 34 A 83 GLU N A 83 GLU H 1.0 . . . 35 35 A 85 GLU N A 85 GLU H 1.0 . . . 36 36 A 87 VAL N A 87 VAL H 1.0 . . . 37 37 A 88 ILE N A 88 ILE H 1.0 . . . 38 38 A 89 GLU N A 89 GLU H 1.0 . . . 39 39 A 90 VAL N A 90 VAL H 1.0 . . . 40 40 A 94 GLN N A 94 GLN H 1.0 . . . 41 41 A 95 THR N A 95 THR H 1.0 . . . 42 42 A 96 GLY N A 96 GLY H 1.0 . . . stop_ save_