data_nef_c19000_2m4e 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 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly 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 -23 MET start . . 2 A -22 HIS middle . . 3 A -21 HIS middle . . 4 A -20 HIS middle . . 5 A -19 HIS middle . . 6 A -18 HIS middle . . 7 A -17 HIS middle . . 8 A -16 SER middle . . 9 A -15 SER middle . . 10 A -14 GLY middle . false 11 A -13 VAL middle . . 12 A -12 ASP middle . . 13 A -11 LEU middle . . 14 A -10 GLY middle . false 15 A -9 THR middle . . 16 A -8 GLU middle . . 17 A -7 ASN middle . . 18 A -6 LEU middle . . 19 A -5 TYR middle . . 20 A -4 PHE middle . . 21 A -3 GLN middle . . 22 A -2 SER middle . . 23 A -1 ASN middle . . 24 A 0 ALA middle . . 25 A 1 MET middle . . 26 A 2 SER middle . . 27 A 3 LYS middle . . 28 A 4 THR middle . . 29 A 5 ALA middle . . 30 A 6 LYS middle . . 31 A 7 LEU middle . . 32 A 8 ASN middle . . 33 A 9 ASN middle . . 34 A 10 GLU middle . . 35 A 11 GLU middle . . 36 A 12 LYS middle . . 37 A 13 LEU middle . . 38 A 14 VAL middle . . 39 A 15 LYS middle . . 40 A 16 LYS middle . . 41 A 17 ALA middle . . 42 A 18 LEU middle . . 43 A 19 GLU middle . . 44 A 20 ILE middle . . 45 A 21 GLY middle . false 46 A 22 GLY middle . false 47 A 23 LYS middle . . 48 A 24 MET middle . . 49 A 25 ALA middle . . 50 A 26 LYS middle . . 51 A 27 MET middle . . 52 A 28 GLN middle . . 53 A 29 GLY middle . false 54 A 30 PHE middle . . 55 A 31 ASP middle . . 56 A 32 LEU middle . . 57 A 33 PRO middle . false 58 A 34 GLN middle . . 59 A 35 SER middle . . 60 A 36 PRO middle . false 61 A 37 GLN middle . . 62 A 38 PRO middle . false 63 A 39 VAL middle . . 64 A 40 ARG middle . . 65 A 41 VAL middle . . 66 A 42 LYS middle . . 67 A 43 ALA middle . . 68 A 44 VAL middle . . 69 A 45 TYR middle . . 70 A 46 LEU middle . . 71 A 47 PHE middle . . 72 A 48 LEU middle . . 73 A 49 VAL middle . . 74 A 50 ASP middle . . 75 A 51 ALA middle . . 76 A 52 LYS middle . . 77 A 53 GLN middle . . 78 A 54 ILE middle . . 79 A 55 ALA middle . . 80 A 56 PRO middle . false 81 A 57 LEU middle . . 82 A 58 PRO middle . false 83 A 59 ASP middle . . 84 A 60 SER middle . . 85 A 61 LYS middle . . 86 A 62 LEU middle . . 87 A 63 ASP middle . . 88 A 64 GLY middle . false 89 A 65 ALA middle . . 90 A 66 ASN middle . . 91 A 67 ILE middle . . 92 A 68 LYS middle . . 93 A 69 HIS middle . . 94 A 70 ARG middle . . 95 A 71 LEU middle . . 96 A 72 ALA middle . . 97 A 73 LEU middle . . 98 A 74 TRP middle . . 99 A 75 ILE middle . . 100 A 76 HIS middle . . 101 A 77 ALA middle . . 102 A 78 ALA middle . . 103 A 79 LEU middle . . 104 A 80 PRO middle . false 105 A 81 ASP middle . . 106 A 82 ASN middle . . 107 A 83 ASP middle . . 108 A 84 PRO middle . false 109 A 85 LEU middle . . 110 A 86 LYS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_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 3 LYS HA H 1 4.307 0.04 A 3 LYS HBy H 1 1.834 0.04 A 3 LYS HBx H 1 1.728 0.04 A 3 LYS HDx H 1 1.627 0.04 A 3 LYS HDy H 1 1.627 0.04 A 3 LYS HEx H 1 2.926 0.04 A 3 LYS HEy H 1 2.926 0.04 A 3 LYS HGy H 1 1.404 0.04 A 3 LYS HGx H 1 1.353 0.04 A 3 LYS CA C 13 56.870 0.40 A 3 LYS CB C 13 32.870 0.40 A 3 LYS CD C 13 29.280 0.40 A 3 LYS CE C 13 42.140 0.40 A 3 LYS CG C 13 24.710 0.40 A 4 THR HA H 1 4.217 0.04 A 4 THR HB H 1 4.100 0.04 A 4 THR HG2% H 1 1.093 0.04 A 4 THR CA C 13 61.800 0.40 A 4 THR CB C 13 70.020 0.40 A 4 THR CG2 C 13 21.540 0.40 A 5 ALA HA H 1 4.205 0.04 A 5 ALA HB% H 1 1.292 0.04 A 5 ALA C C 13 177.085 0.40 A 5 ALA CA C 13 52.940 0.40 A 5 ALA CB C 13 19.350 0.40 A 6 LYS H H 1 8.035 0.04 A 6 LYS HA H 1 4.243 0.04 A 6 LYS HBy H 1 1.704 0.04 A 6 LYS HBx H 1 1.652 0.04 A 6 LYS HDx H 1 1.601 0.04 A 6 LYS HDy H 1 1.601 0.04 A 6 LYS HEx H 1 2.926 0.04 A 6 LYS HEy H 1 2.926 0.04 A 6 LYS HGx H 1 1.350 0.04 A 6 LYS HGy H 1 1.350 0.04 A 6 LYS CA C 13 56.140 0.40 A 6 LYS CB C 13 33.290 0.40 A 6 LYS CD C 13 29.080 0.40 A 6 LYS CE C 13 42.140 0.40 A 6 LYS CG C 13 24.660 0.40 A 6 LYS N N 15 120.316 0.40 A 7 LEU H H 1 8.782 0.04 A 7 LEU HA H 1 4.253 0.04 A 7 LEU HBy H 1 1.516 0.04 A 7 LEU HBx H 1 1.347 0.04 A 7 LEU HDx% H 1 0.608 0.04 A 7 LEU HDy% H 1 0.505 0.04 A 7 LEU HG H 1 1.512 0.04 A 7 LEU CA C 13 54.870 0.40 A 7 LEU CB C 13 42.380 0.40 A 7 LEU CDy C 13 25.240 0.40 A 7 LEU CDx C 13 23.100 0.40 A 7 LEU CG C 13 27.100 0.40 A 7 LEU N N 15 124.900 0.40 A 9 ASN HA H 1 4.706 0.04 A 9 ASN HBx H 1 2.847 0.04 A 9 ASN HBy H 1 2.847 0.04 A 9 ASN HD2y H 1 7.606 0.04 A 9 ASN HD2x H 1 7.084 0.04 A 9 ASN C C 13 175.856 0.40 A 9 ASN CA C 13 53.800 0.40 A 9 ASN CB C 13 38.010 0.40 A 9 ASN ND2 N 15 115.012 0.40 A 10 GLU H H 1 7.922 0.04 A 10 GLU HA H 1 3.655 0.04 A 10 GLU HBy H 1 2.348 0.04 A 10 GLU HBx H 1 1.983 0.04 A 10 GLU HGx H 1 2.102 0.04 A 10 GLU HGy H 1 2.102 0.04 A 10 GLU C C 13 177.454 0.40 A 10 GLU CA C 13 61.660 0.40 A 10 GLU CB C 13 29.900 0.40 A 10 GLU CG C 13 37.190 0.40 A 10 GLU N N 15 119.396 0.40 A 11 GLU H H 1 8.725 0.04 A 11 GLU HA H 1 3.991 0.04 A 11 GLU HBy H 1 2.071 0.04 A 11 GLU HBx H 1 2.024 0.04 A 11 GLU HGy H 1 2.356 0.04 A 11 GLU HGx H 1 2.291 0.04 A 11 GLU C C 13 179.727 0.40 A 11 GLU CA C 13 60.120 0.40 A 11 GLU CB C 13 29.020 0.40 A 11 GLU CG C 13 36.260 0.40 A 11 GLU N N 15 117.048 0.40 A 12 LYS H H 1 7.659 0.04 A 12 LYS HA H 1 4.014 0.04 A 12 LYS HBx H 1 1.844 0.04 A 12 LYS HBy H 1 1.844 0.04 A 12 LYS HDx H 1 1.681 0.04 A 12 LYS HDy H 1 1.681 0.04 A 12 LYS HEx H 1 2.957 0.04 A 12 LYS HEy H 1 2.957 0.04 A 12 LYS HGy H 1 1.621 0.04 A 12 LYS HGx H 1 1.422 0.04 A 12 LYS C C 13 179.947 0.40 A 12 LYS CA C 13 59.570 0.40 A 12 LYS CB C 13 32.960 0.40 A 12 LYS CD C 13 29.520 0.40 A 12 LYS CE C 13 42.440 0.40 A 12 LYS CG C 13 26.120 0.40 A 12 LYS N N 15 118.908 0.40 A 13 LEU H H 1 8.094 0.04 A 13 LEU HA H 1 4.019 0.04 A 13 LEU HBy H 1 2.197 0.04 A 13 LEU HBx H 1 1.456 0.04 A 13 LEU HDx% H 1 0.962 0.04 A 13 LEU HDy% H 1 0.908 0.04 A 13 LEU HG H 1 1.803 0.04 A 13 LEU C C 13 178.691 0.40 A 13 LEU CA C 13 58.040 0.40 A 13 LEU CB C 13 41.460 0.40 A 13 LEU CDy C 13 27.290 0.40 A 13 LEU CDx C 13 24.220 0.40 A 13 LEU CG C 13 27.290 0.40 A 13 LEU N N 15 121.257 0.40 A 14 VAL H H 1 8.730 0.04 A 14 VAL HA H 1 3.388 0.04 A 14 VAL HB H 1 2.208 0.04 A 14 VAL HGx% H 1 0.900 0.04 A 14 VAL HGy% H 1 1.163 0.04 A 14 VAL C C 13 177.550 0.40 A 14 VAL CA C 13 67.610 0.40 A 14 VAL CB C 13 31.250 0.40 A 14 VAL CGx C 13 21.360 0.40 A 14 VAL CGy C 13 24.810 0.40 A 14 VAL N N 15 120.164 0.40 A 15 LYS H H 1 7.573 0.04 A 15 LYS HA H 1 3.882 0.04 A 15 LYS HBx H 1 1.930 0.04 A 15 LYS HBy H 1 1.930 0.04 A 15 LYS HDx H 1 1.681 0.04 A 15 LYS HDy H 1 1.681 0.04 A 15 LYS HEx H 1 2.974 0.04 A 15 LYS HEy H 1 2.974 0.04 A 15 LYS HGy H 1 1.610 0.04 A 15 LYS HGx H 1 1.432 0.04 A 15 LYS C C 13 179.385 0.40 A 15 LYS CA C 13 60.530 0.40 A 15 LYS CB C 13 32.570 0.40 A 15 LYS CD C 13 29.670 0.40 A 15 LYS CE C 13 42.140 0.40 A 15 LYS CG C 13 25.440 0.40 A 15 LYS N N 15 117.870 0.40 A 16 LYS H H 1 7.686 0.04 A 16 LYS HA H 1 4.219 0.04 A 16 LYS HBy H 1 2.002 0.04 A 16 LYS HBx H 1 1.912 0.04 A 16 LYS HDy H 1 1.695 0.04 A 16 LYS HDx H 1 1.632 0.04 A 16 LYS HEx H 1 2.803 0.04 A 16 LYS HEy H 1 2.803 0.04 A 16 LYS HGy H 1 1.510 0.04 A 16 LYS HGx H 1 1.405 0.04 A 16 LYS C C 13 178.033 0.40 A 16 LYS CA C 13 58.240 0.40 A 16 LYS CB C 13 31.580 0.40 A 16 LYS CD C 13 28.500 0.40 A 16 LYS CE C 13 42.050 0.40 A 16 LYS CG C 13 24.660 0.40 A 16 LYS N N 15 119.844 0.40 A 17 ALA H H 1 8.899 0.04 A 17 ALA HA H 1 4.217 0.04 A 17 ALA HB% H 1 1.790 0.04 A 17 ALA C C 13 180.658 0.40 A 17 ALA CA C 13 55.640 0.40 A 17 ALA CB C 13 19.320 0.40 A 17 ALA N N 15 122.170 0.40 A 18 LEU H H 1 8.572 0.04 A 18 LEU HA H 1 4.084 0.04 A 18 LEU HBy H 1 2.051 0.04 A 18 LEU HBx H 1 1.372 0.04 A 18 LEU HDx% H 1 0.819 0.04 A 18 LEU HDy% H 1 0.775 0.04 A 18 LEU HG H 1 2.165 0.04 A 18 LEU C C 13 180.429 0.40 A 18 LEU CA C 13 57.930 0.40 A 18 LEU CB C 13 41.210 0.40 A 18 LEU CDy C 13 25.870 0.40 A 18 LEU CDx C 13 23.740 0.40 A 18 LEU CG C 13 26.460 0.40 A 18 LEU N N 15 116.351 0.40 A 19 GLU H H 1 7.889 0.04 A 19 GLU HA H 1 4.068 0.04 A 19 GLU HBx H 1 2.254 0.04 A 19 GLU HBy H 1 2.254 0.04 A 19 GLU HGy H 1 2.437 0.04 A 19 GLU HGx H 1 2.126 0.04 A 19 GLU C C 13 179.411 0.40 A 19 GLU CA C 13 59.500 0.40 A 19 GLU CB C 13 29.740 0.40 A 19 GLU CG C 13 35.920 0.40 A 19 GLU N N 15 121.497 0.40 A 20 ILE H H 1 8.805 0.04 A 20 ILE HA H 1 3.859 0.04 A 20 ILE HB H 1 2.028 0.04 A 20 ILE HD1% H 1 0.742 0.04 A 20 ILE HG1x H 1 1.528 0.04 A 20 ILE HG1y H 1 1.528 0.04 A 20 ILE HG2% H 1 1.003 0.04 A 20 ILE C C 13 179.227 0.40 A 20 ILE CA C 13 63.780 0.40 A 20 ILE CB C 13 37.140 0.40 A 20 ILE CD1 C 13 11.070 0.40 A 20 ILE CG1 C 13 28.460 0.40 A 20 ILE CG2 C 13 17.330 0.40 A 20 ILE N N 15 120.536 0.40 A 21 GLY H H 1 9.513 0.04 A 21 GLY HAy H 1 4.112 0.04 A 21 GLY HAx H 1 3.699 0.04 A 21 GLY C C 13 175.075 0.40 A 21 GLY CA C 13 47.470 0.40 A 21 GLY N N 15 109.481 0.40 A 22 GLY H H 1 7.967 0.04 A 22 GLY HAy H 1 3.910 0.04 A 22 GLY HAx H 1 3.628 0.04 A 22 GLY C C 13 176.462 0.40 A 22 GLY CA C 13 47.070 0.40 A 22 GLY N N 15 106.770 0.40 A 23 LYS H H 1 7.718 0.04 A 23 LYS HA H 1 4.082 0.04 A 23 LYS HBx H 1 1.998 0.04 A 23 LYS HBy H 1 1.998 0.04 A 23 LYS HDx H 1 1.676 0.04 A 23 LYS HDy H 1 1.676 0.04 A 23 LYS HEx H 1 2.957 0.04 A 23 LYS HEy H 1 2.957 0.04 A 23 LYS HGy H 1 1.603 0.04 A 23 LYS HGx H 1 1.422 0.04 A 23 LYS C C 13 178.928 0.40 A 23 LYS CA C 13 59.680 0.40 A 23 LYS CB C 13 32.070 0.40 A 23 LYS CD C 13 29.670 0.40 A 23 LYS CE C 13 41.890 0.40 A 23 LYS CG C 13 25.440 0.40 A 23 LYS N N 15 123.825 0.40 A 24 MET H H 1 8.337 0.04 A 24 MET HA H 1 4.030 0.04 A 24 MET HBy H 1 2.445 0.04 A 24 MET HBx H 1 2.386 0.04 A 24 MET HE% H 1 2.175 0.04 A 24 MET HGy H 1 2.946 0.04 A 24 MET HGx H 1 2.626 0.04 A 24 MET C C 13 178.340 0.40 A 24 MET CA C 13 59.510 0.40 A 24 MET CB C 13 33.840 0.40 A 24 MET CE C 13 16.800 0.40 A 24 MET CG C 13 32.140 0.40 A 24 MET N N 15 120.113 0.40 A 25 ALA H H 1 7.698 0.04 A 25 ALA HA H 1 3.186 0.04 A 25 ALA HB% H 1 0.559 0.04 A 25 ALA C C 13 179.885 0.40 A 25 ALA CA C 13 55.440 0.40 A 25 ALA CB C 13 16.990 0.40 A 25 ALA N N 15 120.985 0.40 A 26 LYS H H 1 7.826 0.04 A 26 LYS HA H 1 4.148 0.04 A 26 LYS HBy H 1 1.949 0.04 A 26 LYS HBx H 1 1.910 0.04 A 26 LYS HDx H 1 1.620 0.04 A 26 LYS HDy H 1 1.620 0.04 A 26 LYS HEx H 1 2.925 0.04 A 26 LYS HEy H 1 2.925 0.04 A 26 LYS HGx H 1 1.436 0.04 A 26 LYS HGy H 1 1.436 0.04 A 26 LYS C C 13 181.263 0.40 A 26 LYS CA C 13 58.890 0.40 A 26 LYS CB C 13 32.060 0.40 A 26 LYS CD C 13 28.930 0.40 A 26 LYS CE C 13 42.340 0.40 A 26 LYS CG C 13 24.710 0.40 A 26 LYS N N 15 119.895 0.40 A 27 MET H H 1 8.154 0.04 A 27 MET HA H 1 4.203 0.04 A 27 MET HBy H 1 2.268 0.04 A 27 MET HBx H 1 2.220 0.04 A 27 MET HE% H 1 2.095 0.04 A 27 MET HGy H 1 2.775 0.04 A 27 MET HGx H 1 2.674 0.04 A 27 MET C C 13 177.708 0.40 A 27 MET CA C 13 58.470 0.40 A 27 MET CB C 13 32.330 0.40 A 27 MET CE C 13 16.800 0.40 A 27 MET CG C 13 32.330 0.40 A 27 MET N N 15 119.293 0.40 A 28 GLN H H 1 7.419 0.04 A 28 GLN HA H 1 4.390 0.04 A 28 GLN HBy H 1 2.599 0.04 A 28 GLN HBx H 1 2.101 0.04 A 28 GLN HE2y H 1 7.552 0.04 A 28 GLN HE2x H 1 6.771 0.04 A 28 GLN HGy H 1 2.714 0.04 A 28 GLN HGx H 1 2.534 0.04 A 28 GLN C C 13 175.364 0.40 A 28 GLN CA C 13 55.610 0.40 A 28 GLN CB C 13 29.260 0.40 A 28 GLN CG C 13 34.320 0.40 A 28 GLN N N 15 116.076 0.40 A 28 GLN NE2 N 15 110.699 0.40 A 29 GLY H H 1 7.737 0.04 A 29 GLY HAy H 1 3.975 0.04 A 29 GLY HAx H 1 3.619 0.04 A 29 GLY C C 13 174.021 0.40 A 29 GLY CA C 13 45.490 0.40 A 29 GLY N N 15 106.674 0.40 A 30 PHE H H 1 8.084 0.04 A 30 PHE HA H 1 4.555 0.04 A 30 PHE HBy H 1 2.751 0.04 A 30 PHE HBx H 1 2.541 0.04 A 30 PHE HDx H 1 7.149 0.04 A 30 PHE HDy H 1 7.149 0.04 A 30 PHE HEx H 1 7.438 0.04 A 30 PHE HEy H 1 7.438 0.04 A 30 PHE CA C 13 57.080 0.40 A 30 PHE CB C 13 39.900 0.40 A 30 PHE CDx C 13 131.832 0.40 A 30 PHE CEx C 13 131.576 0.40 A 30 PHE N N 15 120.626 0.40 A 31 ASP HA H 1 4.640 0.04 A 31 ASP HBy H 1 2.582 0.04 A 31 ASP HBx H 1 2.398 0.04 A 31 ASP C C 13 174.873 0.40 A 31 ASP CA C 13 53.150 0.40 A 31 ASP CB C 13 41.020 0.40 A 32 LEU H H 1 8.122 0.04 A 32 LEU HA H 1 4.532 0.04 A 32 LEU HBy H 1 1.453 0.04 A 32 LEU HBx H 1 1.261 0.04 A 32 LEU HDx% H 1 0.552 0.04 A 32 LEU HDy% H 1 0.696 0.04 A 32 LEU HG H 1 1.476 0.04 A 32 LEU CA C 13 52.330 0.40 A 32 LEU CB C 13 40.880 0.40 A 32 LEU CDy C 13 26.460 0.40 A 32 LEU CDx C 13 22.810 0.40 A 32 LEU CG C 13 26.760 0.40 A 32 LEU N N 15 123.295 0.40 A 33 PRO HDy H 1 3.750 0.04 A 33 PRO HDx H 1 3.328 0.04 A 33 PRO CD C 13 50.300 0.40 A 34 GLN HA H 1 4.089 0.04 A 34 GLN HBy H 1 2.200 0.04 A 34 GLN HBx H 1 1.835 0.04 A 34 GLN HE2y H 1 7.256 0.04 A 34 GLN HE2x H 1 6.853 0.04 A 34 GLN HGy H 1 2.372 0.04 A 34 GLN HGx H 1 2.341 0.04 A 34 GLN C C 13 175.224 0.40 A 34 GLN CA C 13 55.610 0.40 A 34 GLN CB C 13 30.150 0.40 A 34 GLN CG C 13 34.090 0.40 A 34 GLN NE2 N 15 113.818 0.40 A 35 SER H H 1 7.546 0.04 A 35 SER HA H 1 4.291 0.04 A 35 SER HBy H 1 3.735 0.04 A 35 SER HBx H 1 3.676 0.04 A 35 SER CA C 13 56.170 0.40 A 35 SER CB C 13 63.830 0.40 A 35 SER N N 15 111.628 0.40 A 36 PRO HA H 1 4.937 0.04 A 36 PRO HBy H 1 2.599 0.04 A 36 PRO HBx H 1 2.265 0.04 A 36 PRO HDx H 1 3.510 0.04 A 36 PRO HDy H 1 3.510 0.04 A 36 PRO HGy H 1 2.098 0.04 A 36 PRO HGx H 1 1.694 0.04 A 36 PRO CA C 13 62.600 0.40 A 36 PRO CB C 13 35.120 0.40 A 36 PRO CD C 13 49.880 0.40 A 36 PRO CG C 13 25.360 0.40 A 38 PRO HA H 1 4.243 0.04 A 38 PRO HBy H 1 2.378 0.04 A 38 PRO HBx H 1 1.810 0.04 A 38 PRO HDy H 1 3.860 0.04 A 38 PRO HDx H 1 3.536 0.04 A 38 PRO HGy H 1 2.066 0.04 A 38 PRO HGx H 1 2.030 0.04 A 38 PRO C C 13 179.736 0.40 A 38 PRO CA C 13 66.740 0.40 A 38 PRO CB C 13 31.440 0.40 A 38 PRO CD C 13 50.290 0.40 A 38 PRO CG C 13 28.990 0.40 A 39 VAL H H 1 6.494 0.04 A 39 VAL HA H 1 3.641 0.04 A 39 VAL HB H 1 1.892 0.04 A 39 VAL HGx% H 1 0.892 0.04 A 39 VAL HGy% H 1 0.994 0.04 A 39 VAL C C 13 177.498 0.40 A 39 VAL CA C 13 65.150 0.40 A 39 VAL CB C 13 32.160 0.40 A 39 VAL CGx C 13 20.680 0.40 A 39 VAL CGy C 13 22.430 0.40 A 39 VAL N N 15 117.011 0.40 A 40 ARG H H 1 7.654 0.04 A 40 ARG HA H 1 3.872 0.04 A 40 ARG HBy H 1 1.891 0.04 A 40 ARG HBx H 1 1.365 0.04 A 40 ARG HDy H 1 3.202 0.04 A 40 ARG HDx H 1 3.084 0.04 A 40 ARG HGy H 1 1.792 0.04 A 40 ARG HGx H 1 1.373 0.04 A 40 ARG C C 13 178.059 0.40 A 40 ARG CA C 13 59.570 0.40 A 40 ARG CB C 13 30.520 0.40 A 40 ARG CD C 13 43.680 0.40 A 40 ARG CG C 13 27.490 0.40 A 40 ARG N N 15 122.921 0.40 A 41 VAL H H 1 8.429 0.04 A 41 VAL HA H 1 3.431 0.04 A 41 VAL HB H 1 2.006 0.04 A 41 VAL HGx% H 1 0.808 0.04 A 41 VAL HGy% H 1 0.977 0.04 A 41 VAL C C 13 177.076 0.40 A 41 VAL CA C 13 66.240 0.40 A 41 VAL CB C 13 32.260 0.40 A 41 VAL CGx C 13 21.850 0.40 A 41 VAL CGy C 13 23.490 0.40 A 41 VAL N N 15 117.659 0.40 A 42 LYS H H 1 7.442 0.04 A 42 LYS HA H 1 3.880 0.04 A 42 LYS HBy H 1 1.970 0.04 A 42 LYS HBx H 1 1.810 0.04 A 42 LYS HDx H 1 1.659 0.04 A 42 LYS HDy H 1 1.659 0.04 A 42 LYS HEy H 1 2.861 0.04 A 42 LYS HEx H 1 2.803 0.04 A 42 LYS HGy H 1 1.539 0.04 A 42 LYS HGx H 1 1.320 0.04 A 42 LYS C C 13 177.181 0.40 A 42 LYS CA C 13 60.110 0.40 A 42 LYS CB C 13 31.860 0.40 A 42 LYS CD C 13 29.620 0.40 A 42 LYS CE C 13 41.850 0.40 A 42 LYS CG C 13 25.400 0.40 A 42 LYS N N 15 117.870 0.40 A 43 ALA H H 1 8.244 0.04 A 43 ALA HA H 1 4.117 0.04 A 43 ALA HB% H 1 1.567 0.04 A 43 ALA C C 13 180.745 0.40 A 43 ALA CA C 13 55.110 0.40 A 43 ALA CB C 13 19.260 0.40 A 43 ALA N N 15 119.434 0.40 A 44 VAL H H 1 8.075 0.04 A 44 VAL HA H 1 3.450 0.04 A 44 VAL HB H 1 2.027 0.04 A 44 VAL HGx% H 1 0.821 0.04 A 44 VAL HGy% H 1 0.973 0.04 A 44 VAL C C 13 176.874 0.40 A 44 VAL CA C 13 67.180 0.40 A 44 VAL CB C 13 31.320 0.40 A 44 VAL CGx C 13 22.220 0.40 A 44 VAL CGy C 13 24.100 0.40 A 44 VAL N N 15 118.947 0.40 A 45 TYR H H 1 7.826 0.04 A 45 TYR HA H 1 3.785 0.04 A 45 TYR HBy H 1 3.214 0.04 A 45 TYR HBx H 1 2.837 0.04 A 45 TYR HDx H 1 6.741 0.04 A 45 TYR HDy H 1 6.741 0.04 A 45 TYR HEx H 1 6.499 0.04 A 45 TYR HEy H 1 6.499 0.04 A 45 TYR C C 13 175.250 0.40 A 45 TYR CA C 13 61.790 0.40 A 45 TYR CB C 13 38.770 0.40 A 45 TYR CDx C 13 132.815 0.40 A 45 TYR CEx C 13 118.030 0.40 A 45 TYR N N 15 119.902 0.40 A 46 LEU H H 1 8.688 0.04 A 46 LEU HA H 1 3.413 0.04 A 46 LEU HBy H 1 1.837 0.04 A 46 LEU HBx H 1 1.369 0.04 A 46 LEU HDx% H 1 0.893 0.04 A 46 LEU HDy% H 1 0.865 0.04 A 46 LEU HG H 1 1.959 0.04 A 46 LEU C C 13 179.938 0.40 A 46 LEU CA C 13 57.750 0.40 A 46 LEU CB C 13 41.470 0.40 A 46 LEU CDy C 13 26.050 0.40 A 46 LEU CDx C 13 22.260 0.40 A 46 LEU CG C 13 26.940 0.40 A 46 LEU N N 15 118.684 0.40 A 47 PHE H H 1 7.775 0.04 A 47 PHE HA H 1 3.939 0.04 A 47 PHE HBy H 1 2.993 0.04 A 47 PHE HBx H 1 2.956 0.04 A 47 PHE HDx H 1 6.699 0.04 A 47 PHE HDy H 1 6.699 0.04 A 47 PHE HEx H 1 7.046 0.04 A 47 PHE HEy H 1 7.046 0.04 A 47 PHE HZ H 1 6.897 0.04 A 47 PHE C C 13 176.242 0.40 A 47 PHE CA C 13 60.560 0.40 A 47 PHE CB C 13 38.440 0.40 A 47 PHE CDx C 13 131.839 0.40 A 47 PHE CEx C 13 131.521 0.40 A 47 PHE CZ C 13 128.969 0.40 A 47 PHE N N 15 120.305 0.40 A 48 LEU H H 1 7.987 0.04 A 48 LEU HA H 1 3.183 0.04 A 48 LEU HBy H 1 1.441 0.04 A 48 LEU HBx H 1 0.381 0.04 A 48 LEU HDx% H 1 -0.453 0.04 A 48 LEU HDy% H 1 0.201 0.04 A 48 LEU HG H 1 1.595 0.04 A 48 LEU C C 13 179.639 0.40 A 48 LEU CA C 13 57.160 0.40 A 48 LEU CB C 13 41.200 0.40 A 48 LEU CDy C 13 25.320 0.40 A 48 LEU CDx C 13 22.010 0.40 A 48 LEU CG C 13 25.910 0.40 A 48 LEU N N 15 119.959 0.40 A 49 VAL H H 1 7.922 0.04 A 49 VAL HA H 1 3.696 0.04 A 49 VAL HB H 1 1.663 0.04 A 49 VAL HGx% H 1 0.708 0.04 A 49 VAL HGy% H 1 0.128 0.04 A 49 VAL C C 13 181.018 0.40 A 49 VAL CA C 13 65.440 0.40 A 49 VAL CB C 13 31.500 0.40 A 49 VAL CGx C 13 21.670 0.40 A 49 VAL CGy C 13 21.970 0.40 A 49 VAL N N 15 121.927 0.40 A 50 ASP H H 1 7.788 0.04 A 50 ASP HA H 1 4.190 0.04 A 50 ASP HBy H 1 2.558 0.04 A 50 ASP HBx H 1 2.448 0.04 A 50 ASP C C 13 177.577 0.40 A 50 ASP CA C 13 57.440 0.40 A 50 ASP CB C 13 40.250 0.40 A 50 ASP N N 15 124.825 0.40 A 51 ALA H H 1 7.858 0.04 A 51 ALA HA H 1 4.053 0.04 A 51 ALA HB% H 1 0.821 0.04 A 51 ALA C C 13 176.400 0.40 A 51 ALA CA C 13 51.660 0.40 A 51 ALA CB C 13 17.930 0.40 A 51 ALA N N 15 119.113 0.40 A 52 LYS H H 1 7.770 0.04 A 52 LYS HA H 1 3.946 0.04 A 52 LYS HBy H 1 2.042 0.04 A 52 LYS HBx H 1 1.873 0.04 A 52 LYS HDy H 1 1.628 0.04 A 52 LYS HDx H 1 1.534 0.04 A 52 LYS HEx H 1 2.937 0.04 A 52 LYS HEy H 1 2.937 0.04 A 52 LYS HGy H 1 1.297 0.04 A 52 LYS HGx H 1 1.205 0.04 A 52 LYS C C 13 176.225 0.40 A 52 LYS CA C 13 56.980 0.40 A 52 LYS CB C 13 28.130 0.40 A 52 LYS CD C 13 28.580 0.40 A 52 LYS CE C 13 42.180 0.40 A 52 LYS CG C 13 24.860 0.40 A 52 LYS N N 15 113.679 0.40 A 53 GLN H H 1 8.171 0.04 A 53 GLN HA H 1 4.097 0.04 A 53 GLN HBy H 1 2.139 0.04 A 53 GLN HBx H 1 1.406 0.04 A 53 GLN HE2y H 1 7.420 0.04 A 53 GLN HE2x H 1 6.981 0.04 A 53 GLN HGy H 1 2.067 0.04 A 53 GLN HGx H 1 2.027 0.04 A 53 GLN C C 13 175.400 0.40 A 53 GLN CA C 13 56.290 0.40 A 53 GLN CB C 13 30.110 0.40 A 53 GLN CG C 13 33.700 0.40 A 53 GLN N N 15 114.999 0.40 A 53 GLN NE2 N 15 114.180 0.40 A 54 ILE H H 1 6.595 0.04 A 54 ILE HA H 1 4.236 0.04 A 54 ILE HB H 1 1.204 0.04 A 54 ILE HD1% H 1 0.449 0.04 A 54 ILE HG1y H 1 0.831 0.04 A 54 ILE HG1x H 1 0.435 0.04 A 54 ILE HG2% H 1 0.547 0.04 A 54 ILE C C 13 173.609 0.40 A 54 ILE CA C 13 58.820 0.40 A 54 ILE CB C 13 42.140 0.40 A 54 ILE CD1 C 13 14.270 0.40 A 54 ILE CG1 C 13 25.970 0.40 A 54 ILE CG2 C 13 17.820 0.40 A 54 ILE N N 15 111.878 0.40 A 55 ALA H H 1 8.311 0.04 A 55 ALA HA H 1 4.454 0.04 A 55 ALA HB% H 1 1.258 0.04 A 55 ALA CA C 13 49.690 0.40 A 55 ALA CB C 13 17.520 0.40 A 55 ALA N N 15 127.849 0.40 A 56 PRO HA H 1 4.403 0.04 A 56 PRO HBy H 1 2.097 0.04 A 56 PRO HBx H 1 1.846 0.04 A 56 PRO HDx H 1 3.643 0.04 A 56 PRO HDy H 1 3.643 0.04 A 56 PRO HGx H 1 1.956 0.04 A 56 PRO HGy H 1 1.956 0.04 A 56 PRO C C 13 178.244 0.40 A 56 PRO CA C 13 62.480 0.40 A 56 PRO CB C 13 31.720 0.40 A 56 PRO CD C 13 50.150 0.40 A 56 PRO CG C 13 27.140 0.40 A 57 LEU H H 1 8.136 0.04 A 57 LEU HA H 1 4.342 0.04 A 57 LEU HBy H 1 1.465 0.04 A 57 LEU HBx H 1 1.238 0.04 A 57 LEU HDx% H 1 0.632 0.04 A 57 LEU HDy% H 1 0.904 0.04 A 57 LEU HG H 1 1.570 0.04 A 57 LEU CA C 13 53.100 0.40 A 57 LEU CB C 13 41.890 0.40 A 57 LEU CDy C 13 26.080 0.40 A 57 LEU CDx C 13 23.980 0.40 A 57 LEU CG C 13 28.060 0.40 A 57 LEU N N 15 123.933 0.40 A 58 PRO HA H 1 4.433 0.04 A 58 PRO HBy H 1 2.304 0.04 A 58 PRO HBx H 1 1.800 0.04 A 58 PRO HDy H 1 3.782 0.04 A 58 PRO HDx H 1 3.342 0.04 A 58 PRO HGy H 1 1.988 0.04 A 58 PRO HGx H 1 1.855 0.04 A 58 PRO C C 13 177.146 0.40 A 58 PRO CA C 13 62.420 0.40 A 58 PRO CB C 13 32.150 0.40 A 58 PRO CD C 13 50.300 0.40 A 58 PRO CG C 13 27.520 0.40 A 59 ASP H H 1 8.536 0.04 A 59 ASP HA H 1 4.229 0.04 A 59 ASP HBx H 1 2.587 0.04 A 59 ASP HBy H 1 2.587 0.04 A 59 ASP CA C 13 57.250 0.40 A 59 ASP CB C 13 40.110 0.40 A 59 ASP N N 15 121.433 0.40 A 60 SER HA H 1 4.202 0.04 A 60 SER HBy H 1 3.962 0.04 A 60 SER HBx H 1 3.821 0.04 A 60 SER C C 13 175.189 0.40 A 60 SER CA C 13 59.140 0.40 A 60 SER CB C 13 62.680 0.40 A 61 LYS H H 1 7.872 0.04 A 61 LYS HA H 1 4.512 0.04 A 61 LYS HBy H 1 2.054 0.04 A 61 LYS HBx H 1 1.410 0.04 A 61 LYS HDy H 1 1.566 0.04 A 61 LYS HDx H 1 1.476 0.04 A 61 LYS HEy H 1 2.894 0.04 A 61 LYS HEx H 1 2.852 0.04 A 61 LYS HGy H 1 1.326 0.04 A 61 LYS HGx H 1 1.206 0.04 A 61 LYS C C 13 174.153 0.40 A 61 LYS CA C 13 54.570 0.40 A 61 LYS CB C 13 33.640 0.40 A 61 LYS CD C 13 28.980 0.40 A 61 LYS CE C 13 42.280 0.40 A 61 LYS CG C 13 24.710 0.40 A 61 LYS N N 15 121.599 0.40 A 62 LEU H H 1 7.075 0.04 A 62 LEU HA H 1 4.195 0.04 A 62 LEU HBy H 1 1.637 0.04 A 62 LEU HBx H 1 1.468 0.04 A 62 LEU HDx% H 1 0.833 0.04 A 62 LEU HDy% H 1 0.739 0.04 A 62 LEU HG H 1 1.540 0.04 A 62 LEU C C 13 175.233 0.40 A 62 LEU CA C 13 54.070 0.40 A 62 LEU CB C 13 40.470 0.40 A 62 LEU CDy C 13 25.410 0.40 A 62 LEU CDx C 13 24.520 0.40 A 62 LEU CG C 13 26.260 0.40 A 62 LEU N N 15 119.895 0.40 A 63 ASP H H 1 7.908 0.04 A 63 ASP HA H 1 4.581 0.04 A 63 ASP HBy H 1 2.806 0.04 A 63 ASP HBx H 1 2.609 0.04 A 63 ASP CA C 13 52.240 0.40 A 63 ASP CB C 13 42.730 0.40 A 63 ASP N N 15 121.708 0.40 A 64 GLY HAy H 1 3.938 0.04 A 64 GLY HAx H 1 3.532 0.04 A 64 GLY C C 13 175.347 0.40 A 64 GLY CA C 13 48.060 0.40 A 65 ALA H H 1 8.153 0.04 A 65 ALA HA H 1 4.053 0.04 A 65 ALA HB% H 1 1.359 0.04 A 65 ALA C C 13 180.939 0.40 A 65 ALA CA C 13 55.500 0.40 A 65 ALA CB C 13 18.220 0.40 A 65 ALA N N 15 122.874 0.40 A 66 ASN H H 1 8.283 0.04 A 66 ASN HA H 1 4.462 0.04 A 66 ASN HBy H 1 3.125 0.04 A 66 ASN HBx H 1 2.581 0.04 A 66 ASN HD2y H 1 9.091 0.04 A 66 ASN HD2x H 1 7.018 0.04 A 66 ASN C C 13 178.595 0.40 A 66 ASN CA C 13 56.670 0.40 A 66 ASN CB C 13 39.540 0.40 A 66 ASN N N 15 118.152 0.40 A 66 ASN ND2 N 15 118.108 0.40 A 67 ILE H H 1 8.275 0.04 A 67 ILE HA H 1 3.124 0.04 A 67 ILE HB H 1 1.510 0.04 A 67 ILE HD1% H 1 0.345 0.04 A 67 ILE HG1y H 1 1.399 0.04 A 67 ILE HG1x H 1 -0.266 0.04 A 67 ILE HG2% H 1 0.481 0.04 A 67 ILE C C 13 177.612 0.40 A 67 ILE CA C 13 66.410 0.40 A 67 ILE CB C 13 37.970 0.40 A 67 ILE CD1 C 13 13.600 0.40 A 67 ILE CG1 C 13 29.040 0.40 A 67 ILE CG2 C 13 18.880 0.40 A 67 ILE N N 15 121.247 0.40 A 68 LYS H H 1 8.213 0.04 A 68 LYS HA H 1 3.656 0.04 A 68 LYS HBy H 1 1.922 0.04 A 68 LYS HBx H 1 1.818 0.04 A 68 LYS HDx H 1 1.725 0.04 A 68 LYS HDy H 1 1.725 0.04 A 68 LYS HEx H 1 2.823 0.04 A 68 LYS HEy H 1 2.823 0.04 A 68 LYS HGy H 1 1.811 0.04 A 68 LYS HGx H 1 1.230 0.04 A 68 LYS C C 13 177.620 0.40 A 68 LYS CA C 13 61.490 0.40 A 68 LYS CB C 13 32.330 0.40 A 68 LYS CD C 13 29.660 0.40 A 68 LYS CE C 13 41.940 0.40 A 68 LYS CG C 13 27.620 0.40 A 68 LYS N N 15 118.049 0.40 A 69 HIS H H 1 7.647 0.04 A 69 HIS HA H 1 4.323 0.04 A 69 HIS HBy H 1 3.270 0.04 A 69 HIS HBx H 1 3.221 0.04 A 69 HIS HD2 H 1 7.008 0.04 A 69 HIS C C 13 176.751 0.40 A 69 HIS CA C 13 59.570 0.40 A 69 HIS CB C 13 29.700 0.40 A 69 HIS CD2 C 13 121.998 0.40 A 69 HIS N N 15 116.537 0.40 A 70 ARG H H 1 7.866 0.04 A 70 ARG HA H 1 4.064 0.04 A 70 ARG HBy H 1 2.107 0.04 A 70 ARG HBx H 1 2.038 0.04 A 70 ARG HDy H 1 3.392 0.04 A 70 ARG HDx H 1 3.211 0.04 A 70 ARG HGy H 1 1.911 0.04 A 70 ARG HGx H 1 1.678 0.04 A 70 ARG C C 13 179.701 0.40 A 70 ARG CA C 13 58.210 0.40 A 70 ARG CB C 13 29.360 0.40 A 70 ARG CD C 13 42.480 0.40 A 70 ARG CG C 13 27.580 0.40 A 70 ARG N N 15 116.723 0.40 A 71 LEU H H 1 8.388 0.04 A 71 LEU HA H 1 4.199 0.04 A 71 LEU HBy H 1 2.188 0.04 A 71 LEU HBx H 1 1.351 0.04 A 71 LEU HDx% H 1 0.889 0.04 A 71 LEU HDy% H 1 0.707 0.04 A 71 LEU HG H 1 1.959 0.04 A 71 LEU C C 13 178.226 0.40 A 71 LEU CA C 13 58.170 0.40 A 71 LEU CB C 13 41.910 0.40 A 71 LEU CDy C 13 27.000 0.40 A 71 LEU CDx C 13 23.440 0.40 A 71 LEU CG C 13 27.000 0.40 A 71 LEU N N 15 119.613 0.40 A 72 ALA H H 1 8.411 0.04 A 72 ALA HA H 1 3.918 0.04 A 72 ALA HB% H 1 1.488 0.04 A 72 ALA C C 13 179.113 0.40 A 72 ALA CA C 13 55.500 0.40 A 72 ALA CB C 13 18.900 0.40 A 72 ALA N N 15 121.292 0.40 A 73 LEU H H 1 8.106 0.04 A 73 LEU HA H 1 3.918 0.04 A 73 LEU HBy H 1 1.748 0.04 A 73 LEU HBx H 1 1.494 0.04 A 73 LEU HDx% H 1 0.717 0.04 A 73 LEU HDy% H 1 0.755 0.04 A 73 LEU HG H 1 1.396 0.04 A 73 LEU C C 13 179.710 0.40 A 73 LEU CA C 13 57.870 0.40 A 73 LEU CB C 13 42.720 0.40 A 73 LEU CDy C 13 25.790 0.40 A 73 LEU CDx C 13 23.450 0.40 A 73 LEU CG C 13 26.550 0.40 A 73 LEU N N 15 117.024 0.40 A 74 TRP H H 1 7.947 0.04 A 74 TRP HA H 1 4.360 0.04 A 74 TRP HBy H 1 3.744 0.04 A 74 TRP HBx H 1 3.219 0.04 A 74 TRP HD1 H 1 7.202 0.04 A 74 TRP HE1 H 1 10.218 0.04 A 74 TRP HH2 H 1 6.865 0.04 A 74 TRP HZ2 H 1 7.160 0.04 A 74 TRP HZ3 H 1 7.151 0.04 A 74 TRP C C 13 177.989 0.40 A 74 TRP CA C 13 60.570 0.40 A 74 TRP CB C 13 27.690 0.40 A 74 TRP CD1 C 13 127.437 0.40 A 74 TRP CH2 C 13 123.707 0.40 A 74 TRP CZ2 C 13 114.227 0.40 A 74 TRP CZ3 C 13 121.602 0.40 A 74 TRP N N 15 121.106 0.40 A 74 TRP NE1 N 15 130.157 0.40 A 75 ILE H H 1 7.945 0.04 A 75 ILE HA H 1 3.415 0.04 A 75 ILE HB H 1 1.737 0.04 A 75 ILE HD1% H 1 0.303 0.04 A 75 ILE HG1y H 1 1.157 0.04 A 75 ILE HG1x H 1 1.123 0.04 A 75 ILE HG2% H 1 1.154 0.04 A 75 ILE C C 13 176.839 0.40 A 75 ILE CA C 13 59.300 0.40 A 75 ILE CB C 13 37.250 0.40 A 75 ILE CD1 C 13 12.230 0.40 A 75 ILE CG1 C 13 29.080 0.40 A 75 ILE CG2 C 13 20.240 0.40 A 75 ILE N N 15 117.678 0.40 A 76 HIS H H 1 8.422 0.04 A 76 HIS HA H 1 3.737 0.04 A 76 HIS HBy H 1 3.285 0.04 A 76 HIS HBx H 1 3.029 0.04 A 76 HIS HD2 H 1 7.080 0.04 A 76 HIS HE1 H 1 7.802 0.04 A 76 HIS C C 13 178.042 0.40 A 76 HIS CA C 13 61.490 0.40 A 76 HIS CB C 13 31.860 0.40 A 76 HIS CD2 C 13 118.030 0.40 A 76 HIS CE1 C 13 137.900 0.40 A 76 HIS N N 15 122.324 0.40 A 77 ALA H H 1 7.552 0.04 A 77 ALA HA H 1 3.961 0.04 A 77 ALA HB% H 1 1.466 0.04 A 77 ALA C C 13 177.893 0.40 A 77 ALA CA C 13 53.810 0.40 A 77 ALA CB C 13 18.620 0.40 A 77 ALA N N 15 118.024 0.40 A 78 ALA H H 1 7.040 0.04 A 78 ALA HA H 1 4.107 0.04 A 78 ALA HB% H 1 1.018 0.04 A 78 ALA C C 13 178.165 0.40 A 78 ALA CA C 13 51.990 0.40 A 78 ALA CB C 13 19.180 0.40 A 78 ALA N N 15 118.242 0.40 A 79 LEU H H 1 7.160 0.04 A 79 LEU HA H 1 4.254 0.04 A 79 LEU HBy H 1 1.444 0.04 A 79 LEU HBx H 1 1.148 0.04 A 79 LEU HDx% H 1 0.618 0.04 A 79 LEU HDy% H 1 0.649 0.04 A 79 LEU HG H 1 1.953 0.04 A 79 LEU CA C 13 53.130 0.40 A 79 LEU CB C 13 41.410 0.40 A 79 LEU CDy C 13 25.820 0.40 A 79 LEU CDx C 13 21.950 0.40 A 79 LEU CG C 13 25.100 0.40 A 79 LEU N N 15 119.780 0.40 A 80 PRO HA H 1 4.413 0.04 A 80 PRO HBx H 1 1.932 0.04 A 80 PRO HBy H 1 1.932 0.04 A 80 PRO HDy H 1 3.752 0.04 A 80 PRO HDx H 1 3.558 0.04 A 80 PRO HGx H 1 2.003 0.04 A 80 PRO HGy H 1 2.003 0.04 A 80 PRO C C 13 176.769 0.40 A 80 PRO CA C 13 62.450 0.40 A 80 PRO CB C 13 32.310 0.40 A 80 PRO CD C 13 50.300 0.40 A 80 PRO CG C 13 27.300 0.40 A 81 ASP H H 1 8.403 0.04 A 81 ASP HA H 1 4.162 0.04 A 81 ASP HBy H 1 2.555 0.04 A 81 ASP HBx H 1 2.462 0.04 A 81 ASP CA C 13 56.610 0.40 A 81 ASP CB C 13 40.460 0.40 A 81 ASP N N 15 119.094 0.40 A 83 ASP HA H 1 4.584 0.04 A 83 ASP HBy H 1 2.731 0.04 A 83 ASP HBx H 1 2.653 0.04 A 83 ASP CA C 13 53.400 0.40 A 83 ASP CB C 13 38.730 0.40 A 84 PRO HA H 1 4.365 0.04 A 84 PRO HBy H 1 2.339 0.04 A 84 PRO HBx H 1 1.843 0.04 A 84 PRO HDy H 1 3.781 0.04 A 84 PRO HDx H 1 3.652 0.04 A 84 PRO HGx H 1 1.956 0.04 A 84 PRO HGy H 1 1.956 0.04 A 84 PRO C C 13 177.462 0.40 A 84 PRO CA C 13 64.600 0.40 A 84 PRO CB C 13 32.600 0.40 A 84 PRO CD C 13 51.070 0.40 A 84 PRO CG C 13 27.330 0.40 A 85 LEU H H 1 9.312 0.04 A 85 LEU HA H 1 4.320 0.04 A 85 LEU HBy H 1 1.695 0.04 A 85 LEU HBx H 1 1.520 0.04 A 85 LEU HDx% H 1 0.783 0.04 A 85 LEU HDy% H 1 0.756 0.04 A 85 LEU HG H 1 1.620 0.04 A 85 LEU C C 13 176.655 0.40 A 85 LEU CA C 13 54.450 0.40 A 85 LEU CB C 13 41.730 0.40 A 85 LEU CDy C 13 25.580 0.40 A 85 LEU CDx C 13 22.860 0.40 A 85 LEU CG C 13 26.990 0.40 A 85 LEU N N 15 118.299 0.40 A 86 LYS H H 1 7.664 0.04 A 86 LYS HA H 1 3.858 0.04 A 86 LYS HBy H 1 1.938 0.04 A 86 LYS HBx H 1 1.495 0.04 A 86 LYS HDy H 1 1.292 0.04 A 86 LYS HDx H 1 1.130 0.04 A 86 LYS HEy H 1 2.745 0.04 A 86 LYS HEx H 1 2.610 0.04 A 86 LYS HGx H 1 1.316 0.04 A 86 LYS HGy H 1 1.316 0.04 A 86 LYS CA C 13 57.920 0.40 A 86 LYS CB C 13 33.640 0.40 A 86 LYS CD C 13 29.370 0.40 A 86 LYS CE C 13 42.670 0.40 A 86 LYS CG C 13 25.400 0.40 A 86 LYS N N 15 125.728 0.40 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 3 LYS HA A 3 LYS HEx 1.0 1.8 5.0 2 1 A 3 LYS HA A 3 LYS HEy 1.0 1.8 5.0 3 2 A 3 LYS HA A 3 LYS HGx 1.0 1.8 5.0 4 3 A 3 LYS HA A 3 LYS HGy 1.0 1.8 5.0 5 4 A 3 LYS HDy A 3 LYS HBx 1.0 1.8 3.5 6 4 A 3 LYS HBx A 3 LYS HDx 1.0 1.8 3.5 7 5 A 3 LYS HA A 3 LYS HDx 1.0 1.8 5.0 8 5 A 3 LYS HA A 3 LYS HDy 1.0 1.8 5.0 9 6 A 3 LYS HDy A 3 LYS HBy 1.0 1.8 3.5 10 6 A 3 LYS HBy A 3 LYS HDx 1.0 1.8 3.5 11 7 A 3 LYS HEy A 3 LYS HBx 1.0 1.8 5.0 12 7 A 3 LYS HBx A 3 LYS HEx 1.0 1.8 5.0 13 8 A 3 LYS HEy A 3 LYS HBy 1.0 1.8 5.0 14 8 A 3 LYS HBy A 3 LYS HEx 1.0 1.8 5.0 15 9 A 3 LYS HDy A 3 LYS HEx 1.0 1.8 3.5 16 9 A 3 LYS HDx A 3 LYS HEx 1.0 1.8 3.5 17 9 A 3 LYS HEy A 3 LYS HDx 1.0 1.8 3.5 18 9 A 3 LYS HEy A 3 LYS HDy 1.0 1.8 3.5 19 10 A 3 LYS HA A 3 LYS HGy 1.0 1.8 3.5 20 10 A 3 LYS HA A 3 LYS HGx 1.0 1.8 3.5 21 11 A 3 LYS HBy A 3 LYS HEx 1.0 1.8 5.0 22 11 A 3 LYS HEy A 3 LYS HBx 1.0 1.8 5.0 23 11 A 3 LYS HEy A 3 LYS HBy 1.0 1.8 5.0 24 11 A 3 LYS HBx A 3 LYS HEx 1.0 1.8 5.0 25 12 A 3 LYS HEy A 3 LYS HGy 1.0 1.8 3.5 26 12 A 3 LYS HEx A 3 LYS HGy 1.0 1.8 3.5 27 12 A 3 LYS HGx A 3 LYS HEx 1.0 1.8 3.5 28 12 A 3 LYS HEy A 3 LYS HGx 1.0 1.8 3.5 29 13 A 73 LEU HDx% A 3 LYS HDx 1.0 1.8 6.0 30 13 A 3 LYS HDy A 73 LEU HDx% 1.0 1.8 6.0 31 14 A 73 LEU HDy% A 3 LYS HDx 1.0 1.8 5.0 32 14 A 3 LYS HDy A 73 LEU HDy% 1.0 1.8 5.0 33 15 A 4 THR HA A 4 THR HG2% 1.0 1.8 3.5 34 16 A 6 LYS HEx A 6 LYS HGx 1.0 1.8 3.5 35 16 A 6 LYS HEy A 6 LYS HGx 1.0 1.8 3.5 36 16 A 6 LYS HGy A 6 LYS HEx 1.0 1.8 3.5 37 16 A 6 LYS HGy A 6 LYS HEy 1.0 1.8 3.5 38 17 A 6 LYS HA A 6 LYS HDx 1.0 1.8 5.0 39 17 A 6 LYS HA A 6 LYS HDy 1.0 1.8 5.0 40 18 A 6 LYS HA A 6 LYS HGx 1.0 1.8 5.0 41 18 A 6 LYS HGy A 6 LYS HA 1.0 1.8 5.0 42 19 A 6 LYS H A 6 LYS HEx 1.0 1.8 5.0 43 19 A 6 LYS HEy A 6 LYS H 1.0 1.8 5.0 44 20 A 6 LYS HDy A 6 LYS HEx 1.0 1.8 3.5 45 20 A 6 LYS HDx A 6 LYS HEx 1.0 1.8 3.5 46 20 A 6 LYS HEy A 6 LYS HDx 1.0 1.8 3.5 47 20 A 6 LYS HEy A 6 LYS HDy 1.0 1.8 3.5 48 21 A 6 LYS H A 6 LYS HDx 1.0 1.8 6.0 49 21 A 6 LYS HDy A 6 LYS H 1.0 1.8 6.0 50 22 A 6 LYS HBx A 6 LYS HDx 1.0 1.8 2.7 51 22 A 6 LYS HBy A 6 LYS HDx 1.0 1.8 2.7 52 22 A 6 LYS HDy A 6 LYS HBy 1.0 1.8 2.7 53 22 A 6 LYS HDy A 6 LYS HBx 1.0 1.8 2.7 54 23 A 6 LYS HBy A 6 LYS HEx 1.0 1.8 5.0 55 23 A 6 LYS HEy A 6 LYS HBy 1.0 1.8 5.0 56 23 A 6 LYS HEy A 6 LYS HBx 1.0 1.8 5.0 57 23 A 6 LYS HBx A 6 LYS HEx 1.0 1.8 5.0 58 24 A 7 LEU HA A 7 LEU HG 1.0 1.8 5.0 59 25 A 7 LEU HA A 7 LEU HDy% 1.0 1.8 5.0 60 26 A 7 LEU HDx% A 7 LEU HBy 1.0 1.8 3.5 61 27 A 7 LEU HA A 7 LEU HDx% 1.0 1.8 5.0 62 28 A 7 LEU HDx% A 7 LEU HBx 1.0 1.8 3.5 63 29 A 7 LEU HDy% A 7 LEU HBx 1.0 1.8 3.5 64 30 A 7 LEU HDy% A 7 LEU HBy 1.0 1.8 3.5 65 31 A 7 LEU H A 7 LEU HBy 1.0 1.8 5.0 66 31 A 7 LEU H A 7 LEU HBx 1.0 1.8 5.0 67 32 A 7 LEU HDx% A 7 LEU HBy 1.0 1.8 3.5 68 32 A 7 LEU HDx% A 7 LEU HBx 1.0 1.8 3.5 69 33 A 7 LEU HDy% A 7 LEU HBy 1.0 1.8 3.5 70 33 A 7 LEU HDy% A 7 LEU HBx 1.0 1.8 3.5 71 34 A 7 LEU HDx% A 10 GLU HGx 1.0 1.8 5.0 72 34 A 7 LEU HDx% A 10 GLU HGy 1.0 1.8 5.0 73 35 A 7 LEU HDx% A 10 GLU HA 1.0 1.8 5.0 74 36 A 7 LEU HDy% A 10 GLU HBy 1.0 1.8 5.0 75 37 A 7 LEU HDy% A 10 GLU HBx 1.0 1.8 6.0 76 38 A 7 LEU HDy% A 10 GLU H 1.0 1.8 6.0 77 39 A 7 LEU HG A 13 LEU HDx% 1.0 1.8 3.5 78 40 A 7 LEU HDx% A 13 LEU HDx% 1.0 1.8 3.5 79 41 A 7 LEU HDx% A 13 LEU HA 1.0 1.8 6.0 80 42 A 7 LEU HDy% A 13 LEU HDx% 1.0 1.8 5.0 81 43 A 7 LEU HDx% A 13 LEU HDy% 1.0 1.8 3.5 82 44 A 13 LEU HDx% A 7 LEU HBy 1.0 1.8 5.0 83 44 A 7 LEU HBx A 13 LEU HDx% 1.0 1.8 5.0 84 45 A 7 LEU HDy% A 72 ALA HB% 1.0 1.8 5.0 85 46 A 7 LEU HDx% A 72 ALA HB% 1.0 1.8 3.5 86 47 A 7 LEU HDx% A 73 LEU HA 1.0 1.8 5.0 87 48 A 7 LEU HDy% A 73 LEU HA 1.0 1.8 6.0 88 49 A 73 LEU HDy% A 7 LEU HDy% 1.0 1.8 5.0 89 50 A 73 LEU HDy% A 7 LEU HDx% 1.0 1.8 5.0 90 51 A 73 LEU HDx% A 7 LEU HDx% 1.0 1.8 5.0 91 52 A 7 LEU HDy% A 73 LEU HG 1.0 1.8 5.0 92 53 A 7 LEU HDx% A 73 LEU HG 1.0 1.8 5.0 93 54 A 7 LEU HDx% A 73 LEU H 1.0 1.8 5.0 94 55 A 7 LEU HDx% A 76 HIS HBx 1.0 1.8 5.0 95 56 A 7 LEU HDx% A 76 HIS HBy 1.0 1.8 5.0 96 57 A 7 LEU HDy% A 76 HIS HE1 1.0 1.8 6.0 97 58 A 7 LEU HDx% A 76 HIS HD2 1.0 1.8 5.0 98 59 A 7 LEU HDx% A 76 HIS HE1 1.0 1.8 5.0 99 60 A 76 HIS HE1 A 7 LEU HBy 1.0 1.8 5.0 100 61 A 7 LEU HBx A 76 HIS HE1 1.0 1.8 5.0 101 62 A 7 LEU HDx% A 76 HIS H 1.0 1.8 5.0 102 63 A 76 HIS HE1 A 7 LEU HBy 1.0 1.8 5.0 103 63 A 7 LEU HBx A 76 HIS HE1 1.0 1.8 5.0 104 64 A 9 ASN HA A 9 ASN HD2y 1.0 1.8 5.0 105 65 A 9 ASN HA A 9 ASN HD2x 1.0 1.8 5.0 106 66 A 9 ASN HA A 9 ASN HD2y 1.0 1.8 5.0 107 66 A 9 ASN HA A 9 ASN HD2x 1.0 1.8 5.0 108 67 A 10 GLU H A 9 ASN HA 1.0 1.8 5.0 109 68 A 9 ASN HA A 11 GLU HBy 1.0 1.8 5.0 110 69 A 9 ASN HA A 11 GLU H 1.0 1.8 5.0 111 70 A 9 ASN HBy A 12 LYS HBx 1.0 1.8 5.0 112 70 A 9 ASN HBx A 12 LYS HBx 1.0 1.8 5.0 113 70 A 12 LYS HBy A 9 ASN HBx 1.0 1.8 5.0 114 70 A 9 ASN HBy A 12 LYS HBy 1.0 1.8 5.0 115 71 A 9 ASN HBx A 12 LYS HGy 1.0 1.8 5.0 116 71 A 9 ASN HBy A 12 LYS HGy 1.0 1.8 5.0 117 72 A 12 LYS HGx A 9 ASN HBx 1.0 1.8 5.0 118 72 A 9 ASN HBy A 12 LYS HGx 1.0 1.8 5.0 119 73 A 12 LYS H A 9 ASN HBx 1.0 1.8 5.0 120 73 A 9 ASN HBy A 12 LYS H 1.0 1.8 5.0 121 74 A 9 ASN HBx A 12 LYS HGy 1.0 1.8 5.0 122 74 A 9 ASN HBy A 12 LYS HGy 1.0 1.8 5.0 123 74 A 12 LYS HGx A 9 ASN HBx 1.0 1.8 5.0 124 74 A 9 ASN HBy A 12 LYS HGx 1.0 1.8 5.0 125 75 A 13 LEU HDx% A 9 ASN HBx 1.0 1.8 5.0 126 75 A 13 LEU HDx% A 9 ASN HBy 1.0 1.8 5.0 127 76 A 13 LEU H A 9 ASN HBx 1.0 1.8 5.0 128 76 A 9 ASN HBy A 13 LEU H 1.0 1.8 5.0 129 77 A 13 LEU HDx% A 9 ASN HD2y 1.0 1.8 6.0 130 77 A 13 LEU HDx% A 9 ASN HD2x 1.0 1.8 6.0 131 78 A 10 GLU HA A 10 GLU HGx 1.0 1.8 5.0 132 78 A 10 GLU HGy A 10 GLU HA 1.0 1.8 5.0 133 79 A 10 GLU HBy A 11 GLU H 1.0 1.8 6.0 134 80 A 10 GLU HBx A 11 GLU H 1.0 1.8 5.0 135 81 A 11 GLU H A 10 GLU HGx 1.0 1.8 5.0 136 81 A 10 GLU HGy A 11 GLU H 1.0 1.8 5.0 137 82 A 10 GLU HA A 13 LEU HBx 1.0 1.8 5.0 138 83 A 10 GLU HA A 13 LEU HDy% 1.0 1.8 5.0 139 84 A 10 GLU HA A 13 LEU HBy 1.0 1.8 5.0 140 85 A 10 GLU HA A 13 LEU HDx% 1.0 1.8 3.5 141 86 A 10 GLU HBx A 13 LEU HBy 1.0 1.8 6.0 142 87 A 10 GLU HBy A 13 LEU HBy 1.0 1.8 6.0 143 88 A 13 LEU HDy% A 10 GLU HGx 1.0 1.8 5.0 144 88 A 10 GLU HGy A 13 LEU HDy% 1.0 1.8 5.0 145 89 A 10 GLU HBy A 13 LEU HDx% 1.0 1.8 5.0 146 90 A 13 LEU HDx% A 10 GLU HGx 1.0 1.8 5.0 147 90 A 10 GLU HGy A 13 LEU HDx% 1.0 1.8 5.0 148 91 A 10 GLU HA A 13 LEU H 1.0 1.8 5.0 149 92 A 13 LEU H A 10 GLU HGx 1.0 1.8 5.0 150 92 A 10 GLU HGy A 13 LEU H 1.0 1.8 5.0 151 93 A 14 VAL HGy% A 10 GLU HGx 1.0 1.8 5.0 152 93 A 10 GLU HGy A 14 VAL HGy% 1.0 1.8 5.0 153 94 A 10 GLU HBx A 14 VAL HGy% 1.0 1.8 5.0 154 95 A 10 GLU HBx A 14 VAL HB 1.0 1.8 6.0 155 96 A 14 VAL HB A 10 GLU HGx 1.0 1.8 5.0 156 96 A 10 GLU HGy A 14 VAL HB 1.0 1.8 5.0 157 97 A 10 GLU HA A 14 VAL HB 1.0 1.8 6.0 158 98 A 14 VAL HGx% A 10 GLU HGx 1.0 1.8 5.0 159 98 A 10 GLU HGy A 14 VAL HGx% 1.0 1.8 5.0 160 99 A 10 GLU HBy A 14 VAL HGy% 1.0 1.8 5.0 161 100 A 14 VAL H A 10 GLU HGx 1.0 1.8 5.0 162 100 A 10 GLU HGy A 14 VAL H 1.0 1.8 5.0 163 101 A 68 LYS HGx A 10 GLU HGx 1.0 1.8 6.0 164 101 A 10 GLU HGy A 68 LYS HGx 1.0 1.8 6.0 165 102 A 68 LYS H A 10 GLU HGx 1.0 1.8 6.0 166 102 A 10 GLU HGy A 68 LYS H 1.0 1.8 6.0 167 103 A 72 ALA HB% A 10 GLU HGx 1.0 1.8 3.5 168 103 A 10 GLU HGy A 72 ALA HB% 1.0 1.8 3.5 169 104 A 10 GLU HBx A 72 ALA HB% 1.0 1.8 5.0 170 105 A 10 GLU HA A 72 ALA HB% 1.0 1.8 5.0 171 106 A 72 ALA H A 10 GLU HGx 1.0 1.8 5.0 172 106 A 10 GLU HGy A 72 ALA H 1.0 1.8 5.0 173 107 A 73 LEU HDx% A 10 GLU HGx 1.0 1.8 6.0 174 107 A 73 LEU HDx% A 10 GLU HGy 1.0 1.8 6.0 175 108 A 11 GLU HA A 11 GLU HGx 1.0 1.8 5.0 176 109 A 11 GLU HA A 11 GLU HGy 1.0 1.8 5.0 177 110 A 11 GLU H A 11 GLU HGx 1.0 1.8 6.0 178 111 A 11 GLU H A 11 GLU HGy 1.0 1.8 6.0 179 112 A 11 GLU H A 11 GLU HGx 1.0 1.8 5.0 180 112 A 11 GLU H A 11 GLU HGy 1.0 1.8 5.0 181 113 A 11 GLU HBx A 12 LYS HDx 1.0 1.8 6.0 182 113 A 11 GLU HBx A 12 LYS HDy 1.0 1.8 6.0 183 114 A 12 LYS H A 11 GLU HBx 1.0 1.8 5.0 184 115 A 11 GLU HBy A 12 LYS H 1.0 1.8 5.0 185 116 A 12 LYS H A 11 GLU HGx 1.0 1.8 5.0 186 117 A 12 LYS H A 11 GLU HGy 1.0 1.8 5.0 187 118 A 11 GLU H A 12 LYS H 1.0 1.8 5.0 188 119 A 12 LYS H A 11 GLU HGx 1.0 1.8 5.0 189 119 A 12 LYS H A 11 GLU HGy 1.0 1.8 5.0 190 120 A 11 GLU HBy A 13 LEU H 1.0 1.8 6.0 191 121 A 14 VAL HGy% A 11 GLU HA 1.0 1.8 5.0 192 122 A 14 VAL HB A 11 GLU HA 1.0 1.8 5.0 193 123 A 14 VAL HGx% A 11 GLU HA 1.0 1.8 5.0 194 124 A 14 VAL HB A 11 GLU HBx 1.0 1.8 6.0 195 125 A 14 VAL H A 11 GLU HBx 1.0 1.8 6.0 196 126 A 14 VAL H A 11 GLU HA 1.0 1.8 5.0 197 127 A 14 VAL HGx% A 11 GLU HGx 1.0 1.8 6.0 198 127 A 14 VAL HGx% A 11 GLU HGy 1.0 1.8 6.0 199 128 A 14 VAL HGy% A 11 GLU HGx 1.0 1.8 6.0 200 128 A 14 VAL HGy% A 11 GLU HGy 1.0 1.8 6.0 201 129 A 11 GLU HA A 15 LYS HGy 1.0 1.8 6.0 202 130 A 11 GLU HA A 15 LYS H 1.0 1.8 5.0 203 131 A 11 GLU HBx A 15 LYS H 1.0 1.8 6.0 204 132 A 12 LYS HA A 12 LYS HDx 1.0 1.8 5.0 205 132 A 12 LYS HDy A 12 LYS HA 1.0 1.8 5.0 206 133 A 12 LYS HA A 12 LYS HGy 1.0 1.8 5.0 207 134 A 12 LYS HBx A 12 LYS HDx 1.0 1.8 3.5 208 134 A 12 LYS HBy A 12 LYS HDx 1.0 1.8 3.5 209 134 A 12 LYS HDy A 12 LYS HBx 1.0 1.8 3.5 210 134 A 12 LYS HBy A 12 LYS HDy 1.0 1.8 3.5 211 135 A 12 LYS HBy A 12 LYS HEx 1.0 1.8 5.0 212 135 A 12 LYS HBx A 12 LYS HEx 1.0 1.8 5.0 213 135 A 12 LYS HEy A 12 LYS HBx 1.0 1.8 5.0 214 135 A 12 LYS HBy A 12 LYS HEy 1.0 1.8 5.0 215 136 A 12 LYS HGx A 12 LYS HEy 1.0 1.8 5.0 216 136 A 12 LYS HGx A 12 LYS HEx 1.0 1.8 5.0 217 137 A 12 LYS HGx A 12 LYS HA 1.0 1.8 5.0 218 138 A 12 LYS HEx A 12 LYS HGy 1.0 1.8 5.0 219 138 A 12 LYS HEy A 12 LYS HGy 1.0 1.8 5.0 220 139 A 12 LYS HGx A 12 LYS HDx 1.0 1.8 3.5 221 139 A 12 LYS HGx A 12 LYS HDy 1.0 1.8 3.5 222 140 A 12 LYS HDy A 12 LYS HGy 1.0 1.8 3.5 223 140 A 12 LYS HDx A 12 LYS HGy 1.0 1.8 3.5 224 141 A 12 LYS HA A 12 LYS HEx 1.0 1.8 5.0 225 141 A 12 LYS HA A 12 LYS HEy 1.0 1.8 5.0 226 142 A 12 LYS H A 12 LYS HBx 1.0 1.8 3.5 227 142 A 12 LYS HBy A 12 LYS H 1.0 1.8 3.5 228 143 A 12 LYS H A 12 LYS HDx 1.0 1.8 5.0 229 143 A 12 LYS H A 12 LYS HDy 1.0 1.8 5.0 230 144 A 12 LYS H A 12 LYS HEx 1.0 1.8 5.0 231 144 A 12 LYS H A 12 LYS HEy 1.0 1.8 5.0 232 145 A 12 LYS H A 12 LYS HGx 1.0 1.8 5.0 233 146 A 12 LYS H A 12 LYS HGy 1.0 1.8 5.0 234 147 A 12 LYS H A 12 LYS HGy 1.0 1.8 3.5 235 147 A 12 LYS H A 12 LYS HGx 1.0 1.8 3.5 236 148 A 12 LYS HEx A 12 LYS HGy 1.0 1.8 3.5 237 148 A 12 LYS HEy A 12 LYS HGy 1.0 1.8 3.5 238 148 A 12 LYS HGx A 12 LYS HEx 1.0 1.8 3.5 239 148 A 12 LYS HGx A 12 LYS HEy 1.0 1.8 3.5 240 149 A 13 LEU HDx% A 12 LYS HA 1.0 1.8 6.0 241 150 A 13 LEU H A 12 LYS HEx 1.0 1.8 6.0 242 150 A 13 LEU H A 12 LYS HEy 1.0 1.8 6.0 243 151 A 13 LEU HDx% A 12 LYS H 1.0 1.8 5.0 244 152 A 12 LYS H A 13 LEU HBy 1.0 1.8 6.0 245 153 A 13 LEU H A 12 LYS HBx 1.0 1.8 3.5 246 153 A 12 LYS HBy A 13 LEU H 1.0 1.8 3.5 247 154 A 12 LYS H A 13 LEU H 1.0 1.8 3.5 248 155 A 13 LEU H A 12 LYS HGy 1.0 1.8 5.0 249 155 A 12 LYS HGx A 13 LEU H 1.0 1.8 5.0 250 156 A 12 LYS H A 14 VAL H 1.0 1.8 5.0 251 157 A 14 VAL H A 12 LYS HBx 1.0 1.8 5.0 252 157 A 12 LYS HBy A 14 VAL H 1.0 1.8 5.0 253 158 A 15 LYS HGy A 12 LYS HA 1.0 1.8 6.0 254 159 A 12 LYS HA A 15 LYS HBx 1.0 1.8 5.0 255 159 A 12 LYS HA A 15 LYS HBy 1.0 1.8 5.0 256 160 A 15 LYS H A 12 LYS HA 1.0 1.8 5.0 257 161 A 12 LYS HA A 15 LYS HGx 1.0 1.8 5.0 258 162 A 12 LYS HA A 16 LYS H 1.0 1.8 5.0 259 163 A 12 LYS HA A 85 LEU HDx% 1.0 1.8 6.0 260 164 A 12 LYS HA A 85 LEU HDy% 1.0 1.8 6.0 261 165 A 85 LEU HDx% A 12 LYS HBx 1.0 1.8 5.0 262 165 A 12 LYS HBy A 85 LEU HDx% 1.0 1.8 5.0 263 166 A 85 LEU HDx% A 12 LYS HDx 1.0 1.8 6.0 264 166 A 12 LYS HDy A 85 LEU HDx% 1.0 1.8 6.0 265 167 A 85 LEU HDy% A 12 LYS HEx 1.0 1.8 5.0 266 167 A 12 LYS HEy A 85 LEU HDy% 1.0 1.8 5.0 267 168 A 85 LEU HBx A 12 LYS HBx 1.0 1.8 5.0 268 168 A 12 LYS HBy A 85 LEU HBx 1.0 1.8 5.0 269 169 A 12 LYS H A 85 LEU HDx% 1.0 1.8 6.0 270 170 A 85 LEU HBy A 12 LYS HGy 1.0 1.8 5.0 271 170 A 12 LYS HGx A 85 LEU HBy 1.0 1.8 5.0 272 171 A 86 LYS HA A 12 LYS HGy 1.0 1.8 6.0 273 171 A 12 LYS HGx A 86 LYS HA 1.0 1.8 6.0 274 172 A 13 LEU HDx% A 13 LEU HA 1.0 1.8 5.0 275 173 A 13 LEU HA A 13 LEU HDy% 1.0 1.8 3.5 276 174 A 13 LEU HA A 13 LEU HG 1.0 1.8 5.0 277 175 A 13 LEU HDy% A 13 LEU HBy 1.0 1.8 5.0 278 176 A 13 LEU HDx% A 13 LEU HBx 1.0 1.8 3.5 279 177 A 13 LEU HDx% A 13 LEU HBy 1.0 1.8 5.0 280 178 A 13 LEU HDy% A 13 LEU HBx 1.0 1.8 3.5 281 179 A 13 LEU H A 13 LEU HBx 1.0 1.8 5.0 282 180 A 13 LEU H A 13 LEU HBy 1.0 1.8 3.5 283 181 A 13 LEU HDx% A 13 LEU H 1.0 1.8 5.0 284 182 A 13 LEU HDy% A 13 LEU H 1.0 1.8 5.0 285 183 A 13 LEU H A 13 LEU HG 1.0 1.8 5.0 286 184 A 13 LEU HBy A 14 VAL HGy% 1.0 1.8 5.0 287 185 A 13 LEU HBx A 14 VAL HA 1.0 1.8 5.0 288 186 A 13 LEU HDy% A 14 VAL H 1.0 1.8 5.0 289 187 A 14 VAL H A 13 LEU HG 1.0 1.8 5.0 290 188 A 13 LEU H A 14 VAL HGy% 1.0 1.8 5.0 291 189 A 13 LEU H A 14 VAL HA 1.0 1.8 6.0 292 190 A 13 LEU H A 14 VAL H 1.0 1.8 3.5 293 191 A 13 LEU HBx A 14 VAL H 1.0 1.8 5.0 294 192 A 13 LEU HBy A 14 VAL H 1.0 1.8 3.5 295 193 A 13 LEU HDx% A 14 VAL H 1.0 1.8 5.0 296 194 A 13 LEU HA A 15 LYS H 1.0 1.8 6.0 297 195 A 13 LEU H A 15 LYS H 1.0 1.8 5.0 298 196 A 13 LEU HA A 16 LYS HBx 1.0 1.8 5.0 299 197 A 13 LEU HA A 16 LYS HBy 1.0 1.8 5.0 300 198 A 13 LEU HA A 16 LYS H 1.0 1.8 5.0 301 199 A 13 LEU HA A 16 LYS HGy 1.0 1.8 5.0 302 200 A 13 LEU H A 16 LYS HBy 1.0 1.8 6.0 303 201 A 13 LEU HA A 17 ALA H 1.0 1.8 5.0 304 202 A 13 LEU HA A 72 ALA HB% 1.0 1.8 6.0 305 203 A 13 LEU HDx% A 72 ALA HB% 1.0 1.8 3.5 306 204 A 72 ALA HB% A 13 LEU HBy 1.0 1.8 5.0 307 205 A 13 LEU HBy A 72 ALA HA 1.0 1.8 5.0 308 206 A 13 LEU HDy% A 72 ALA HA 1.0 1.8 5.0 309 207 A 13 LEU HDx% A 72 ALA HA 1.0 1.8 5.0 310 208 A 13 LEU HDy% A 72 ALA HB% 1.0 1.8 3.5 311 209 A 13 LEU HBx A 72 ALA HA 1.0 1.8 5.0 312 210 A 13 LEU HDy% A 72 ALA H 1.0 1.8 6.0 313 211 A 13 LEU HDy% A 73 LEU HA 1.0 1.8 5.0 314 212 A 13 LEU HDy% A 73 LEU H 1.0 1.8 5.0 315 213 A 13 LEU HDy% A 74 TRP H 1.0 1.8 6.0 316 214 A 13 LEU HDx% A 75 ILE HG2% 1.0 1.8 5.0 317 215 A 13 LEU HA A 75 ILE HD1% 1.0 1.8 6.0 318 216 A 13 LEU HBy A 75 ILE HG2% 1.0 1.8 5.0 319 217 A 13 LEU HA A 75 ILE HG2% 1.0 1.8 5.0 320 218 A 13 LEU H A 75 ILE HG2% 1.0 1.8 6.0 321 219 A 13 LEU HDy% A 75 ILE HD1% 1.0 1.8 6.0 322 220 A 13 LEU HDy% A 75 ILE HA 1.0 1.8 6.0 323 221 A 13 LEU HG A 75 ILE HG1x 1.0 1.8 6.0 324 222 A 13 LEU HDy% A 75 ILE HG2% 1.0 1.8 3.5 325 223 A 13 LEU HBx A 75 ILE H 1.0 1.8 6.0 326 224 A 13 LEU HDy% A 75 ILE H 1.0 1.8 6.0 327 225 A 13 LEU HDx% A 76 HIS HD2 1.0 1.8 5.0 328 226 A 13 LEU HDy% A 76 HIS HA 1.0 1.8 5.0 329 227 A 13 LEU HDx% A 76 HIS HA 1.0 1.8 6.0 330 228 A 13 LEU HDy% A 76 HIS HBx 1.0 1.8 5.0 331 229 A 13 LEU HDy% A 76 HIS HBy 1.0 1.8 5.0 332 230 A 13 LEU HDx% A 76 HIS HBy 1.0 1.8 5.0 333 231 A 76 HIS HD2 A 13 LEU HBx 1.0 1.8 6.0 334 232 A 13 LEU HDy% A 76 HIS HD2 1.0 1.8 3.5 335 233 A 13 LEU HDy% A 76 HIS H 1.0 1.8 5.0 336 234 A 76 HIS H A 13 LEU HBx 1.0 1.8 6.0 337 235 A 76 HIS H A 13 LEU HG 1.0 1.8 6.0 338 236 A 13 LEU HA A 79 LEU HDx% 1.0 1.8 6.0 339 237 A 13 LEU HA A 85 LEU HDx% 1.0 1.8 5.0 340 238 A 13 LEU HA A 85 LEU HDy% 1.0 1.8 5.0 341 239 A 13 LEU HA A 85 LEU HBy 1.0 1.8 5.0 342 240 A 13 LEU HDx% A 85 LEU HDx% 1.0 1.8 5.0 343 241 A 13 LEU HDy% A 85 LEU HDx% 1.0 1.8 3.5 344 242 A 13 LEU HDx% A 85 LEU HBy 1.0 1.8 5.0 345 243 A 13 LEU HG A 85 LEU HG 1.0 1.8 5.0 346 244 A 13 LEU HBy A 85 LEU HDy% 1.0 1.8 5.0 347 245 A 85 LEU HDy% A 13 LEU HG 1.0 1.8 3.5 348 246 A 85 LEU HDx% A 13 LEU HG 1.0 1.8 5.0 349 247 A 13 LEU HBx A 85 LEU HDx% 1.0 1.8 5.0 350 248 A 85 LEU HBy A 13 LEU HG 1.0 1.8 5.0 351 249 A 13 LEU HDx% A 85 LEU HBx 1.0 1.8 6.0 352 250 A 13 LEU H A 85 LEU HBx 1.0 1.8 6.0 353 251 A 13 LEU H A 85 LEU HDx% 1.0 1.8 5.0 354 252 A 14 VAL HGy% A 14 VAL HA 1.0 1.8 3.5 355 253 A 14 VAL HGx% A 14 VAL HA 1.0 1.8 3.5 356 254 A 14 VAL HGx% A 14 VAL H 1.0 1.8 5.0 357 255 A 14 VAL HB A 14 VAL H 1.0 1.8 3.5 358 256 A 14 VAL HGy% A 14 VAL H 1.0 1.8 3.5 359 257 A 14 VAL HA A 15 LYS HBx 1.0 1.8 6.0 360 257 A 15 LYS HBy A 14 VAL HA 1.0 1.8 6.0 361 258 A 14 VAL HB A 15 LYS HBx 1.0 1.8 5.0 362 258 A 14 VAL HB A 15 LYS HBy 1.0 1.8 5.0 363 259 A 14 VAL HGx% A 15 LYS HGy 1.0 1.8 5.0 364 260 A 14 VAL HGx% A 15 LYS HA 1.0 1.8 5.0 365 261 A 14 VAL HGy% A 15 LYS HGy 1.0 1.8 6.0 366 262 A 14 VAL HGx% A 15 LYS HGx 1.0 1.8 5.0 367 263 A 14 VAL HGx% A 15 LYS HBx 1.0 1.8 5.0 368 263 A 14 VAL HGx% A 15 LYS HBy 1.0 1.8 5.0 369 264 A 14 VAL H A 15 LYS HBx 1.0 1.8 6.0 370 264 A 14 VAL H A 15 LYS HBy 1.0 1.8 6.0 371 265 A 14 VAL H A 15 LYS H 1.0 1.8 3.5 372 266 A 14 VAL HB A 15 LYS H 1.0 1.8 3.5 373 267 A 14 VAL HGy% A 15 LYS H 1.0 1.8 5.0 374 268 A 14 VAL HGx% A 15 LYS H 1.0 1.8 5.0 375 269 A 14 VAL HA A 16 LYS HBx 1.0 1.8 6.0 376 270 A 14 VAL HGx% A 16 LYS H 1.0 1.8 6.0 377 271 A 14 VAL H A 16 LYS H 1.0 1.8 5.0 378 272 A 16 LYS H A 14 VAL HA 1.0 1.8 5.0 379 273 A 14 VAL HB A 16 LYS H 1.0 1.8 6.0 380 274 A 14 VAL HA A 17 ALA HB% 1.0 1.8 3.5 381 275 A 14 VAL HGx% A 17 ALA HB% 1.0 1.8 5.0 382 276 A 14 VAL HB A 17 ALA HB% 1.0 1.8 6.0 383 277 A 14 VAL HA A 17 ALA H 1.0 1.8 5.0 384 278 A 14 VAL HGx% A 17 ALA H 1.0 1.8 5.0 385 279 A 14 VAL H A 17 ALA H 1.0 1.8 5.0 386 280 A 14 VAL H A 17 ALA HB% 1.0 1.8 5.0 387 281 A 14 VAL HA A 18 LEU H 1.0 1.8 5.0 388 282 A 14 VAL HA A 18 LEU HDy% 1.0 1.8 5.0 389 283 A 14 VAL HB A 18 LEU HDx% 1.0 1.8 5.0 390 284 A 14 VAL HGx% A 18 LEU HDy% 1.0 1.8 5.0 391 285 A 14 VAL HGx% A 18 LEU HBy 1.0 1.8 5.0 392 286 A 14 VAL HGx% A 18 LEU HDx% 1.0 1.8 2.7 393 287 A 14 VAL HGy% A 18 LEU HDy% 1.0 1.8 5.0 394 288 A 14 VAL HGx% A 18 LEU HG 1.0 1.8 5.0 395 289 A 14 VAL HGx% A 18 LEU H 1.0 1.8 5.0 396 290 A 14 VAL HGx% A 41 VAL HB 1.0 1.8 5.0 397 291 A 14 VAL HGx% A 41 VAL H 1.0 1.8 6.0 398 292 A 14 VAL HGx% A 41 VAL HGy% 1.0 1.8 3.5 399 293 A 14 VAL HGy% A 41 VAL HGy% 1.0 1.8 5.0 400 294 A 14 VAL HGy% A 41 VAL HGx% 1.0 1.8 5.0 401 295 A 14 VAL HA A 41 VAL HGy% 1.0 1.8 5.0 402 296 A 14 VAL HGx% A 68 LYS HA 1.0 1.8 5.0 403 297 A 14 VAL HGy% A 68 LYS HBx 1.0 1.8 3.5 404 298 A 14 VAL HGy% A 68 LYS HBy 1.0 1.8 5.0 405 299 A 14 VAL HGy% A 68 LYS HDx 1.0 1.8 5.0 406 299 A 14 VAL HGy% A 68 LYS HDy 1.0 1.8 5.0 407 300 A 14 VAL HGx% A 68 LYS HDx 1.0 1.8 5.0 408 300 A 14 VAL HGx% A 68 LYS HDy 1.0 1.8 5.0 409 301 A 14 VAL HB A 68 LYS HA 1.0 1.8 6.0 410 302 A 14 VAL HGx% A 68 LYS HGy 1.0 1.8 3.5 411 303 A 14 VAL HGx% A 68 LYS HEx 1.0 1.8 5.0 412 303 A 14 VAL HGx% A 68 LYS HEy 1.0 1.8 5.0 413 304 A 14 VAL HGx% A 68 LYS HBx 1.0 1.8 5.0 414 305 A 14 VAL HGx% A 68 LYS HGx 1.0 1.8 5.0 415 306 A 14 VAL HGy% A 68 LYS HA 1.0 1.8 5.0 416 307 A 14 VAL HGy% A 68 LYS HEx 1.0 1.8 5.0 417 307 A 14 VAL HGy% A 68 LYS HEy 1.0 1.8 5.0 418 308 A 14 VAL HB A 68 LYS HBx 1.0 1.8 6.0 419 309 A 14 VAL HGy% A 68 LYS HGy 1.0 1.8 5.0 420 310 A 14 VAL HGx% A 68 LYS H 1.0 1.8 6.0 421 311 A 14 VAL HGy% A 68 LYS H 1.0 1.8 5.0 422 312 A 14 VAL HGy% A 69 HIS H 1.0 1.8 5.0 423 313 A 14 VAL HGy% A 69 HIS HA 1.0 1.8 6.0 424 314 A 14 VAL HGx% A 71 LEU HBy 1.0 1.8 5.0 425 315 A 14 VAL HGy% A 71 LEU HDx% 1.0 1.8 5.0 426 316 A 14 VAL HGy% A 71 LEU HBy 1.0 1.8 5.0 427 317 A 14 VAL HA A 71 LEU HBy 1.0 1.8 5.0 428 318 A 14 VAL HA A 71 LEU HBx 1.0 1.8 5.0 429 319 A 14 VAL HGy% A 71 LEU H 1.0 1.8 6.0 430 320 A 72 ALA HB% A 14 VAL HB 1.0 1.8 6.0 431 321 A 72 ALA HB% A 14 VAL HGy% 1.0 1.8 3.5 432 322 A 72 ALA HB% A 14 VAL HGx% 1.0 1.8 5.0 433 323 A 14 VAL HGx% A 72 ALA H 1.0 1.8 6.0 434 324 A 14 VAL HGy% A 72 ALA HA 1.0 1.8 5.0 435 325 A 72 ALA HB% A 14 VAL HA 1.0 1.8 5.0 436 326 A 14 VAL HA A 72 ALA HA 1.0 1.8 5.0 437 327 A 72 ALA HB% A 14 VAL H 1.0 1.8 5.0 438 328 A 14 VAL HGy% A 72 ALA H 1.0 1.8 5.0 439 329 A 72 ALA H A 14 VAL HA 1.0 1.8 5.0 440 330 A 14 VAL H A 72 ALA HA 1.0 1.8 5.0 441 331 A 14 VAL H A 85 LEU HDx% 1.0 1.8 6.0 442 332 A 15 LYS HGy A 15 LYS HEx 1.0 1.8 3.5 443 332 A 15 LYS HGy A 15 LYS HEy 1.0 1.8 3.5 444 333 A 15 LYS HA A 15 LYS HDx 1.0 1.8 5.0 445 333 A 15 LYS HA A 15 LYS HDy 1.0 1.8 5.0 446 334 A 15 LYS HGx A 15 LYS HA 1.0 1.8 5.0 447 335 A 15 LYS HGy A 15 LYS HA 1.0 1.8 5.0 448 336 A 15 LYS HBy A 15 LYS HDx 1.0 1.8 3.5 449 336 A 15 LYS HBx A 15 LYS HDx 1.0 1.8 3.5 450 336 A 15 LYS HDy A 15 LYS HBx 1.0 1.8 3.5 451 336 A 15 LYS HBy A 15 LYS HDy 1.0 1.8 3.5 452 337 A 15 LYS HBy A 15 LYS HEx 1.0 1.8 5.0 453 337 A 15 LYS HBx A 15 LYS HEx 1.0 1.8 5.0 454 337 A 15 LYS HEy A 15 LYS HBx 1.0 1.8 5.0 455 337 A 15 LYS HBy A 15 LYS HEy 1.0 1.8 5.0 456 338 A 15 LYS H A 15 LYS HEx 1.0 1.8 5.0 457 338 A 15 LYS H A 15 LYS HEy 1.0 1.8 5.0 458 339 A 15 LYS HGy A 15 LYS HDx 1.0 1.8 3.5 459 339 A 15 LYS HGy A 15 LYS HDy 1.0 1.8 3.5 460 340 A 15 LYS HDx A 15 LYS HEx 1.0 1.8 3.5 461 340 A 15 LYS HEy A 15 LYS HDx 1.0 1.8 3.5 462 340 A 15 LYS HEy A 15 LYS HDy 1.0 1.8 3.5 463 340 A 15 LYS HDy A 15 LYS HEx 1.0 1.8 3.5 464 341 A 15 LYS HGx A 15 LYS HEx 1.0 1.8 3.5 465 341 A 15 LYS HGx A 15 LYS HEy 1.0 1.8 3.5 466 342 A 15 LYS H A 15 LYS HDx 1.0 1.8 5.0 467 342 A 15 LYS H A 15 LYS HDy 1.0 1.8 5.0 468 343 A 15 LYS H A 15 LYS HBx 1.0 1.8 3.5 469 343 A 15 LYS H A 15 LYS HBy 1.0 1.8 3.5 470 344 A 15 LYS H A 15 LYS HGx 1.0 1.8 3.5 471 345 A 15 LYS HGy A 15 LYS H 1.0 1.8 3.5 472 346 A 15 LYS HGy A 16 LYS H 1.0 1.8 6.0 473 347 A 16 LYS HA A 15 LYS HBx 1.0 1.8 5.0 474 347 A 15 LYS HBy A 16 LYS HA 1.0 1.8 5.0 475 348 A 16 LYS H A 15 LYS HBx 1.0 1.8 3.5 476 348 A 15 LYS HBy A 16 LYS H 1.0 1.8 3.5 477 349 A 15 LYS H A 16 LYS HBy 1.0 1.8 6.0 478 350 A 16 LYS H A 15 LYS HDx 1.0 1.8 6.0 479 350 A 16 LYS H A 15 LYS HDy 1.0 1.8 6.0 480 351 A 15 LYS HGx A 16 LYS H 1.0 1.8 5.0 481 352 A 15 LYS H A 16 LYS H 1.0 1.8 3.5 482 353 A 15 LYS HA A 17 ALA HB% 1.0 1.8 6.0 483 354 A 15 LYS H A 17 ALA H 1.0 1.8 5.0 484 355 A 15 LYS H A 17 ALA HB% 1.0 1.8 5.0 485 356 A 17 ALA H A 15 LYS HA 1.0 1.8 5.0 486 357 A 15 LYS HA A 18 LEU HBx 1.0 1.8 5.0 487 358 A 15 LYS HA A 18 LEU HBy 1.0 1.8 5.0 488 359 A 15 LYS HA A 18 LEU HDx% 1.0 1.8 5.0 489 360 A 18 LEU HBy A 15 LYS HBx 1.0 1.8 5.0 490 360 A 15 LYS HBy A 18 LEU HBy 1.0 1.8 5.0 491 361 A 18 LEU HDx% A 15 LYS HDx 1.0 1.8 6.0 492 361 A 18 LEU HDx% A 15 LYS HDy 1.0 1.8 6.0 493 362 A 15 LYS HA A 18 LEU HG 1.0 1.8 5.0 494 363 A 18 LEU HDx% A 15 LYS HBx 1.0 1.8 5.0 495 363 A 15 LYS HBy A 18 LEU HDx% 1.0 1.8 5.0 496 364 A 18 LEU HG A 15 LYS HBx 1.0 1.8 5.0 497 364 A 15 LYS HBy A 18 LEU HG 1.0 1.8 5.0 498 365 A 15 LYS HGy A 18 LEU HDx% 1.0 1.8 5.0 499 366 A 15 LYS HA A 18 LEU H 1.0 1.8 5.0 500 367 A 15 LYS H A 18 LEU HDx% 1.0 1.8 5.0 501 368 A 18 LEU H A 15 LYS HBx 1.0 1.8 6.0 502 368 A 15 LYS HBy A 18 LEU H 1.0 1.8 6.0 503 369 A 15 LYS H A 18 LEU HG 1.0 1.8 5.0 504 370 A 15 LYS H A 18 LEU H 1.0 1.8 5.0 505 371 A 15 LYS H A 18 LEU HDy% 1.0 1.8 6.0 506 372 A 15 LYS HA A 19 GLU H 1.0 1.8 5.0 507 373 A 15 LYS HA A 19 GLU HGx 1.0 1.8 5.0 508 373 A 15 LYS HA A 19 GLU HGy 1.0 1.8 5.0 509 374 A 15 LYS HA A 41 VAL HGy% 1.0 1.8 6.0 510 375 A 16 LYS HBx A 16 LYS HDy 1.0 1.8 5.0 511 376 A 16 LYS H A 16 LYS HBx 1.0 1.8 5.0 512 377 A 16 LYS HA A 16 LYS HDx 1.0 1.8 5.0 513 378 A 16 LYS HA A 16 LYS HDy 1.0 1.8 5.0 514 379 A 16 LYS HBx A 16 LYS HDx 1.0 1.8 5.0 515 380 A 16 LYS HBy A 16 LYS HDx 1.0 1.8 5.0 516 381 A 16 LYS HBy A 16 LYS HDy 1.0 1.8 5.0 517 382 A 16 LYS HGy A 16 LYS HEx 1.0 1.8 5.0 518 382 A 16 LYS HGy A 16 LYS HEy 1.0 1.8 5.0 519 383 A 16 LYS HA A 16 LYS HGx 1.0 1.8 5.0 520 384 A 16 LYS HGy A 16 LYS HA 1.0 1.8 5.0 521 385 A 16 LYS H A 16 LYS HGx 1.0 1.8 5.0 522 386 A 16 LYS HBx A 16 LYS HEx 1.0 1.8 6.0 523 386 A 16 LYS HBx A 16 LYS HEy 1.0 1.8 6.0 524 387 A 16 LYS H A 16 LYS HDy 1.0 1.8 6.0 525 388 A 16 LYS H A 16 LYS HDx 1.0 1.8 5.0 526 389 A 16 LYS H A 16 LYS HBy 1.0 1.8 3.5 527 390 A 16 LYS H A 16 LYS HEx 1.0 1.8 6.0 528 390 A 16 LYS H A 16 LYS HEy 1.0 1.8 6.0 529 391 A 16 LYS H A 16 LYS HGy 1.0 1.8 5.0 530 392 A 16 LYS HBx A 17 ALA HB% 1.0 1.8 5.0 531 393 A 16 LYS H A 17 ALA HB% 1.0 1.8 5.0 532 394 A 16 LYS H A 17 ALA H 1.0 1.8 3.5 533 395 A 16 LYS HBx A 17 ALA H 1.0 1.8 5.0 534 396 A 16 LYS HBy A 17 ALA H 1.0 1.8 5.0 535 397 A 17 ALA H A 16 LYS HGx 1.0 1.8 5.0 536 398 A 16 LYS H A 18 LEU H 1.0 1.8 5.0 537 399 A 16 LYS HBx A 18 LEU H 1.0 1.8 6.0 538 400 A 16 LYS H A 18 LEU HG 1.0 1.8 6.0 539 401 A 16 LYS HA A 19 GLU HGy 1.0 1.8 5.0 540 402 A 16 LYS HA A 19 GLU HBx 1.0 1.8 5.0 541 402 A 16 LYS HA A 19 GLU HBy 1.0 1.8 5.0 542 403 A 16 LYS HA A 19 GLU HGx 1.0 1.8 5.0 543 404 A 19 GLU H A 16 LYS HDy 1.0 1.8 6.0 544 405 A 16 LYS H A 19 GLU H 1.0 1.8 6.0 545 406 A 16 LYS HA A 19 GLU H 1.0 1.8 5.0 546 407 A 16 LYS HA A 19 GLU HGx 1.0 1.8 5.0 547 407 A 16 LYS HA A 19 GLU HGy 1.0 1.8 5.0 548 408 A 16 LYS HBy A 19 GLU HGx 1.0 1.8 5.0 549 408 A 16 LYS HBy A 19 GLU HGy 1.0 1.8 5.0 550 409 A 16 LYS HA A 20 ILE HD1% 1.0 1.8 5.0 551 410 A 16 LYS HA A 20 ILE H 1.0 1.8 5.0 552 411 A 16 LYS HGx A 20 ILE HB 1.0 1.8 5.0 553 412 A 16 LYS HGx A 20 ILE HD1% 1.0 1.8 5.0 554 413 A 16 LYS HDy A 20 ILE HD1% 1.0 1.8 5.0 555 414 A 20 ILE HD1% A 16 LYS HEx 1.0 1.8 5.0 556 414 A 16 LYS HEy A 20 ILE HD1% 1.0 1.8 5.0 557 415 A 16 LYS HGx A 20 ILE HG1x 1.0 1.8 5.0 558 415 A 16 LYS HGx A 20 ILE HG1y 1.0 1.8 5.0 559 416 A 16 LYS HA A 20 ILE HG1x 1.0 1.8 5.0 560 416 A 16 LYS HA A 20 ILE HG1y 1.0 1.8 5.0 561 417 A 16 LYS HDy A 20 ILE HG1x 1.0 1.8 5.0 562 417 A 16 LYS HDy A 20 ILE HG1y 1.0 1.8 5.0 563 418 A 16 LYS HGx A 20 ILE H 1.0 1.8 5.0 564 419 A 16 LYS HDy A 20 ILE H 1.0 1.8 5.0 565 420 A 16 LYS HBx A 20 ILE H 1.0 1.8 6.0 566 421 A 16 LYS HDx A 20 ILE H 1.0 1.8 6.0 567 422 A 16 LYS HBy A 75 ILE HG1y 1.0 1.8 6.0 568 423 A 75 ILE HG1y A 16 LYS HEx 1.0 1.8 6.0 569 423 A 16 LYS HEy A 75 ILE HG1y 1.0 1.8 6.0 570 424 A 75 ILE HD1% A 16 LYS HGx 1.0 1.8 5.0 571 425 A 75 ILE HG2% A 16 LYS HGx 1.0 1.8 5.0 572 426 A 16 LYS HBx A 75 ILE HG2% 1.0 1.8 5.0 573 427 A 16 LYS HBy A 75 ILE HG2% 1.0 1.8 5.0 574 428 A 16 LYS HGy A 75 ILE HG1x 1.0 1.8 5.0 575 429 A 16 LYS HBy A 75 ILE HG1x 1.0 1.8 5.0 576 430 A 16 LYS HBx A 75 ILE HD1% 1.0 1.8 5.0 577 431 A 16 LYS HGx A 75 ILE HG1y 1.0 1.8 5.0 578 432 A 75 ILE HG1x A 16 LYS HGx 1.0 1.8 5.0 579 433 A 16 LYS HA A 75 ILE HG1y 1.0 1.8 6.0 580 434 A 16 LYS HGy A 75 ILE HG1y 1.0 1.8 5.0 581 435 A 16 LYS H A 75 ILE HG2% 1.0 1.8 5.0 582 436 A 16 LYS HGy A 79 LEU HDy% 1.0 1.8 5.0 583 437 A 16 LYS HDx A 79 LEU HDy% 1.0 1.8 6.0 584 438 A 16 LYS HDy A 79 LEU HDy% 1.0 1.8 5.0 585 439 A 79 LEU HDy% A 16 LYS HEx 1.0 1.8 5.0 586 439 A 16 LYS HEy A 79 LEU HDy% 1.0 1.8 5.0 587 440 A 16 LYS HGy A 79 LEU HDx% 1.0 1.8 3.5 588 441 A 16 LYS HGx A 79 LEU HDy% 1.0 1.8 5.0 589 442 A 79 LEU HDx% A 16 LYS HGx 1.0 1.8 5.0 590 443 A 85 LEU HDy% A 16 LYS HA 1.0 1.8 6.0 591 444 A 85 LEU HDy% A 16 LYS HDx 1.0 1.8 5.0 592 445 A 85 LEU HDy% A 16 LYS HEx 1.0 1.8 5.0 593 445 A 85 LEU HDy% A 16 LYS HEy 1.0 1.8 5.0 594 446 A 85 LEU HDy% A 16 LYS HGx 1.0 1.8 5.0 595 447 A 85 LEU HDy% A 16 LYS HBy 1.0 1.8 5.0 596 448 A 85 LEU HDy% A 16 LYS HBx 1.0 1.8 5.0 597 449 A 85 LEU HDx% A 16 LYS HBy 1.0 1.8 5.0 598 450 A 85 LEU HDy% A 16 LYS HGy 1.0 1.8 3.5 599 451 A 16 LYS H A 85 LEU HDy% 1.0 1.8 5.0 600 452 A 17 ALA H A 17 ALA HB% 1.0 1.8 3.5 601 453 A 17 ALA HB% A 18 LEU HDx% 1.0 1.8 5.0 602 454 A 17 ALA HB% A 18 LEU HDy% 1.0 1.8 5.0 603 455 A 17 ALA HB% A 18 LEU H 1.0 1.8 3.5 604 456 A 17 ALA H A 18 LEU H 1.0 1.8 3.5 605 457 A 17 ALA H A 19 GLU H 1.0 1.8 5.0 606 458 A 17 ALA HB% A 19 GLU H 1.0 1.8 5.0 607 459 A 17 ALA H A 19 GLU HGx 1.0 1.8 5.0 608 459 A 17 ALA H A 19 GLU HGy 1.0 1.8 5.0 609 460 A 17 ALA HA A 20 ILE HG2% 1.0 1.8 5.0 610 461 A 20 ILE HB A 17 ALA HA 1.0 1.8 5.0 611 462 A 20 ILE HD1% A 17 ALA HA 1.0 1.8 6.0 612 463 A 17 ALA HA A 20 ILE HG1x 1.0 1.8 5.0 613 463 A 20 ILE HG1y A 17 ALA HA 1.0 1.8 5.0 614 464 A 17 ALA HB% A 20 ILE HB 1.0 1.8 5.0 615 465 A 17 ALA HB% A 20 ILE H 1.0 1.8 5.0 616 466 A 20 ILE H A 17 ALA HA 1.0 1.8 5.0 617 467 A 17 ALA H A 20 ILE H 1.0 1.8 6.0 618 468 A 17 ALA HB% A 21 GLY HAx 1.0 1.8 5.0 619 469 A 17 ALA HA A 21 GLY H 1.0 1.8 5.0 620 470 A 17 ALA HB% A 44 VAL HGy% 1.0 1.8 6.0 621 471 A 17 ALA HB% A 71 LEU HDx% 1.0 1.8 5.0 622 472 A 17 ALA HB% A 71 LEU HBy 1.0 1.8 5.0 623 473 A 17 ALA HB% A 71 LEU HBx 1.0 1.8 5.0 624 474 A 17 ALA HB% A 71 LEU HA 1.0 1.8 5.0 625 475 A 17 ALA HB% A 71 LEU HDy% 1.0 1.8 3.5 626 476 A 17 ALA HB% A 71 LEU HG 1.0 1.8 5.0 627 477 A 17 ALA HB% A 71 LEU H 1.0 1.8 5.0 628 478 A 72 ALA HA A 17 ALA HB% 1.0 1.8 5.0 629 479 A 72 ALA H A 17 ALA HB% 1.0 1.8 5.0 630 480 A 17 ALA HB% A 74 TRP HZ3 1.0 1.8 5.0 631 481 A 17 ALA HA A 74 TRP HZ3 1.0 1.8 5.0 632 482 A 17 ALA HB% A 74 TRP HH2 1.0 1.8 5.0 633 483 A 17 ALA HA A 74 TRP HH2 1.0 1.8 5.0 634 484 A 75 ILE HG1y A 17 ALA HA 1.0 1.8 5.0 635 485 A 75 ILE HD1% A 17 ALA HB% 1.0 1.8 5.0 636 486 A 75 ILE HG2% A 17 ALA HB% 1.0 1.8 3.5 637 487 A 75 ILE H A 17 ALA HB% 1.0 1.8 5.0 638 488 A 75 ILE HD1% A 17 ALA HA 1.0 1.8 5.0 639 489 A 75 ILE HG2% A 17 ALA HA 1.0 1.8 5.0 640 490 A 17 ALA HA A 75 ILE HB 1.0 1.8 5.0 641 491 A 75 ILE HG1x A 17 ALA HB% 1.0 1.8 6.0 642 492 A 17 ALA H A 75 ILE HD1% 1.0 1.8 5.0 643 493 A 17 ALA H A 75 ILE HG2% 1.0 1.8 3.5 644 494 A 17 ALA H A 75 ILE HG1y 1.0 1.8 5.0 645 495 A 76 HIS H A 17 ALA HB% 1.0 1.8 6.0 646 496 A 85 LEU HDy% A 17 ALA H 1.0 1.8 5.0 647 497 A 18 LEU HG A 18 LEU HA 1.0 1.8 5.0 648 498 A 18 LEU HDx% A 18 LEU HA 1.0 1.8 5.0 649 499 A 18 LEU HDx% A 18 LEU HBx 1.0 1.8 3.5 650 500 A 18 LEU HDx% A 18 LEU HBy 1.0 1.8 5.0 651 501 A 18 LEU HDy% A 18 LEU HA 1.0 1.8 3.5 652 502 A 18 LEU HDy% A 18 LEU HBy 1.0 1.8 5.0 653 503 A 18 LEU HDy% A 18 LEU HBx 1.0 1.8 3.5 654 504 A 18 LEU H A 18 LEU HBx 1.0 1.8 5.0 655 505 A 18 LEU H A 18 LEU HBy 1.0 1.8 3.5 656 506 A 18 LEU H A 18 LEU HDx% 1.0 1.8 5.0 657 507 A 18 LEU H A 18 LEU HDy% 1.0 1.8 3.5 658 508 A 18 LEU H A 18 LEU HG 1.0 1.8 3.5 659 509 A 18 LEU HDx% A 19 GLU H 1.0 1.8 5.0 660 510 A 18 LEU HBx A 19 GLU H 1.0 1.8 5.0 661 511 A 18 LEU HBy A 19 GLU H 1.0 1.8 5.0 662 512 A 18 LEU HDy% A 19 GLU H 1.0 1.8 5.0 663 513 A 18 LEU HG A 19 GLU H 1.0 1.8 5.0 664 514 A 18 LEU H A 19 GLU H 1.0 1.8 3.5 665 515 A 18 LEU H A 20 ILE H 1.0 1.8 5.0 666 516 A 18 LEU HDy% A 22 GLY H 1.0 1.8 6.0 667 517 A 18 LEU HA A 22 GLY H 1.0 1.8 5.0 668 518 A 18 LEU HBx A 22 GLY H 1.0 1.8 5.0 669 519 A 18 LEU HDy% A 32 LEU HDx% 1.0 1.8 5.0 670 520 A 18 LEU HDx% A 40 ARG HBx 1.0 1.8 5.0 671 521 A 18 LEU HA A 40 ARG HBx 1.0 1.8 6.0 672 522 A 18 LEU HDy% A 40 ARG HBx 1.0 1.8 5.0 673 523 A 18 LEU HDx% A 40 ARG HDx 1.0 1.8 5.0 674 523 A 18 LEU HDx% A 40 ARG HDy 1.0 1.8 5.0 675 524 A 18 LEU HDy% A 40 ARG HDx 1.0 1.8 6.0 676 524 A 18 LEU HDy% A 40 ARG HDy 1.0 1.8 6.0 677 525 A 18 LEU HDy% A 41 VAL HGy% 1.0 1.8 3.5 678 526 A 18 LEU HDy% A 41 VAL HA 1.0 1.8 3.5 679 527 A 18 LEU HDy% A 41 VAL H 1.0 1.8 5.0 680 528 A 18 LEU HDx% A 41 VAL HA 1.0 1.8 5.0 681 529 A 18 LEU HBy A 41 VAL HGy% 1.0 1.8 6.0 682 530 A 18 LEU HDy% A 41 VAL HB 1.0 1.8 5.0 683 531 A 18 LEU HG A 41 VAL HGy% 1.0 1.8 5.0 684 532 A 18 LEU HDx% A 41 VAL HGy% 1.0 1.8 3.5 685 533 A 18 LEU H A 41 VAL HGy% 1.0 1.8 6.0 686 534 A 18 LEU HDx% A 41 VAL H 1.0 1.8 5.0 687 535 A 18 LEU HDy% A 44 VAL HGy% 1.0 1.8 3.5 688 536 A 18 LEU HBy A 44 VAL HGy% 1.0 1.8 6.0 689 537 A 18 LEU HBx A 44 VAL HGy% 1.0 1.8 5.0 690 538 A 44 VAL HGy% A 18 LEU HA 1.0 1.8 3.5 691 539 A 18 LEU HBx A 44 VAL HGx% 1.0 1.8 5.0 692 540 A 18 LEU HA A 44 VAL HGx% 1.0 1.8 3.5 693 541 A 18 LEU HDy% A 44 VAL HB 1.0 1.8 5.0 694 542 A 18 LEU H A 44 VAL HGy% 1.0 1.8 6.0 695 543 A 18 LEU HDy% A 44 VAL H 1.0 1.8 5.0 696 544 A 18 LEU HDy% A 45 TYR H 1.0 1.8 5.0 697 545 A 18 LEU HDy% A 68 LYS HGy 1.0 1.8 6.0 698 546 A 71 LEU HDx% A 18 LEU HA 1.0 1.8 5.0 699 547 A 18 LEU HDy% A 71 LEU HDx% 1.0 1.8 3.5 700 548 A 18 LEU H A 71 LEU HDx% 1.0 1.8 5.0 701 549 A 75 ILE HG2% A 18 LEU H 1.0 1.8 6.0 702 550 A 19 GLU HA A 19 GLU HGx 1.0 1.8 5.0 703 551 A 19 GLU HGy A 19 GLU HA 1.0 1.8 5.0 704 552 A 19 GLU H A 19 GLU HBx 1.0 1.8 3.5 705 552 A 19 GLU H A 19 GLU HBy 1.0 1.8 3.5 706 553 A 19 GLU H A 19 GLU HGx 1.0 1.8 5.0 707 554 A 19 GLU H A 19 GLU HGy 1.0 1.8 5.0 708 555 A 19 GLU H A 19 GLU HGx 1.0 1.8 3.5 709 555 A 19 GLU H A 19 GLU HGy 1.0 1.8 3.5 710 556 A 19 GLU HBx A 20 ILE HG1x 1.0 1.8 5.0 711 556 A 19 GLU HBy A 20 ILE HG1x 1.0 1.8 5.0 712 556 A 20 ILE HG1y A 19 GLU HBx 1.0 1.8 5.0 713 556 A 19 GLU HBy A 20 ILE HG1y 1.0 1.8 5.0 714 557 A 19 GLU HGy A 20 ILE H 1.0 1.8 5.0 715 558 A 19 GLU H A 20 ILE H 1.0 1.8 3.5 716 559 A 20 ILE H A 19 GLU HBx 1.0 1.8 3.5 717 559 A 19 GLU HBy A 20 ILE H 1.0 1.8 3.5 718 560 A 20 ILE H A 19 GLU HGx 1.0 1.8 5.0 719 561 A 19 GLU H A 20 ILE HD1% 1.0 1.8 6.0 720 562 A 20 ILE H A 19 GLU HGx 1.0 1.8 5.0 721 562 A 19 GLU HGy A 20 ILE H 1.0 1.8 5.0 722 563 A 20 ILE HD1% A 19 GLU HGx 1.0 1.8 5.0 723 563 A 19 GLU HGy A 20 ILE HD1% 1.0 1.8 5.0 724 564 A 21 GLY H A 19 GLU HA 1.0 1.8 5.0 725 565 A 19 GLU H A 21 GLY H 1.0 1.8 5.0 726 566 A 22 GLY H A 19 GLU HA 1.0 1.8 5.0 727 567 A 19 GLU HA A 22 GLY HAx 1.0 1.8 5.0 728 568 A 19 GLU H A 22 GLY H 1.0 1.8 5.0 729 569 A 22 GLY H A 19 GLU HBx 1.0 1.8 6.0 730 569 A 19 GLU HBy A 22 GLY H 1.0 1.8 6.0 731 570 A 23 LYS HGy A 19 GLU HBx 1.0 1.8 5.0 732 570 A 19 GLU HBy A 23 LYS HGy 1.0 1.8 5.0 733 571 A 23 LYS HGx A 19 GLU HBx 1.0 1.8 6.0 734 571 A 19 GLU HBy A 23 LYS HGx 1.0 1.8 6.0 735 572 A 23 LYS H A 19 GLU HBx 1.0 1.8 6.0 736 572 A 19 GLU HBy A 23 LYS H 1.0 1.8 6.0 737 573 A 20 ILE HA A 20 ILE HG1x 1.0 1.8 5.0 738 573 A 20 ILE HG1y A 20 ILE HA 1.0 1.8 5.0 739 574 A 20 ILE HD1% A 20 ILE HA 1.0 1.8 3.5 740 575 A 20 ILE HD1% A 20 ILE HB 1.0 1.8 5.0 741 576 A 20 ILE HD1% A 20 ILE HG2% 1.0 1.8 3.5 742 577 A 20 ILE HG2% A 20 ILE HA 1.0 1.8 3.5 743 578 A 20 ILE HG2% A 20 ILE HG1x 1.0 1.8 3.5 744 578 A 20 ILE HG1y A 20 ILE HG2% 1.0 1.8 3.5 745 579 A 20 ILE H A 20 ILE HB 1.0 1.8 3.5 746 580 A 20 ILE HD1% A 20 ILE H 1.0 1.8 5.0 747 581 A 20 ILE H A 20 ILE HG1x 1.0 1.8 3.5 748 581 A 20 ILE H A 20 ILE HG1y 1.0 1.8 3.5 749 582 A 20 ILE H A 20 ILE HG2% 1.0 1.8 5.0 750 583 A 20 ILE HG2% A 21 GLY HAy 1.0 1.8 5.0 751 584 A 20 ILE H A 21 GLY HAx 1.0 1.8 6.0 752 585 A 20 ILE H A 21 GLY H 1.0 1.8 3.5 753 586 A 20 ILE HB A 21 GLY H 1.0 1.8 3.5 754 587 A 21 GLY H A 20 ILE HG1x 1.0 1.8 5.0 755 587 A 20 ILE HG1y A 21 GLY H 1.0 1.8 5.0 756 588 A 20 ILE HG2% A 21 GLY H 1.0 1.8 5.0 757 589 A 20 ILE H A 22 GLY H 1.0 1.8 5.0 758 590 A 20 ILE HB A 22 GLY H 1.0 1.8 5.0 759 591 A 20 ILE HD1% A 23 LYS HDx 1.0 1.8 5.0 760 591 A 20 ILE HD1% A 23 LYS HDy 1.0 1.8 5.0 761 592 A 20 ILE HD1% A 23 LYS HGy 1.0 1.8 5.0 762 593 A 20 ILE HD1% A 23 LYS HEx 1.0 1.8 5.0 763 593 A 20 ILE HD1% A 23 LYS HEy 1.0 1.8 5.0 764 594 A 20 ILE HG2% A 23 LYS HDx 1.0 1.8 5.0 765 594 A 20 ILE HG2% A 23 LYS HDy 1.0 1.8 5.0 766 595 A 20 ILE HG2% A 23 LYS HGy 1.0 1.8 5.0 767 596 A 20 ILE HG2% A 23 LYS HEx 1.0 1.8 5.0 768 596 A 20 ILE HG2% A 23 LYS HEy 1.0 1.8 5.0 769 597 A 20 ILE HG2% A 23 LYS HGx 1.0 1.8 5.0 770 598 A 20 ILE H A 23 LYS HGy 1.0 1.8 6.0 771 599 A 20 ILE HA A 23 LYS HDx 1.0 1.8 5.0 772 599 A 20 ILE HA A 23 LYS HDy 1.0 1.8 5.0 773 600 A 23 LYS HGx A 20 ILE HA 1.0 1.8 5.0 774 601 A 23 LYS HGy A 20 ILE HA 1.0 1.8 5.0 775 602 A 23 LYS H A 20 ILE HA 1.0 1.8 5.0 776 603 A 20 ILE H A 23 LYS H 1.0 1.8 6.0 777 604 A 20 ILE HG2% A 24 MET HE% 1.0 1.8 3.5 778 605 A 20 ILE HG2% A 24 MET HBy 1.0 1.8 5.0 779 606 A 20 ILE HG2% A 24 MET HBx 1.0 1.8 5.0 780 607 A 20 ILE HB A 24 MET HBy 1.0 1.8 6.0 781 608 A 20 ILE HA A 24 MET HBy 1.0 1.8 5.0 782 609 A 20 ILE HG2% A 24 MET HGy 1.0 1.8 5.0 783 610 A 20 ILE HG2% A 24 MET HGx 1.0 1.8 5.0 784 611 A 20 ILE HA A 24 MET H 1.0 1.8 5.0 785 612 A 20 ILE HG2% A 24 MET H 1.0 1.8 5.0 786 613 A 20 ILE HG2% A 48 LEU HDy% 1.0 1.8 5.0 787 614 A 74 TRP HZ3 A 20 ILE HG1x 1.0 1.8 5.0 788 614 A 20 ILE HG1y A 74 TRP HZ3 1.0 1.8 5.0 789 615 A 20 ILE HG2% A 74 TRP HZ3 1.0 1.8 5.0 790 616 A 20 ILE HG2% A 74 TRP HH2 1.0 1.8 3.5 791 617 A 20 ILE HD1% A 74 TRP HZ3 1.0 1.8 6.0 792 618 A 20 ILE HD1% A 74 TRP HH2 1.0 1.8 5.0 793 619 A 20 ILE HG2% A 74 TRP HZ2 1.0 1.8 5.0 794 620 A 20 ILE H A 74 TRP HZ3 1.0 1.8 5.0 795 621 A 75 ILE HD1% A 20 ILE HD1% 1.0 1.8 3.5 796 622 A 75 ILE HD1% A 20 ILE HG2% 1.0 1.8 3.5 797 623 A 75 ILE HD1% A 20 ILE HG1x 1.0 1.8 5.0 798 623 A 75 ILE HD1% A 20 ILE HG1y 1.0 1.8 5.0 799 624 A 75 ILE HD1% A 20 ILE HB 1.0 1.8 5.0 800 625 A 20 ILE HG2% A 75 ILE HB 1.0 1.8 6.0 801 626 A 75 ILE HB A 20 ILE HG1x 1.0 1.8 5.0 802 626 A 20 ILE HG1y A 75 ILE HB 1.0 1.8 5.0 803 627 A 75 ILE HA A 20 ILE HG1x 1.0 1.8 5.0 804 627 A 75 ILE HA A 20 ILE HG1y 1.0 1.8 5.0 805 628 A 75 ILE HG1y A 20 ILE HG1x 1.0 1.8 6.0 806 628 A 20 ILE HG1y A 75 ILE HG1y 1.0 1.8 6.0 807 629 A 75 ILE HD1% A 20 ILE H 1.0 1.8 5.0 808 630 A 20 ILE H A 75 ILE HG1y 1.0 1.8 6.0 809 631 A 79 LEU HDy% A 20 ILE HG1x 1.0 1.8 5.0 810 631 A 20 ILE HG1y A 79 LEU HDy% 1.0 1.8 5.0 811 632 A 20 ILE HD1% A 79 LEU HDy% 1.0 1.8 5.0 812 633 A 21 GLY HAy A 22 GLY HAy 1.0 1.8 6.0 813 634 A 21 GLY HAx A 22 GLY H 1.0 1.8 3.5 814 635 A 21 GLY H A 22 GLY H 1.0 1.8 3.5 815 636 A 21 GLY HAx A 23 LYS H 1.0 1.8 6.0 816 637 A 21 GLY H A 23 LYS H 1.0 1.8 5.0 817 638 A 21 GLY HAy A 24 MET HBy 1.0 1.8 5.0 818 639 A 21 GLY HAy A 24 MET HE% 1.0 1.8 5.0 819 640 A 21 GLY HAy A 24 MET HGx 1.0 1.8 5.0 820 641 A 21 GLY HAy A 24 MET H 1.0 1.8 5.0 821 642 A 21 GLY HAy A 24 MET HBx 1.0 1.8 5.0 822 643 A 21 GLY HAx A 24 MET H 1.0 1.8 6.0 823 644 A 21 GLY HAx A 25 ALA H 1.0 1.8 5.0 824 645 A 21 GLY HAy A 25 ALA H 1.0 1.8 5.0 825 646 A 21 GLY HAx A 32 LEU HDx% 1.0 1.8 5.0 826 647 A 44 VAL HGx% A 21 GLY HAy 1.0 1.8 5.0 827 648 A 21 GLY HAx A 44 VAL HGy% 1.0 1.8 5.0 828 649 A 21 GLY HAx A 44 VAL HGx% 1.0 1.8 5.0 829 650 A 21 GLY H A 44 VAL HGx% 1.0 1.8 5.0 830 651 A 21 GLY HAy A 47 PHE HE% 1.0 1.8 5.0 831 652 A 21 GLY H A 47 PHE HE% 1.0 1.8 5.0 832 653 A 21 GLY HAx A 48 LEU HDy% 1.0 1.8 5.0 833 654 A 21 GLY HAy A 48 LEU HDy% 1.0 1.8 5.0 834 655 A 21 GLY HAx A 48 LEU HDx% 1.0 1.8 5.0 835 656 A 21 GLY HAx A 48 LEU HG 1.0 1.8 5.0 836 657 A 21 GLY H A 48 LEU HDx% 1.0 1.8 6.0 837 658 A 21 GLY H A 48 LEU HDy% 1.0 1.8 5.0 838 659 A 21 GLY HAx A 74 TRP HZ3 1.0 1.8 5.0 839 660 A 74 TRP HZ3 A 21 GLY HAy 1.0 1.8 5.0 840 661 A 21 GLY HAy A 74 TRP HZ2 1.0 1.8 5.0 841 662 A 21 GLY HAx A 74 TRP HH2 1.0 1.8 5.0 842 663 A 74 TRP HH2 A 21 GLY HAy 1.0 1.8 5.0 843 664 A 21 GLY HAx A 74 TRP HZ2 1.0 1.8 6.0 844 665 A 21 GLY H A 74 TRP HZ3 1.0 1.8 5.0 845 666 A 21 GLY H A 74 TRP HH2 1.0 1.8 5.0 846 667 A 22 GLY HAx A 23 LYS HA 1.0 1.8 6.0 847 668 A 22 GLY HAy A 23 LYS HA 1.0 1.8 6.0 848 669 A 22 GLY H A 23 LYS H 1.0 1.8 3.5 849 670 A 22 GLY HAx A 23 LYS H 1.0 1.8 5.0 850 671 A 24 MET H A 22 GLY HAy 1.0 1.8 5.0 851 672 A 22 GLY HAx A 24 MET H 1.0 1.8 5.0 852 673 A 22 GLY H A 24 MET H 1.0 1.8 5.0 853 674 A 22 GLY H A 24 MET HBy 1.0 1.8 5.0 854 675 A 22 GLY HAy A 25 ALA HB% 1.0 1.8 5.0 855 676 A 22 GLY HAx A 25 ALA HB% 1.0 1.8 6.0 856 677 A 22 GLY HAy A 25 ALA H 1.0 1.8 5.0 857 678 A 22 GLY HAy A 26 LYS H 1.0 1.8 5.0 858 679 A 32 LEU HDx% A 22 GLY HAx 1.0 1.8 5.0 859 680 A 32 LEU HDx% A 22 GLY HAy 1.0 1.8 5.0 860 681 A 22 GLY HAx A 32 LEU HG 1.0 1.8 6.0 861 682 A 22 GLY HAx A 32 LEU HBy 1.0 1.8 6.0 862 683 A 22 GLY HAy A 32 LEU HBy 1.0 1.8 6.0 863 684 A 22 GLY HAy A 32 LEU HG 1.0 1.8 6.0 864 685 A 22 GLY H A 32 LEU HDx% 1.0 1.8 5.0 865 686 A 44 VAL HGy% A 22 GLY HAy 1.0 1.8 5.0 866 687 A 44 VAL HGy% A 22 GLY HAx 1.0 1.8 5.0 867 688 A 44 VAL HGx% A 22 GLY HAy 1.0 1.8 5.0 868 689 A 44 VAL HGx% A 22 GLY HAx 1.0 1.8 5.0 869 690 A 44 VAL HGy% A 22 GLY H 1.0 1.8 5.0 870 691 A 22 GLY H A 44 VAL HGx% 1.0 1.8 5.0 871 692 A 23 LYS HGx A 23 LYS HA 1.0 1.8 5.0 872 693 A 23 LYS HA A 23 LYS HEx 1.0 1.8 6.0 873 693 A 23 LYS HEy A 23 LYS HA 1.0 1.8 6.0 874 694 A 23 LYS HA A 23 LYS HDx 1.0 1.8 5.0 875 694 A 23 LYS HDy A 23 LYS HA 1.0 1.8 5.0 876 695 A 23 LYS HBy A 23 LYS HDx 1.0 1.8 3.5 877 695 A 23 LYS HBx A 23 LYS HDx 1.0 1.8 3.5 878 695 A 23 LYS HDy A 23 LYS HBx 1.0 1.8 3.5 879 695 A 23 LYS HDy A 23 LYS HBy 1.0 1.8 3.5 880 696 A 23 LYS HBy A 23 LYS HEx 1.0 1.8 5.0 881 696 A 23 LYS HBx A 23 LYS HEx 1.0 1.8 5.0 882 696 A 23 LYS HEy A 23 LYS HBx 1.0 1.8 5.0 883 696 A 23 LYS HEy A 23 LYS HBy 1.0 1.8 5.0 884 697 A 23 LYS HDy A 23 LYS HEx 1.0 1.8 3.5 885 697 A 23 LYS HDx A 23 LYS HEx 1.0 1.8 3.5 886 697 A 23 LYS HEy A 23 LYS HDx 1.0 1.8 3.5 887 697 A 23 LYS HDy A 23 LYS HEy 1.0 1.8 3.5 888 698 A 23 LYS HGx A 23 LYS HEx 1.0 1.8 5.0 889 698 A 23 LYS HGx A 23 LYS HEy 1.0 1.8 5.0 890 699 A 23 LYS HGy A 23 LYS HEx 1.0 1.8 3.5 891 699 A 23 LYS HGy A 23 LYS HEy 1.0 1.8 3.5 892 700 A 23 LYS H A 23 LYS HBx 1.0 1.8 2.7 893 700 A 23 LYS H A 23 LYS HBy 1.0 1.8 2.7 894 701 A 23 LYS H A 23 LYS HDx 1.0 1.8 5.0 895 701 A 23 LYS H A 23 LYS HDy 1.0 1.8 5.0 896 702 A 23 LYS H A 23 LYS HEx 1.0 1.8 5.0 897 702 A 23 LYS H A 23 LYS HEy 1.0 1.8 5.0 898 703 A 23 LYS HGx A 23 LYS H 1.0 1.8 5.0 899 704 A 23 LYS HGy A 23 LYS H 1.0 1.8 5.0 900 705 A 24 MET HA A 23 LYS HDx 1.0 1.8 5.0 901 705 A 23 LYS HDy A 24 MET HA 1.0 1.8 5.0 902 706 A 24 MET H A 23 LYS HDx 1.0 1.8 5.0 903 706 A 23 LYS HDy A 24 MET H 1.0 1.8 5.0 904 707 A 24 MET H A 23 LYS HEx 1.0 1.8 5.0 905 707 A 23 LYS HEy A 24 MET H 1.0 1.8 5.0 906 708 A 24 MET H A 23 LYS HBx 1.0 1.8 3.5 907 708 A 24 MET H A 23 LYS HBy 1.0 1.8 3.5 908 709 A 23 LYS HGx A 24 MET H 1.0 1.8 6.0 909 710 A 23 LYS HGy A 24 MET H 1.0 1.8 5.0 910 711 A 23 LYS H A 24 MET H 1.0 1.8 3.5 911 712 A 23 LYS HA A 26 LYS HDx 1.0 1.8 5.0 912 712 A 23 LYS HA A 26 LYS HDy 1.0 1.8 5.0 913 713 A 23 LYS HA A 26 LYS HGx 1.0 1.8 5.0 914 713 A 23 LYS HA A 26 LYS HGy 1.0 1.8 5.0 915 714 A 23 LYS HA A 26 LYS HBx 1.0 1.8 5.0 916 715 A 23 LYS HA A 26 LYS HBy 1.0 1.8 3.5 917 716 A 23 LYS HBy A 26 LYS HEx 1.0 1.8 5.0 918 716 A 23 LYS HBx A 26 LYS HEx 1.0 1.8 5.0 919 716 A 26 LYS HEy A 23 LYS HBx 1.0 1.8 5.0 920 716 A 23 LYS HBy A 26 LYS HEy 1.0 1.8 5.0 921 717 A 23 LYS HA A 26 LYS HEx 1.0 1.8 5.0 922 717 A 23 LYS HA A 26 LYS HEy 1.0 1.8 5.0 923 718 A 23 LYS HA A 26 LYS H 1.0 1.8 5.0 924 719 A 27 MET HE% A 23 LYS HDx 1.0 1.8 5.0 925 719 A 23 LYS HDy A 27 MET HE% 1.0 1.8 5.0 926 720 A 27 MET HBy A 23 LYS HDx 1.0 1.8 6.0 927 720 A 23 LYS HDy A 27 MET HBy 1.0 1.8 6.0 928 721 A 27 MET HE% A 23 LYS HEx 1.0 1.8 5.0 929 721 A 23 LYS HEy A 27 MET HE% 1.0 1.8 5.0 930 722 A 23 LYS HGx A 27 MET HE% 1.0 1.8 6.0 931 723 A 23 LYS HGy A 27 MET HE% 1.0 1.8 5.0 932 724 A 27 MET H A 23 LYS HBx 1.0 1.8 5.0 933 724 A 23 LYS HBy A 27 MET H 1.0 1.8 5.0 934 725 A 27 MET H A 23 LYS HDx 1.0 1.8 6.0 935 725 A 23 LYS HDy A 27 MET H 1.0 1.8 6.0 936 726 A 23 LYS HA A 27 MET H 1.0 1.8 5.0 937 727 A 24 MET HGx A 24 MET HA 1.0 1.8 5.0 938 728 A 24 MET HE% A 24 MET HBy 1.0 1.8 3.5 939 729 A 24 MET HE% A 24 MET HA 1.0 1.8 5.0 940 730 A 24 MET HE% A 24 MET HGx 1.0 1.8 3.5 941 731 A 24 MET HE% A 24 MET HGy 1.0 1.8 5.0 942 732 A 24 MET HGy A 24 MET HA 1.0 1.8 5.0 943 733 A 24 MET HE% A 24 MET HBx 1.0 1.8 3.5 944 734 A 24 MET HGy A 24 MET H 1.0 1.8 5.0 945 735 A 24 MET HBx A 24 MET H 1.0 1.8 5.0 946 736 A 24 MET HBy A 24 MET H 1.0 1.8 3.5 947 737 A 24 MET HE% A 24 MET H 1.0 1.8 5.0 948 738 A 24 MET HGx A 24 MET H 1.0 1.8 5.0 949 739 A 24 MET HBx A 25 ALA HA 1.0 1.8 5.0 950 740 A 24 MET HBx A 25 ALA HB% 1.0 1.8 5.0 951 741 A 24 MET H A 25 ALA HB% 1.0 1.8 5.0 952 742 A 24 MET HE% A 25 ALA H 1.0 1.8 5.0 953 743 A 24 MET HBx A 25 ALA H 1.0 1.8 3.5 954 744 A 24 MET HBy A 25 ALA H 1.0 1.8 5.0 955 745 A 24 MET HGx A 25 ALA H 1.0 1.8 5.0 956 746 A 24 MET HGy A 25 ALA H 1.0 1.8 5.0 957 747 A 24 MET H A 25 ALA H 1.0 1.8 3.5 958 748 A 26 LYS H A 24 MET HA 1.0 1.8 5.0 959 749 A 24 MET H A 26 LYS H 1.0 1.8 5.0 960 750 A 24 MET HA A 27 MET HBx 1.0 1.8 6.0 961 751 A 24 MET HA A 27 MET HE% 1.0 1.8 5.0 962 752 A 24 MET HA A 27 MET HGx 1.0 1.8 5.0 963 753 A 24 MET HA A 27 MET HBy 1.0 1.8 5.0 964 754 A 24 MET HBx A 27 MET HE% 1.0 1.8 6.0 965 755 A 24 MET HGy A 27 MET HE% 1.0 1.8 6.0 966 756 A 24 MET HA A 27 MET H 1.0 1.8 5.0 967 757 A 24 MET H A 27 MET HE% 1.0 1.8 5.0 968 758 A 24 MET HE% A 28 GLN HGx 1.0 1.8 5.0 969 759 A 24 MET HBx A 28 GLN HGx 1.0 1.8 5.0 970 760 A 24 MET HBx A 28 GLN HGy 1.0 1.8 5.0 971 761 A 24 MET HA A 28 GLN H 1.0 1.8 5.0 972 762 A 44 VAL HGx% A 24 MET HBy 1.0 1.8 6.0 973 763 A 24 MET HE% A 47 PHE HZ 1.0 1.8 5.0 974 764 A 24 MET HE% A 47 PHE HE% 1.0 1.8 5.0 975 765 A 24 MET HE% A 47 PHE HD% 1.0 1.8 5.0 976 766 A 24 MET HBy A 47 PHE HE% 1.0 1.8 5.0 977 767 A 24 MET HBy A 47 PHE HD% 1.0 1.8 6.0 978 768 A 24 MET HGy A 47 PHE HZ 1.0 1.8 6.0 979 769 A 24 MET HBx A 47 PHE HE% 1.0 1.8 5.0 980 770 A 24 MET HBx A 47 PHE HZ 1.0 1.8 5.0 981 771 A 24 MET HGx A 47 PHE HZ 1.0 1.8 5.0 982 772 A 24 MET HA A 47 PHE HZ 1.0 1.8 5.0 983 773 A 24 MET H A 47 PHE HZ 1.0 1.8 6.0 984 774 A 24 MET HBy A 47 PHE HZ 1.0 1.8 5.0 985 775 A 24 MET HE% A 48 LEU HDy% 1.0 1.8 3.5 986 776 A 24 MET HE% A 48 LEU HA 1.0 1.8 5.0 987 777 A 24 MET HE% A 48 LEU HDx% 1.0 1.8 5.0 988 778 A 24 MET HE% A 51 ALA HB% 1.0 1.8 5.0 989 779 A 24 MET HBx A 51 ALA HB% 1.0 1.8 6.0 990 780 A 24 MET HE% A 53 GLN HGx 1.0 1.8 3.5 991 781 A 24 MET HE% A 53 GLN HE2y 1.0 1.8 5.0 992 782 A 24 MET HBx A 53 GLN HGx 1.0 1.8 6.0 993 783 A 24 MET HE% A 53 GLN HBy 1.0 1.8 5.0 994 784 A 24 MET HE% A 53 GLN HGy 1.0 1.8 5.0 995 785 A 24 MET HE% A 53 GLN HE2x 1.0 1.8 5.0 996 786 A 24 MET HE% A 74 TRP HZ2 1.0 1.8 3.5 997 787 A 24 MET HE% A 74 TRP HE1 1.0 1.8 5.0 998 788 A 25 ALA H A 25 ALA HB% 1.0 1.8 3.5 999 789 A 25 ALA HB% A 26 LYS HBy 1.0 1.8 5.0 1000 790 A 25 ALA HB% A 26 LYS HA 1.0 1.8 5.0 1001 791 A 25 ALA HB% A 26 LYS HBx 1.0 1.8 6.0 1002 792 A 25 ALA HB% A 26 LYS H 1.0 1.8 3.5 1003 793 A 25 ALA H A 26 LYS H 1.0 1.8 3.5 1004 794 A 25 ALA HB% A 27 MET H 1.0 1.8 5.0 1005 795 A 27 MET H A 25 ALA HA 1.0 1.8 5.0 1006 796 A 25 ALA H A 27 MET H 1.0 1.8 5.0 1007 797 A 25 ALA HA A 28 GLN HBx 1.0 1.8 5.0 1008 798 A 25 ALA HA A 28 GLN HBy 1.0 1.8 5.0 1009 799 A 25 ALA HA A 28 GLN HGx 1.0 1.8 5.0 1010 800 A 25 ALA HA A 28 GLN H 1.0 1.8 5.0 1011 801 A 25 ALA H A 28 GLN H 1.0 1.8 5.0 1012 802 A 25 ALA HA A 30 PHE HBy 1.0 1.8 6.0 1013 803 A 25 ALA HA A 30 PHE HE% 1.0 1.8 6.0 1014 804 A 25 ALA HB% A 30 PHE HBy 1.0 1.8 5.0 1015 805 A 25 ALA HB% A 30 PHE HD% 1.0 1.8 5.0 1016 806 A 25 ALA HB% A 30 PHE HE% 1.0 1.8 5.0 1017 807 A 25 ALA HA A 30 PHE HD% 1.0 1.8 5.0 1018 808 A 25 ALA HB% A 30 PHE HBx 1.0 1.8 5.0 1019 809 A 25 ALA HB% A 30 PHE HA 1.0 1.8 5.0 1020 810 A 25 ALA HB% A 30 PHE H 1.0 1.8 5.0 1021 811 A 25 ALA HA A 30 PHE H 1.0 1.8 6.0 1022 812 A 25 ALA HB% A 32 LEU HDy% 1.0 1.8 3.5 1023 813 A 25 ALA HB% A 32 LEU HG 1.0 1.8 5.0 1024 814 A 25 ALA HB% A 32 LEU H 1.0 1.8 5.0 1025 815 A 25 ALA HB% A 47 PHE HA 1.0 1.8 6.0 1026 816 A 47 PHE HE% A 25 ALA HA 1.0 1.8 5.0 1027 817 A 25 ALA HA A 47 PHE HZ 1.0 1.8 5.0 1028 818 A 25 ALA HB% A 47 PHE HBx 1.0 1.8 5.0 1029 819 A 25 ALA HB% A 47 PHE HD% 1.0 1.8 5.0 1030 820 A 47 PHE HE% A 25 ALA HB% 1.0 1.8 5.0 1031 821 A 25 ALA HB% A 47 PHE HBy 1.0 1.8 5.0 1032 822 A 25 ALA HB% A 47 PHE HZ 1.0 1.8 5.0 1033 823 A 25 ALA H A 47 PHE HZ 1.0 1.8 5.0 1034 824 A 25 ALA H A 47 PHE HE% 1.0 1.8 5.0 1035 825 A 25 ALA H A 47 PHE HD% 1.0 1.8 5.0 1036 826 A 48 LEU HDy% A 25 ALA HB% 1.0 1.8 5.0 1037 827 A 48 LEU HDy% A 25 ALA H 1.0 1.8 6.0 1038 828 A 25 ALA HB% A 48 LEU H 1.0 1.8 6.0 1039 829 A 26 LYS HA A 26 LYS HGx 1.0 1.8 3.5 1040 829 A 26 LYS HGy A 26 LYS HA 1.0 1.8 3.5 1041 830 A 26 LYS HA A 26 LYS HDx 1.0 1.8 5.0 1042 830 A 26 LYS HDy A 26 LYS HA 1.0 1.8 5.0 1043 831 A 26 LYS HBx A 26 LYS HDx 1.0 1.8 3.5 1044 831 A 26 LYS HDy A 26 LYS HBx 1.0 1.8 3.5 1045 832 A 26 LYS HBy A 26 LYS HDx 1.0 1.8 3.5 1046 832 A 26 LYS HDy A 26 LYS HBy 1.0 1.8 3.5 1047 833 A 26 LYS HA A 26 LYS HEx 1.0 1.8 5.0 1048 833 A 26 LYS HEy A 26 LYS HA 1.0 1.8 5.0 1049 834 A 26 LYS HBx A 26 LYS HEx 1.0 1.8 5.0 1050 834 A 26 LYS HBx A 26 LYS HEy 1.0 1.8 5.0 1051 835 A 26 LYS HBy A 26 LYS HEx 1.0 1.8 5.0 1052 835 A 26 LYS HBy A 26 LYS HEy 1.0 1.8 5.0 1053 836 A 26 LYS HEx A 26 LYS HGx 1.0 1.8 3.5 1054 836 A 26 LYS HEy A 26 LYS HGx 1.0 1.8 3.5 1055 836 A 26 LYS HGy A 26 LYS HEx 1.0 1.8 3.5 1056 836 A 26 LYS HGy A 26 LYS HEy 1.0 1.8 3.5 1057 837 A 26 LYS H A 26 LYS HEx 1.0 1.8 5.0 1058 837 A 26 LYS H A 26 LYS HEy 1.0 1.8 5.0 1059 838 A 26 LYS HDy A 26 LYS HGx 1.0 1.8 2.7 1060 838 A 26 LYS HDx A 26 LYS HGx 1.0 1.8 2.7 1061 838 A 26 LYS HGy A 26 LYS HDx 1.0 1.8 2.7 1062 838 A 26 LYS HDy A 26 LYS HGy 1.0 1.8 2.7 1063 839 A 26 LYS H A 26 LYS HGx 1.0 1.8 5.0 1064 839 A 26 LYS H A 26 LYS HGy 1.0 1.8 5.0 1065 840 A 26 LYS H A 26 LYS HBx 1.0 1.8 3.5 1066 841 A 26 LYS H A 26 LYS HBy 1.0 1.8 3.5 1067 842 A 26 LYS H A 26 LYS HDx 1.0 1.8 5.0 1068 842 A 26 LYS H A 26 LYS HDy 1.0 1.8 5.0 1069 843 A 27 MET H A 26 LYS HEx 1.0 1.8 5.0 1070 843 A 26 LYS HEy A 27 MET H 1.0 1.8 5.0 1071 844 A 27 MET H A 26 LYS HGx 1.0 1.8 5.0 1072 844 A 26 LYS HGy A 27 MET H 1.0 1.8 5.0 1073 845 A 26 LYS HBx A 27 MET H 1.0 1.8 3.5 1074 846 A 26 LYS HBy A 27 MET H 1.0 1.8 5.0 1075 847 A 27 MET H A 26 LYS HDx 1.0 1.8 5.0 1076 847 A 26 LYS HDy A 27 MET H 1.0 1.8 5.0 1077 848 A 26 LYS H A 28 GLN H 1.0 1.8 5.0 1078 849 A 26 LYS HBx A 28 GLN H 1.0 1.8 5.0 1079 850 A 28 GLN H A 26 LYS HA 1.0 1.8 5.0 1080 851 A 26 LYS H A 28 GLN HBy 1.0 1.8 6.0 1081 852 A 29 GLY H A 26 LYS HGx 1.0 1.8 5.0 1082 852 A 26 LYS HGy A 29 GLY H 1.0 1.8 5.0 1083 853 A 26 LYS HA A 29 GLY H 1.0 1.8 5.0 1084 854 A 26 LYS HA A 30 PHE HBx 1.0 1.8 5.0 1085 855 A 26 LYS HA A 30 PHE HBy 1.0 1.8 5.0 1086 856 A 26 LYS HA A 30 PHE H 1.0 1.8 3.5 1087 857 A 30 PHE H A 26 LYS HGx 1.0 1.8 5.0 1088 857 A 26 LYS HGy A 30 PHE H 1.0 1.8 5.0 1089 858 A 26 LYS H A 30 PHE HBy 1.0 1.8 5.0 1090 859 A 26 LYS HBy A 30 PHE H 1.0 1.8 5.0 1091 860 A 27 MET HE% A 27 MET HA 1.0 1.8 6.0 1092 861 A 27 MET HE% A 27 MET HBx 1.0 1.8 5.0 1093 862 A 27 MET HE% A 27 MET HBy 1.0 1.8 3.5 1094 863 A 27 MET HE% A 27 MET HGx 1.0 1.8 5.0 1095 864 A 27 MET HE% A 27 MET HGy 1.0 1.8 5.0 1096 865 A 27 MET HE% A 27 MET H 1.0 1.8 5.0 1097 866 A 27 MET HGx A 27 MET HA 1.0 1.8 5.0 1098 867 A 27 MET HA A 27 MET HGy 1.0 1.8 5.0 1099 868 A 27 MET H A 27 MET HBx 1.0 1.8 5.0 1100 869 A 27 MET HBy A 27 MET H 1.0 1.8 3.5 1101 870 A 27 MET H A 27 MET HGx 1.0 1.8 3.5 1102 871 A 27 MET H A 27 MET HGy 1.0 1.8 3.5 1103 872 A 27 MET HBy A 28 GLN HBy 1.0 1.8 5.0 1104 873 A 27 MET HBy A 28 GLN HGy 1.0 1.8 5.0 1105 874 A 27 MET HBx A 28 GLN H 1.0 1.8 5.0 1106 875 A 27 MET HBy A 28 GLN H 1.0 1.8 5.0 1107 876 A 27 MET HGx A 28 GLN H 1.0 1.8 5.0 1108 877 A 27 MET H A 28 GLN H 1.0 1.8 3.5 1109 878 A 27 MET H A 29 GLY H 1.0 1.8 5.0 1110 879 A 29 GLY H A 27 MET HA 1.0 1.8 5.0 1111 880 A 27 MET HBy A 29 GLY H 1.0 1.8 5.0 1112 881 A 28 GLN HGy A 28 GLN HA 1.0 1.8 5.0 1113 882 A 28 GLN HGx A 28 GLN HA 1.0 1.8 5.0 1114 883 A 28 GLN H A 28 GLN HBx 1.0 1.8 5.0 1115 884 A 28 GLN H A 28 GLN HBy 1.0 1.8 3.5 1116 885 A 28 GLN HGx A 28 GLN H 1.0 1.8 5.0 1117 886 A 28 GLN HGy A 28 GLN H 1.0 1.8 3.5 1118 887 A 28 GLN HA A 28 GLN HE2x 1.0 1.8 5.0 1119 888 A 28 GLN HBy A 28 GLN HE2y 1.0 1.8 5.0 1120 889 A 28 GLN HBx A 29 GLY H 1.0 1.8 5.0 1121 890 A 28 GLN HBy A 29 GLY H 1.0 1.8 5.0 1122 891 A 28 GLN HGy A 29 GLY H 1.0 1.8 5.0 1123 892 A 28 GLN H A 29 GLY H 1.0 1.8 3.5 1124 893 A 28 GLN HBy A 30 PHE HD% 1.0 1.8 5.0 1125 894 A 28 GLN HBx A 30 PHE HD% 1.0 1.8 5.0 1126 895 A 30 PHE HD% A 28 GLN HA 1.0 1.8 6.0 1127 896 A 28 GLN HBx A 30 PHE H 1.0 1.8 6.0 1128 897 A 28 GLN HBx A 30 PHE HE% 1.0 1.8 5.0 1129 898 A 47 PHE HE% A 28 GLN HBx 1.0 1.8 5.0 1130 899 A 47 PHE HE% A 28 GLN HGy 1.0 1.8 5.0 1131 900 A 47 PHE HE% A 28 GLN HBy 1.0 1.8 5.0 1132 901 A 28 GLN HGx A 47 PHE HZ 1.0 1.8 5.0 1133 902 A 47 PHE HE% A 28 GLN HGx 1.0 1.8 5.0 1134 903 A 28 GLN HGy A 47 PHE HZ 1.0 1.8 5.0 1135 904 A 47 PHE HE% A 28 GLN H 1.0 1.8 6.0 1136 905 A 30 PHE HBx A 29 GLY H 1.0 1.8 6.0 1137 906 A 30 PHE HD% A 29 GLY H 1.0 1.8 5.0 1138 907 A 30 PHE HBy A 29 GLY H 1.0 1.8 5.0 1139 908 A 30 PHE H A 29 GLY HAy 1.0 1.8 3.5 1140 909 A 30 PHE H A 29 GLY H 1.0 1.8 3.5 1141 910 A 30 PHE HD% A 30 PHE HA 1.0 1.8 5.0 1142 911 A 30 PHE HE% A 30 PHE HA 1.0 1.8 5.0 1143 912 A 30 PHE HBy A 30 PHE H 1.0 1.8 3.5 1144 913 A 30 PHE HD% A 30 PHE H 1.0 1.8 5.0 1145 914 A 30 PHE H A 31 ASP HBx 1.0 1.8 6.0 1146 914 A 30 PHE H A 31 ASP HBy 1.0 1.8 6.0 1147 915 A 30 PHE HA A 31 ASP HBx 1.0 1.8 5.0 1148 915 A 30 PHE HA A 31 ASP HBy 1.0 1.8 5.0 1149 916 A 30 PHE HBy A 32 LEU HDy% 1.0 1.8 5.0 1150 917 A 30 PHE HBx A 32 LEU HDy% 1.0 1.8 5.0 1151 918 A 30 PHE HD% A 32 LEU HDy% 1.0 1.8 5.0 1152 919 A 32 LEU HG A 30 PHE HBx 1.0 1.8 5.0 1153 920 A 30 PHE HBy A 32 LEU H 1.0 1.8 5.0 1154 921 A 47 PHE HD% A 30 PHE HD% 1.0 1.8 5.0 1155 922 A 47 PHE HE% A 30 PHE HE% 1.0 1.8 5.0 1156 923 A 47 PHE HE% A 30 PHE HD% 1.0 1.8 5.0 1157 924 A 32 LEU H A 31 ASP HBx 1.0 1.8 5.0 1158 925 A 32 LEU H A 31 ASP HA 1.0 1.8 3.5 1159 926 A 32 LEU H A 31 ASP HBy 1.0 1.8 5.0 1160 927 A 32 LEU H A 31 ASP HBx 1.0 1.8 5.0 1161 927 A 32 LEU H A 31 ASP HBy 1.0 1.8 5.0 1162 928 A 32 LEU HBy A 32 LEU HDy% 1.0 1.8 5.0 1163 929 A 32 LEU HDx% A 32 LEU HA 1.0 1.8 5.0 1164 930 A 32 LEU HDx% A 32 LEU HBx 1.0 1.8 5.0 1165 931 A 32 LEU HDx% A 32 LEU HBy 1.0 1.8 3.5 1166 932 A 32 LEU HDy% A 32 LEU HA 1.0 1.8 3.5 1167 933 A 32 LEU HDy% A 32 LEU HBx 1.0 1.8 5.0 1168 934 A 32 LEU H A 32 LEU HBx 1.0 1.8 5.0 1169 935 A 32 LEU HG A 32 LEU H 1.0 1.8 3.5 1170 936 A 32 LEU HDx% A 32 LEU H 1.0 1.8 5.0 1171 937 A 32 LEU HDy% A 32 LEU H 1.0 1.8 5.0 1172 938 A 32 LEU HA A 33 PRO HDy 1.0 1.8 3.5 1173 939 A 32 LEU HDy% A 33 PRO HDy 1.0 1.8 5.0 1174 940 A 32 LEU HDy% A 33 PRO HDx 1.0 1.8 5.0 1175 941 A 32 LEU HDx% A 33 PRO HDy 1.0 1.8 5.0 1176 942 A 32 LEU HBx A 33 PRO HDx 1.0 1.8 5.0 1177 943 A 32 LEU HBx A 33 PRO HDy 1.0 1.8 5.0 1178 944 A 32 LEU HBy A 33 PRO HDy 1.0 1.8 5.0 1179 945 A 32 LEU HDx% A 33 PRO HDx 1.0 1.8 6.0 1180 946 A 32 LEU HA A 33 PRO HDx 1.0 1.8 3.5 1181 947 A 32 LEU H A 33 PRO HDx 1.0 1.8 6.0 1182 948 A 32 LEU HDx% A 40 ARG HA 1.0 1.8 5.0 1183 949 A 32 LEU HDx% A 40 ARG HBx 1.0 1.8 5.0 1184 950 A 32 LEU HDx% A 43 ALA HB% 1.0 1.8 5.0 1185 951 A 32 LEU HDy% A 43 ALA HB% 1.0 1.8 3.5 1186 952 A 32 LEU HBx A 43 ALA HB% 1.0 1.8 5.0 1187 953 A 32 LEU HA A 43 ALA HB% 1.0 1.8 5.0 1188 954 A 32 LEU HDy% A 43 ALA HA 1.0 1.8 5.0 1189 955 A 32 LEU HBy A 43 ALA HB% 1.0 1.8 5.0 1190 956 A 32 LEU HG A 43 ALA HB% 1.0 1.8 5.0 1191 957 A 32 LEU HDy% A 43 ALA H 1.0 1.8 6.0 1192 958 A 44 VAL HGy% A 32 LEU HDy% 1.0 1.8 5.0 1193 959 A 32 LEU HDy% A 44 VAL HA 1.0 1.8 5.0 1194 960 A 32 LEU HDx% A 44 VAL HA 1.0 1.8 5.0 1195 961 A 44 VAL HGy% A 32 LEU HDx% 1.0 1.8 3.5 1196 962 A 44 VAL HGy% A 32 LEU HBx 1.0 1.8 5.0 1197 963 A 32 LEU HDx% A 44 VAL HGx% 1.0 1.8 5.0 1198 964 A 44 VAL HGy% A 32 LEU HBy 1.0 1.8 5.0 1199 965 A 44 VAL HGy% A 32 LEU HG 1.0 1.8 6.0 1200 966 A 32 LEU HDx% A 44 VAL H 1.0 1.8 5.0 1201 967 A 44 VAL H A 32 LEU HDy% 1.0 1.8 5.0 1202 968 A 32 LEU HDy% A 47 PHE HBx 1.0 1.8 5.0 1203 969 A 32 LEU HDy% A 47 PHE HBy 1.0 1.8 5.0 1204 970 A 32 LEU HDx% A 47 PHE HBx 1.0 1.8 5.0 1205 971 A 32 LEU HDx% A 47 PHE HBy 1.0 1.8 5.0 1206 972 A 32 LEU HDy% A 47 PHE HA 1.0 1.8 6.0 1207 973 A 47 PHE HD% A 32 LEU HDy% 1.0 1.8 5.0 1208 974 A 32 LEU HDx% A 47 PHE H 1.0 1.8 5.0 1209 975 A 32 LEU HDy% A 47 PHE H 1.0 1.8 5.0 1210 976 A 33 PRO HDy A 43 ALA HB% 1.0 1.8 3.5 1211 977 A 33 PRO HDx A 43 ALA HB% 1.0 1.8 5.0 1212 978 A 33 PRO HDy A 43 ALA H 1.0 1.8 6.0 1213 979 A 34 GLN HA A 34 GLN HGy 1.0 1.8 5.0 1214 980 A 34 GLN HA A 34 GLN HGx 1.0 1.8 5.0 1215 981 A 34 GLN HA A 34 GLN HGx 1.0 1.8 5.0 1216 981 A 34 GLN HA A 34 GLN HGy 1.0 1.8 5.0 1217 982 A 34 GLN HA A 34 GLN HE2x 1.0 1.8 5.0 1218 982 A 34 GLN HA A 34 GLN HE2y 1.0 1.8 5.0 1219 983 A 34 GLN HBx A 35 SER H 1.0 1.8 5.0 1220 984 A 35 SER H A 34 GLN HBy 1.0 1.8 5.0 1221 985 A 35 SER H A 34 GLN HGx 1.0 1.8 6.0 1222 986 A 34 GLN HGy A 35 SER H 1.0 1.8 5.0 1223 987 A 35 SER H A 34 GLN HGx 1.0 1.8 5.0 1224 987 A 34 GLN HGy A 35 SER H 1.0 1.8 5.0 1225 988 A 40 ARG HDy A 34 GLN HA 1.0 1.8 5.0 1226 989 A 34 GLN HA A 40 ARG HDx 1.0 1.8 5.0 1227 990 A 34 GLN HA A 40 ARG HGx 1.0 1.8 5.0 1228 991 A 34 GLN HA A 40 ARG HBy 1.0 1.8 6.0 1229 992 A 40 ARG HBx A 34 GLN HA 1.0 1.8 6.0 1230 993 A 34 GLN HA A 40 ARG HDx 1.0 1.8 5.0 1231 993 A 40 ARG HDy A 34 GLN HA 1.0 1.8 5.0 1232 994 A 35 SER H A 35 SER HBx 1.0 1.8 5.0 1233 995 A 35 SER H A 35 SER HBy 1.0 1.8 5.0 1234 996 A 35 SER H A 35 SER HBy 1.0 1.8 3.5 1235 996 A 35 SER H A 35 SER HBx 1.0 1.8 3.5 1236 997 A 35 SER HBx A 36 PRO HA 1.0 1.8 6.0 1237 998 A 36 PRO HA A 35 SER HBy 1.0 1.8 6.0 1238 999 A 36 PRO HA A 35 SER HA 1.0 1.8 6.0 1239 1000 A 36 PRO HA A 35 SER HBy 1.0 1.8 6.0 1240 1000 A 35 SER HBx A 36 PRO HA 1.0 1.8 6.0 1241 1001 A 35 SER H A 40 ARG HGx 1.0 1.8 6.0 1242 1002 A 35 SER HA A 40 ARG HDx 1.0 1.8 6.0 1243 1002 A 40 ARG HDy A 35 SER HA 1.0 1.8 6.0 1244 1003 A 36 PRO HBy A 38 PRO HDy 1.0 1.8 5.0 1245 1004 A 36 PRO HA A 38 PRO HDy 1.0 1.8 5.0 1246 1005 A 36 PRO HBy A 38 PRO HDx 1.0 1.8 5.0 1247 1006 A 36 PRO HGx A 38 PRO HGx 1.0 1.8 6.0 1248 1006 A 36 PRO HGx A 38 PRO HGy 1.0 1.8 6.0 1249 1007 A 39 VAL HGy% A 36 PRO HDx 1.0 1.8 3.5 1250 1007 A 36 PRO HDy A 39 VAL HGy% 1.0 1.8 3.5 1251 1008 A 39 VAL HGx% A 36 PRO HDx 1.0 1.8 5.0 1252 1008 A 36 PRO HDy A 39 VAL HGx% 1.0 1.8 5.0 1253 1009 A 39 VAL HB A 36 PRO HDx 1.0 1.8 5.0 1254 1009 A 36 PRO HDy A 39 VAL HB 1.0 1.8 5.0 1255 1010 A 36 PRO HGx A 39 VAL HGy% 1.0 1.8 5.0 1256 1011 A 39 VAL HB A 36 PRO HGy 1.0 1.8 6.0 1257 1012 A 39 VAL HGy% A 36 PRO HGy 1.0 1.8 5.0 1258 1013 A 36 PRO HBy A 39 VAL HGy% 1.0 1.8 5.0 1259 1014 A 36 PRO HGx A 39 VAL HGx% 1.0 1.8 5.0 1260 1015 A 36 PRO HBy A 39 VAL HGx% 1.0 1.8 5.0 1261 1016 A 39 VAL HGx% A 36 PRO HGy 1.0 1.8 5.0 1262 1017 A 39 VAL HGy% A 36 PRO HBx 1.0 1.8 6.0 1263 1018 A 36 PRO HGy A 39 VAL H 1.0 1.8 5.0 1264 1019 A 38 PRO HDx A 39 VAL H 1.0 1.8 5.0 1265 1020 A 38 PRO HDy A 39 VAL H 1.0 1.8 5.0 1266 1021 A 38 PRO HGy A 39 VAL H 1.0 1.8 5.0 1267 1022 A 39 VAL H A 38 PRO HGx 1.0 1.8 5.0 1268 1022 A 38 PRO HGy A 39 VAL H 1.0 1.8 5.0 1269 1023 A 38 PRO HA A 40 ARG H 1.0 1.8 5.0 1270 1024 A 41 VAL HGy% A 38 PRO HA 1.0 1.8 5.0 1271 1025 A 41 VAL HB A 38 PRO HA 1.0 1.8 5.0 1272 1026 A 39 VAL HGy% A 39 VAL HA 1.0 1.8 3.5 1273 1027 A 39 VAL HGx% A 39 VAL HA 1.0 1.8 3.5 1274 1028 A 39 VAL HB A 39 VAL H 1.0 1.8 5.0 1275 1029 A 39 VAL HGy% A 39 VAL H 1.0 1.8 3.5 1276 1030 A 39 VAL HGx% A 39 VAL H 1.0 1.8 5.0 1277 1031 A 40 ARG HGx A 39 VAL HGy% 1.0 1.8 5.0 1278 1032 A 39 VAL HGy% A 40 ARG HGy 1.0 1.8 5.0 1279 1033 A 40 ARG HBy A 39 VAL HGy% 1.0 1.8 6.0 1280 1034 A 40 ARG HA A 39 VAL HGy% 1.0 1.8 5.0 1281 1035 A 39 VAL HB A 40 ARG H 1.0 1.8 5.0 1282 1036 A 40 ARG HBy A 39 VAL H 1.0 1.8 5.0 1283 1037 A 40 ARG HGx A 39 VAL H 1.0 1.8 6.0 1284 1038 A 39 VAL HGy% A 40 ARG H 1.0 1.8 5.0 1285 1039 A 39 VAL H A 40 ARG H 1.0 1.8 3.5 1286 1040 A 39 VAL HGy% A 40 ARG HDx 1.0 1.8 5.0 1287 1040 A 40 ARG HDy A 39 VAL HGy% 1.0 1.8 5.0 1288 1041 A 41 VAL H A 39 VAL H 1.0 1.8 5.0 1289 1042 A 39 VAL HA A 42 LYS HBy 1.0 1.8 5.0 1290 1043 A 39 VAL HA A 42 LYS HBx 1.0 1.8 5.0 1291 1044 A 39 VAL HGx% A 42 LYS HBy 1.0 1.8 6.0 1292 1045 A 39 VAL HA A 42 LYS H 1.0 1.8 5.0 1293 1046 A 39 VAL H A 42 LYS H 1.0 1.8 6.0 1294 1047 A 43 ALA HB% A 39 VAL HB 1.0 1.8 5.0 1295 1048 A 43 ALA H A 39 VAL HB 1.0 1.8 5.0 1296 1049 A 40 ARG HA A 40 ARG HGy 1.0 1.8 5.0 1297 1050 A 40 ARG HA A 40 ARG HDx 1.0 1.8 5.0 1298 1051 A 40 ARG HDy A 40 ARG HA 1.0 1.8 5.0 1299 1052 A 40 ARG H A 40 ARG HDx 1.0 1.8 5.0 1300 1053 A 40 ARG HBx A 40 ARG H 1.0 1.8 5.0 1301 1054 A 40 ARG HBy A 40 ARG H 1.0 1.8 3.5 1302 1055 A 40 ARG HGx A 40 ARG H 1.0 1.8 5.0 1303 1056 A 40 ARG HDy A 40 ARG H 1.0 1.8 5.0 1304 1057 A 40 ARG H A 40 ARG HGy 1.0 1.8 5.0 1305 1058 A 40 ARG HA A 40 ARG HDx 1.0 1.8 5.0 1306 1058 A 40 ARG HDy A 40 ARG HA 1.0 1.8 5.0 1307 1059 A 40 ARG HBy A 40 ARG HDx 1.0 1.8 5.0 1308 1059 A 40 ARG HDy A 40 ARG HBy 1.0 1.8 5.0 1309 1060 A 41 VAL HGy% A 40 ARG HBy 1.0 1.8 5.0 1310 1061 A 41 VAL HGy% A 40 ARG HA 1.0 1.8 6.0 1311 1062 A 41 VAL H A 40 ARG HGy 1.0 1.8 6.0 1312 1063 A 41 VAL H A 40 ARG H 1.0 1.8 3.5 1313 1064 A 41 VAL H A 40 ARG HBy 1.0 1.8 5.0 1314 1065 A 41 VAL H A 40 ARG HBx 1.0 1.8 5.0 1315 1066 A 41 VAL H A 40 ARG HDx 1.0 1.8 5.0 1316 1066 A 41 VAL H A 40 ARG HDy 1.0 1.8 5.0 1317 1067 A 41 VAL HGy% A 40 ARG HDx 1.0 1.8 6.0 1318 1067 A 41 VAL HGy% A 40 ARG HDy 1.0 1.8 6.0 1319 1068 A 40 ARG H A 42 LYS H 1.0 1.8 5.0 1320 1069 A 40 ARG HA A 43 ALA HB% 1.0 1.8 5.0 1321 1070 A 43 ALA HB% A 40 ARG HGy 1.0 1.8 5.0 1322 1071 A 40 ARG HBx A 43 ALA HB% 1.0 1.8 6.0 1323 1072 A 43 ALA H A 40 ARG H 1.0 1.8 5.0 1324 1073 A 40 ARG HA A 43 ALA H 1.0 1.8 5.0 1325 1074 A 44 VAL HGy% A 40 ARG HBx 1.0 1.8 6.0 1326 1075 A 44 VAL HGy% A 40 ARG HGy 1.0 1.8 6.0 1327 1076 A 44 VAL HGy% A 40 ARG HA 1.0 1.8 5.0 1328 1077 A 44 VAL H A 40 ARG HA 1.0 1.8 5.0 1329 1078 A 41 VAL HGx% A 41 VAL HA 1.0 1.8 3.5 1330 1079 A 41 VAL HGy% A 41 VAL HA 1.0 1.8 3.5 1331 1080 A 41 VAL H A 41 VAL HGx% 1.0 1.8 5.0 1332 1081 A 41 VAL HB A 41 VAL H 1.0 1.8 3.5 1333 1082 A 41 VAL H A 41 VAL HGy% 1.0 1.8 3.5 1334 1083 A 41 VAL HGx% A 42 LYS HA 1.0 1.8 5.0 1335 1084 A 41 VAL HGy% A 42 LYS H 1.0 1.8 5.0 1336 1085 A 41 VAL H A 42 LYS HBy 1.0 1.8 6.0 1337 1086 A 41 VAL H A 42 LYS H 1.0 1.8 3.5 1338 1087 A 41 VAL HB A 42 LYS H 1.0 1.8 3.5 1339 1088 A 41 VAL HGx% A 42 LYS H 1.0 1.8 3.5 1340 1089 A 41 VAL HA A 43 ALA H 1.0 1.8 5.0 1341 1090 A 41 VAL H A 43 ALA HB% 1.0 1.8 6.0 1342 1091 A 41 VAL H A 43 ALA H 1.0 1.8 5.0 1343 1092 A 41 VAL HGx% A 43 ALA H 1.0 1.8 6.0 1344 1093 A 41 VAL HA A 44 VAL HB 1.0 1.8 5.0 1345 1094 A 44 VAL HGy% A 41 VAL HA 1.0 1.8 3.5 1346 1095 A 41 VAL H A 44 VAL H 1.0 1.8 5.0 1347 1096 A 41 VAL HGx% A 45 TYR HBx 1.0 1.8 5.0 1348 1097 A 41 VAL HGx% A 45 TYR HBy 1.0 1.8 5.0 1349 1098 A 41 VAL HGx% A 45 TYR HD% 1.0 1.8 6.0 1350 1099 A 41 VAL HGx% A 67 ILE HG2% 1.0 1.8 3.5 1351 1100 A 41 VAL HGy% A 67 ILE HG2% 1.0 1.8 5.0 1352 1101 A 41 VAL HB A 67 ILE HG2% 1.0 1.8 5.0 1353 1102 A 41 VAL HGx% A 67 ILE HB 1.0 1.8 5.0 1354 1103 A 41 VAL HGx% A 67 ILE H 1.0 1.8 6.0 1355 1104 A 41 VAL HGx% A 68 LYS HA 1.0 1.8 5.0 1356 1105 A 41 VAL HGx% A 68 LYS HDx 1.0 1.8 5.0 1357 1105 A 41 VAL HGx% A 68 LYS HDy 1.0 1.8 5.0 1358 1106 A 68 LYS HGx A 41 VAL HGx% 1.0 1.8 5.0 1359 1107 A 68 LYS HGx A 41 VAL HGy% 1.0 1.8 5.0 1360 1108 A 41 VAL HGy% A 68 LYS HDx 1.0 1.8 5.0 1361 1108 A 41 VAL HGy% A 68 LYS HDy 1.0 1.8 5.0 1362 1109 A 41 VAL HGx% A 68 LYS HEx 1.0 1.8 5.0 1363 1109 A 41 VAL HGx% A 68 LYS HEy 1.0 1.8 5.0 1364 1110 A 41 VAL HGy% A 68 LYS HEx 1.0 1.8 5.0 1365 1110 A 41 VAL HGy% A 68 LYS HEy 1.0 1.8 5.0 1366 1111 A 41 VAL HGx% A 68 LYS HGy 1.0 1.8 5.0 1367 1112 A 41 VAL HGy% A 68 LYS HGy 1.0 1.8 5.0 1368 1113 A 68 LYS H A 41 VAL HGx% 1.0 1.8 5.0 1369 1114 A 68 LYS H A 41 VAL HGy% 1.0 1.8 6.0 1370 1115 A 41 VAL HGx% A 71 LEU HDx% 1.0 1.8 2.7 1371 1116 A 41 VAL HGy% A 71 LEU HDx% 1.0 1.8 5.0 1372 1117 A 41 VAL HGx% A 71 LEU HBx 1.0 1.8 5.0 1373 1118 A 41 VAL HGx% A 71 LEU HBy 1.0 1.8 5.0 1374 1119 A 41 VAL HGx% A 71 LEU HG 1.0 1.8 5.0 1375 1120 A 41 VAL HB A 71 LEU HDx% 1.0 1.8 5.0 1376 1121 A 71 LEU HDx% A 41 VAL HA 1.0 1.8 5.0 1377 1122 A 71 LEU HDy% A 41 VAL HA 1.0 1.8 5.0 1378 1123 A 41 VAL HGx% A 71 LEU H 1.0 1.8 5.0 1379 1124 A 42 LYS HBx A 42 LYS HDx 1.0 1.8 3.5 1380 1124 A 42 LYS HBx A 42 LYS HDy 1.0 1.8 3.5 1381 1125 A 42 LYS HA A 42 LYS HDx 1.0 1.8 5.0 1382 1125 A 42 LYS HA A 42 LYS HDy 1.0 1.8 5.0 1383 1126 A 42 LYS HA A 42 LYS HGy 1.0 1.8 5.0 1384 1127 A 42 LYS HBy A 42 LYS HDx 1.0 1.8 5.0 1385 1127 A 42 LYS HBy A 42 LYS HDy 1.0 1.8 5.0 1386 1128 A 42 LYS HGx A 42 LYS HDx 1.0 1.8 3.5 1387 1128 A 42 LYS HDy A 42 LYS HGx 1.0 1.8 3.5 1388 1129 A 42 LYS HBy A 42 LYS H 1.0 1.8 3.5 1389 1130 A 42 LYS HBx A 42 LYS H 1.0 1.8 3.5 1390 1131 A 42 LYS H A 42 LYS HDx 1.0 1.8 5.0 1391 1131 A 42 LYS H A 42 LYS HDy 1.0 1.8 5.0 1392 1132 A 42 LYS H A 42 LYS HGy 1.0 1.8 5.0 1393 1133 A 42 LYS H A 42 LYS HGx 1.0 1.8 5.0 1394 1134 A 42 LYS H A 42 LYS HEy 1.0 1.8 6.0 1395 1134 A 42 LYS H A 42 LYS HEx 1.0 1.8 6.0 1396 1135 A 42 LYS HA A 42 LYS HEy 1.0 1.8 6.0 1397 1135 A 42 LYS HA A 42 LYS HEx 1.0 1.8 6.0 1398 1136 A 42 LYS HBy A 42 LYS HEy 1.0 1.8 6.0 1399 1136 A 42 LYS HBy A 42 LYS HEx 1.0 1.8 6.0 1400 1137 A 42 LYS HBx A 42 LYS HEy 1.0 1.8 5.0 1401 1137 A 42 LYS HBx A 42 LYS HEx 1.0 1.8 5.0 1402 1138 A 42 LYS HGx A 42 LYS HEy 1.0 1.8 5.0 1403 1138 A 42 LYS HGx A 42 LYS HEx 1.0 1.8 5.0 1404 1139 A 43 ALA HB% A 42 LYS HBx 1.0 1.8 5.0 1405 1140 A 43 ALA HA A 42 LYS HBx 1.0 1.8 6.0 1406 1141 A 43 ALA HB% A 42 LYS H 1.0 1.8 6.0 1407 1142 A 43 ALA H A 42 LYS HBy 1.0 1.8 5.0 1408 1143 A 43 ALA H A 42 LYS HBx 1.0 1.8 3.5 1409 1144 A 43 ALA H A 42 LYS HDx 1.0 1.8 5.0 1410 1144 A 43 ALA H A 42 LYS HDy 1.0 1.8 5.0 1411 1145 A 43 ALA H A 42 LYS HGy 1.0 1.8 5.0 1412 1146 A 43 ALA H A 42 LYS H 1.0 1.8 3.5 1413 1147 A 43 ALA H A 42 LYS HEy 1.0 1.8 5.0 1414 1147 A 43 ALA H A 42 LYS HEx 1.0 1.8 5.0 1415 1148 A 44 VAL H A 42 LYS H 1.0 1.8 5.0 1416 1149 A 42 LYS HA A 45 TYR HBy 1.0 1.8 5.0 1417 1150 A 42 LYS HA A 45 TYR HBx 1.0 1.8 5.0 1418 1151 A 45 TYR HBx A 42 LYS HGy 1.0 1.8 6.0 1419 1152 A 42 LYS HA A 45 TYR HD% 1.0 1.8 5.0 1420 1153 A 45 TYR HD% A 42 LYS HGy 1.0 1.8 5.0 1421 1154 A 45 TYR H A 42 LYS HA 1.0 1.8 5.0 1422 1155 A 45 TYR H A 42 LYS HDx 1.0 1.8 6.0 1423 1155 A 45 TYR H A 42 LYS HDy 1.0 1.8 6.0 1424 1156 A 42 LYS H A 45 TYR HBx 1.0 1.8 6.0 1425 1157 A 42 LYS HEx A 46 LEU HDx% 1.0 1.8 5.0 1426 1158 A 46 LEU HBy A 42 LYS HDx 1.0 1.8 5.0 1427 1158 A 42 LYS HDy A 46 LEU HBy 1.0 1.8 5.0 1428 1159 A 42 LYS HBx A 46 LEU HDx% 1.0 1.8 5.0 1429 1160 A 46 LEU HDx% A 42 LYS HDx 1.0 1.8 5.0 1430 1160 A 42 LYS HDy A 46 LEU HDx% 1.0 1.8 5.0 1431 1161 A 46 LEU HDx% A 42 LYS HEy 1.0 1.8 5.0 1432 1162 A 42 LYS HGx A 46 LEU HDx% 1.0 1.8 5.0 1433 1163 A 46 LEU HBx A 42 LYS HDx 1.0 1.8 6.0 1434 1163 A 42 LYS HDy A 46 LEU HBx 1.0 1.8 6.0 1435 1164 A 46 LEU HDy% A 42 LYS HDx 1.0 1.8 5.0 1436 1164 A 42 LYS HDy A 46 LEU HDy% 1.0 1.8 5.0 1437 1165 A 46 LEU HG A 42 LYS HDx 1.0 1.8 3.5 1438 1165 A 42 LYS HDy A 46 LEU HG 1.0 1.8 3.5 1439 1166 A 42 LYS HGy A 46 LEU HDx% 1.0 1.8 5.0 1440 1167 A 42 LYS HA A 46 LEU H 1.0 1.8 5.0 1441 1168 A 46 LEU H A 42 LYS HDx 1.0 1.8 5.0 1442 1168 A 42 LYS HDy A 46 LEU H 1.0 1.8 5.0 1443 1169 A 46 LEU HDx% A 42 LYS HEy 1.0 1.8 5.0 1444 1169 A 42 LYS HEx A 46 LEU HDx% 1.0 1.8 5.0 1445 1170 A 46 LEU HDy% A 42 LYS HEy 1.0 1.8 5.0 1446 1170 A 42 LYS HEx A 46 LEU HDy% 1.0 1.8 5.0 1447 1171 A 42 LYS HGy A 62 LEU HDx% 1.0 1.8 5.0 1448 1172 A 62 LEU HDx% A 42 LYS HDx 1.0 1.8 3.5 1449 1172 A 42 LYS HDy A 62 LEU HDx% 1.0 1.8 3.5 1450 1173 A 62 LEU HDx% A 42 LYS HEy 1.0 1.8 5.0 1451 1173 A 42 LYS HEx A 62 LEU HDx% 1.0 1.8 5.0 1452 1174 A 67 ILE HD1% A 42 LYS HEy 1.0 1.8 6.0 1453 1175 A 42 LYS HEx A 67 ILE HD1% 1.0 1.8 6.0 1454 1176 A 42 LYS HGy A 67 ILE HD1% 1.0 1.8 5.0 1455 1177 A 67 ILE HD1% A 42 LYS HDx 1.0 1.8 5.0 1456 1177 A 42 LYS HDy A 67 ILE HD1% 1.0 1.8 5.0 1457 1178 A 42 LYS HBy A 67 ILE HD1% 1.0 1.8 5.0 1458 1179 A 42 LYS HA A 67 ILE HD1% 1.0 1.8 5.0 1459 1180 A 42 LYS HBy A 67 ILE HG2% 1.0 1.8 5.0 1460 1181 A 42 LYS HA A 67 ILE HG2% 1.0 1.8 5.0 1461 1182 A 42 LYS HA A 67 ILE HG1y 1.0 1.8 5.0 1462 1183 A 42 LYS HA A 67 ILE HB 1.0 1.8 5.0 1463 1184 A 67 ILE HG2% A 42 LYS HGy 1.0 1.8 5.0 1464 1185 A 42 LYS H A 67 ILE HG2% 1.0 1.8 5.0 1465 1186 A 71 LEU HDx% A 42 LYS HA 1.0 1.8 5.0 1466 1187 A 71 LEU HDy% A 42 LYS HA 1.0 1.8 6.0 1467 1188 A 71 LEU HDx% A 42 LYS H 1.0 1.8 5.0 1468 1189 A 43 ALA HB% A 43 ALA H 1.0 1.8 3.5 1469 1190 A 44 VAL HGx% A 43 ALA HB% 1.0 1.8 5.0 1470 1191 A 44 VAL HGy% A 43 ALA HB% 1.0 1.8 5.0 1471 1192 A 43 ALA HB% A 44 VAL HA 1.0 1.8 5.0 1472 1193 A 44 VAL HGy% A 43 ALA H 1.0 1.8 5.0 1473 1194 A 44 VAL H A 43 ALA HB% 1.0 1.8 3.5 1474 1195 A 44 VAL H A 43 ALA H 1.0 1.8 3.5 1475 1196 A 45 TYR H A 43 ALA HB% 1.0 1.8 5.0 1476 1197 A 45 TYR H A 43 ALA H 1.0 1.8 5.0 1477 1198 A 43 ALA HA A 46 LEU HBx 1.0 1.8 5.0 1478 1199 A 43 ALA HA A 46 LEU HBy 1.0 1.8 5.0 1479 1200 A 43 ALA HA A 46 LEU HDx% 1.0 1.8 5.0 1480 1201 A 43 ALA HB% A 46 LEU HDx% 1.0 1.8 5.0 1481 1202 A 43 ALA HA A 46 LEU HG 1.0 1.8 6.0 1482 1203 A 43 ALA HB% A 46 LEU HBy 1.0 1.8 5.0 1483 1204 A 43 ALA HA A 46 LEU H 1.0 1.8 5.0 1484 1205 A 43 ALA H A 46 LEU HDx% 1.0 1.8 5.0 1485 1206 A 43 ALA HB% A 46 LEU H 1.0 1.8 5.0 1486 1207 A 43 ALA H A 46 LEU H 1.0 1.8 6.0 1487 1208 A 47 PHE HBx A 43 ALA HA 1.0 1.8 6.0 1488 1209 A 43 ALA HA A 47 PHE H 1.0 1.8 5.0 1489 1210 A 43 ALA HB% A 47 PHE H 1.0 1.8 5.0 1490 1211 A 44 VAL HGx% A 44 VAL HA 1.0 1.8 3.5 1491 1212 A 44 VAL HGy% A 44 VAL HA 1.0 1.8 3.5 1492 1213 A 44 VAL HB A 44 VAL H 1.0 1.8 3.5 1493 1214 A 44 VAL HGy% A 44 VAL H 1.0 1.8 3.5 1494 1215 A 44 VAL HGx% A 44 VAL H 1.0 1.8 5.0 1495 1216 A 44 VAL HGx% A 45 TYR HA 1.0 1.8 5.0 1496 1217 A 44 VAL H A 45 TYR HA 1.0 1.8 6.0 1497 1218 A 44 VAL HB A 45 TYR H 1.0 1.8 3.5 1498 1219 A 44 VAL HGy% A 45 TYR H 1.0 1.8 5.0 1499 1220 A 44 VAL HGx% A 45 TYR H 1.0 1.8 5.0 1500 1221 A 44 VAL H A 45 TYR H 1.0 1.8 3.5 1501 1222 A 44 VAL H A 46 LEU H 1.0 1.8 5.0 1502 1223 A 44 VAL H A 46 LEU HBy 1.0 1.8 6.0 1503 1224 A 47 PHE HBx A 44 VAL HA 1.0 1.8 5.0 1504 1225 A 47 PHE HBy A 44 VAL HA 1.0 1.8 5.0 1505 1226 A 44 VAL HA A 47 PHE H 1.0 1.8 5.0 1506 1227 A 47 PHE HD% A 44 VAL HA 1.0 1.8 5.0 1507 1228 A 44 VAL HGx% A 47 PHE HD% 1.0 1.8 5.0 1508 1229 A 44 VAL HGx% A 47 PHE HE% 1.0 1.8 6.0 1509 1230 A 44 VAL HGx% A 47 PHE H 1.0 1.8 5.0 1510 1231 A 44 VAL H A 47 PHE H 1.0 1.8 5.0 1511 1232 A 44 VAL H A 47 PHE HBx 1.0 1.8 5.0 1512 1233 A 44 VAL HGx% A 48 LEU HG 1.0 1.8 5.0 1513 1234 A 44 VAL HGx% A 48 LEU HBy 1.0 1.8 5.0 1514 1235 A 44 VAL HGx% A 48 LEU HDx% 1.0 1.8 5.0 1515 1236 A 44 VAL HGx% A 48 LEU HDy% 1.0 1.8 5.0 1516 1237 A 44 VAL HGy% A 48 LEU HDx% 1.0 1.8 5.0 1517 1238 A 48 LEU HDx% A 44 VAL HA 1.0 1.8 5.0 1518 1239 A 44 VAL HB A 48 LEU HDx% 1.0 1.8 6.0 1519 1240 A 48 LEU HG A 44 VAL HA 1.0 1.8 6.0 1520 1241 A 48 LEU H A 44 VAL HA 1.0 1.8 5.0 1521 1242 A 44 VAL HGx% A 48 LEU H 1.0 1.8 5.0 1522 1243 A 71 LEU HDy% A 44 VAL HB 1.0 1.8 5.0 1523 1244 A 71 LEU HA A 44 VAL HGx% 1.0 1.8 6.0 1524 1245 A 71 LEU HDx% A 44 VAL H 1.0 1.8 5.0 1525 1246 A 71 LEU HDx% A 44 VAL HGy% 1.0 1.8 3.5 1526 1247 A 71 LEU HDy% A 44 VAL HGx% 1.0 1.8 2.7 1527 1248 A 71 LEU HBx A 44 VAL HGx% 1.0 1.8 6.0 1528 1249 A 71 LEU HDx% A 44 VAL HB 1.0 1.8 5.0 1529 1250 A 74 TRP HZ3 A 44 VAL HGx% 1.0 1.8 5.0 1530 1251 A 45 TYR HD% A 45 TYR HA 1.0 1.8 5.0 1531 1252 A 45 TYR H A 45 TYR HBx 1.0 1.8 3.5 1532 1253 A 45 TYR H A 45 TYR HBy 1.0 1.8 3.5 1533 1254 A 46 LEU HDx% A 45 TYR HE% 1.0 1.8 5.0 1534 1255 A 45 TYR HD% A 46 LEU HDy% 1.0 1.8 5.0 1535 1256 A 45 TYR HD% A 46 LEU HG 1.0 1.8 3.5 1536 1257 A 45 TYR HD% A 46 LEU HA 1.0 1.8 5.0 1537 1258 A 46 LEU HDy% A 45 TYR HE% 1.0 1.8 3.5 1538 1259 A 46 LEU HG A 45 TYR HE% 1.0 1.8 5.0 1539 1260 A 46 LEU HBx A 45 TYR HE% 1.0 1.8 6.0 1540 1261 A 45 TYR HD% A 46 LEU HDx% 1.0 1.8 5.0 1541 1262 A 45 TYR HBx A 46 LEU H 1.0 1.8 5.0 1542 1263 A 45 TYR HBy A 46 LEU H 1.0 1.8 5.0 1543 1264 A 45 TYR HD% A 46 LEU H 1.0 1.8 3.5 1544 1265 A 46 LEU H A 45 TYR HE% 1.0 1.8 5.0 1545 1266 A 45 TYR H A 46 LEU H 1.0 1.8 3.5 1546 1267 A 47 PHE H A 45 TYR HA 1.0 1.8 5.0 1547 1268 A 45 TYR HA A 48 LEU HBx 1.0 1.8 5.0 1548 1269 A 45 TYR HA A 48 LEU HBy 1.0 1.8 5.0 1549 1270 A 48 LEU HDx% A 45 TYR HA 1.0 1.8 5.0 1550 1271 A 48 LEU H A 45 TYR HA 1.0 1.8 5.0 1551 1272 A 45 TYR H A 48 LEU HDx% 1.0 1.8 6.0 1552 1273 A 45 TYR H A 48 LEU H 1.0 1.8 6.0 1553 1274 A 45 TYR HE% A 49 VAL HGy% 1.0 1.8 5.0 1554 1275 A 45 TYR HA A 49 VAL HGy% 1.0 1.8 5.0 1555 1276 A 45 TYR HE% A 49 VAL HGx% 1.0 1.8 5.0 1556 1277 A 45 TYR HA A 49 VAL H 1.0 1.8 5.0 1557 1278 A 45 TYR HA A 54 ILE HD1% 1.0 1.8 5.0 1558 1279 A 45 TYR HBy A 54 ILE HD1% 1.0 1.8 5.0 1559 1280 A 45 TYR HD% A 54 ILE HD1% 1.0 1.8 3.5 1560 1281 A 45 TYR HE% A 54 ILE HD1% 1.0 1.8 5.0 1561 1282 A 45 TYR HE% A 56 PRO HA 1.0 1.8 5.0 1562 1283 A 45 TYR HE% A 56 PRO HBx 1.0 1.8 6.0 1563 1284 A 45 TYR HE% A 57 LEU HDx% 1.0 1.8 5.0 1564 1285 A 45 TYR HE% A 57 LEU HDy% 1.0 1.8 5.0 1565 1286 A 45 TYR HD% A 57 LEU HDx% 1.0 1.8 5.0 1566 1287 A 45 TYR HD% A 57 LEU HG 1.0 1.8 5.0 1567 1288 A 45 TYR HE% A 57 LEU HG 1.0 1.8 5.0 1568 1289 A 45 TYR HE% A 57 LEU HA 1.0 1.8 5.0 1569 1290 A 45 TYR HE% A 57 LEU H 1.0 1.8 5.0 1570 1291 A 45 TYR HE% A 62 LEU HDy% 1.0 1.8 5.0 1571 1292 A 45 TYR HD% A 62 LEU HDy% 1.0 1.8 5.0 1572 1293 A 45 TYR HE% A 62 LEU HA 1.0 1.8 6.0 1573 1294 A 62 LEU HDx% A 45 TYR HE% 1.0 1.8 3.5 1574 1295 A 45 TYR HD% A 62 LEU HDx% 1.0 1.8 5.0 1575 1296 A 45 TYR HBx A 67 ILE HD1% 1.0 1.8 5.0 1576 1297 A 45 TYR HBy A 67 ILE HD1% 1.0 1.8 5.0 1577 1298 A 45 TYR HD% A 67 ILE HD1% 1.0 1.8 5.0 1578 1299 A 67 ILE HD1% A 45 TYR HE% 1.0 1.8 5.0 1579 1300 A 45 TYR H A 67 ILE HD1% 1.0 1.8 5.0 1580 1301 A 45 TYR HBx A 67 ILE HG2% 1.0 1.8 5.0 1581 1302 A 45 TYR HBy A 67 ILE HG2% 1.0 1.8 5.0 1582 1303 A 45 TYR HD% A 67 ILE HG2% 1.0 1.8 5.0 1583 1304 A 67 ILE HG2% A 45 TYR HE% 1.0 1.8 5.0 1584 1305 A 45 TYR HE% A 67 ILE HA 1.0 1.8 6.0 1585 1306 A 67 ILE HG2% A 45 TYR HA 1.0 1.8 5.0 1586 1307 A 45 TYR H A 67 ILE HG2% 1.0 1.8 5.0 1587 1308 A 45 TYR HD% A 70 ARG HGx 1.0 1.8 5.0 1588 1309 A 45 TYR HBy A 70 ARG HBy 1.0 1.8 5.0 1589 1310 A 45 TYR HD% A 70 ARG HBx 1.0 1.8 5.0 1590 1311 A 45 TYR HE% A 70 ARG HBx 1.0 1.8 5.0 1591 1312 A 71 LEU HDx% A 45 TYR HBx 1.0 1.8 5.0 1592 1313 A 71 LEU HDy% A 45 TYR HBx 1.0 1.8 5.0 1593 1314 A 71 LEU HDy% A 45 TYR HBy 1.0 1.8 5.0 1594 1315 A 71 LEU HDy% A 45 TYR HA 1.0 1.8 3.5 1595 1316 A 71 LEU HDy% A 45 TYR HD% 1.0 1.8 5.0 1596 1317 A 71 LEU HDx% A 45 TYR HD% 1.0 1.8 5.0 1597 1318 A 71 LEU HG A 45 TYR HA 1.0 1.8 5.0 1598 1319 A 71 LEU HDy% A 45 TYR H 1.0 1.8 5.0 1599 1320 A 71 LEU HDx% A 45 TYR H 1.0 1.8 5.0 1600 1321 A 71 LEU H A 45 TYR HBy 1.0 1.8 5.0 1601 1322 A 46 LEU HG A 46 LEU HA 1.0 1.8 5.0 1602 1323 A 46 LEU HDx% A 46 LEU HA 1.0 1.8 5.0 1603 1324 A 46 LEU HDx% A 46 LEU HBy 1.0 1.8 3.5 1604 1325 A 46 LEU HDx% A 46 LEU HBx 1.0 1.8 3.5 1605 1326 A 46 LEU HDx% A 46 LEU H 1.0 1.8 5.0 1606 1327 A 46 LEU HDy% A 46 LEU HA 1.0 1.8 3.5 1607 1328 A 46 LEU HBy A 46 LEU HDy% 1.0 1.8 3.5 1608 1329 A 46 LEU HBx A 46 LEU HDy% 1.0 1.8 5.0 1609 1330 A 46 LEU HDy% A 46 LEU H 1.0 1.8 5.0 1610 1331 A 46 LEU HBy A 46 LEU H 1.0 1.8 3.5 1611 1332 A 46 LEU HBx A 46 LEU H 1.0 1.8 5.0 1612 1333 A 46 LEU HG A 46 LEU H 1.0 1.8 3.5 1613 1334 A 47 PHE H A 46 LEU HDx% 1.0 1.8 5.0 1614 1335 A 47 PHE H A 46 LEU HDy% 1.0 1.8 5.0 1615 1336 A 47 PHE H A 46 LEU HG 1.0 1.8 5.0 1616 1337 A 47 PHE H A 46 LEU H 1.0 1.8 3.5 1617 1338 A 47 PHE H A 46 LEU HBy 1.0 1.8 5.0 1618 1339 A 47 PHE H A 46 LEU HBx 1.0 1.8 5.0 1619 1340 A 48 LEU H A 46 LEU H 1.0 1.8 5.0 1620 1341 A 48 LEU H A 46 LEU HA 1.0 1.8 5.0 1621 1342 A 46 LEU HA A 49 VAL HGx% 1.0 1.8 5.0 1622 1343 A 46 LEU HA A 49 VAL HB 1.0 1.8 5.0 1623 1344 A 46 LEU HA A 49 VAL HGy% 1.0 1.8 5.0 1624 1345 A 46 LEU HBx A 49 VAL HB 1.0 1.8 6.0 1625 1346 A 46 LEU HDy% A 49 VAL HB 1.0 1.8 5.0 1626 1347 A 46 LEU HDy% A 49 VAL HGy% 1.0 1.8 5.0 1627 1348 A 46 LEU HG A 49 VAL HGy% 1.0 1.8 6.0 1628 1349 A 46 LEU HA A 49 VAL H 1.0 1.8 5.0 1629 1350 A 46 LEU HBx A 49 VAL H 1.0 1.8 6.0 1630 1351 A 46 LEU H A 49 VAL H 1.0 1.8 6.0 1631 1352 A 46 LEU HA A 50 ASP H 1.0 1.8 5.0 1632 1353 A 46 LEU H A 54 ILE HD1% 1.0 1.8 6.0 1633 1354 A 46 LEU HDy% A 57 LEU H 1.0 1.8 6.0 1634 1355 A 46 LEU HDy% A 62 LEU HDy% 1.0 1.8 5.0 1635 1356 A 46 LEU HDy% A 62 LEU HG 1.0 1.8 6.0 1636 1357 A 46 LEU HDx% A 62 LEU HDy% 1.0 1.8 6.0 1637 1358 A 67 ILE HG2% A 46 LEU H 1.0 1.8 5.0 1638 1359 A 46 LEU H A 67 ILE HD1% 1.0 1.8 5.0 1639 1360 A 71 LEU HDy% A 46 LEU H 1.0 1.8 5.0 1640 1361 A 47 PHE HD% A 47 PHE HA 1.0 1.8 5.0 1641 1362 A 47 PHE HZ A 47 PHE HD% 1.0 1.8 5.0 1642 1363 A 47 PHE HBx A 47 PHE H 1.0 1.8 3.5 1643 1364 A 47 PHE HBy A 47 PHE H 1.0 1.8 3.5 1644 1365 A 48 LEU HDy% A 47 PHE HBx 1.0 1.8 6.0 1645 1366 A 47 PHE HD% A 48 LEU HA 1.0 1.8 5.0 1646 1367 A 48 LEU HDx% A 47 PHE HD% 1.0 1.8 5.0 1647 1368 A 48 LEU HDy% A 47 PHE HE% 1.0 1.8 5.0 1648 1369 A 48 LEU HDy% A 47 PHE HZ 1.0 1.8 5.0 1649 1370 A 48 LEU HDy% A 47 PHE HD% 1.0 1.8 5.0 1650 1371 A 48 LEU HA A 47 PHE H 1.0 1.8 6.0 1651 1372 A 48 LEU H A 47 PHE H 1.0 1.8 3.5 1652 1373 A 47 PHE HBx A 48 LEU H 1.0 1.8 3.5 1653 1374 A 47 PHE HBy A 48 LEU H 1.0 1.8 5.0 1654 1375 A 47 PHE HD% A 48 LEU H 1.0 1.8 5.0 1655 1376 A 47 PHE HE% A 48 LEU H 1.0 1.8 5.0 1656 1377 A 47 PHE HA A 49 VAL HB 1.0 1.8 6.0 1657 1378 A 47 PHE HD% A 49 VAL H 1.0 1.8 6.0 1658 1379 A 47 PHE H A 49 VAL H 1.0 1.8 5.0 1659 1380 A 47 PHE HA A 49 VAL H 1.0 1.8 5.0 1660 1381 A 47 PHE HA A 50 ASP HBy 1.0 1.8 5.0 1661 1382 A 47 PHE HA A 50 ASP HBx 1.0 1.8 5.0 1662 1383 A 47 PHE HD% A 50 ASP HBx 1.0 1.8 6.0 1663 1384 A 47 PHE HA A 50 ASP H 1.0 1.8 5.0 1664 1385 A 47 PHE H A 50 ASP HBy 1.0 1.8 6.0 1665 1386 A 47 PHE HA A 51 ALA H 1.0 1.8 5.0 1666 1387 A 51 ALA HB% A 47 PHE HA 1.0 1.8 5.0 1667 1388 A 47 PHE HZ A 51 ALA HB% 1.0 1.8 5.0 1668 1389 A 47 PHE HE% A 51 ALA HB% 1.0 1.8 6.0 1669 1390 A 47 PHE HD% A 51 ALA H 1.0 1.8 5.0 1670 1391 A 47 PHE HE% A 51 ALA H 1.0 1.8 6.0 1671 1392 A 48 LEU HDx% A 48 LEU HA 1.0 1.8 5.0 1672 1393 A 48 LEU HDx% A 48 LEU HBx 1.0 1.8 5.0 1673 1394 A 48 LEU HDx% A 48 LEU HBy 1.0 1.8 5.0 1674 1395 A 48 LEU HDy% A 48 LEU HA 1.0 1.8 3.5 1675 1396 A 48 LEU HDy% A 48 LEU HBx 1.0 1.8 5.0 1676 1397 A 48 LEU HDy% A 48 LEU HBy 1.0 1.8 5.0 1677 1398 A 48 LEU H A 48 LEU HBx 1.0 1.8 5.0 1678 1399 A 48 LEU H A 48 LEU HBy 1.0 1.8 3.5 1679 1400 A 48 LEU HDx% A 48 LEU H 1.0 1.8 5.0 1680 1401 A 48 LEU HDy% A 48 LEU H 1.0 1.8 5.0 1681 1402 A 48 LEU HG A 48 LEU H 1.0 1.8 3.5 1682 1403 A 48 LEU H A 49 VAL HGy% 1.0 1.8 5.0 1683 1404 A 48 LEU H A 49 VAL HA 1.0 1.8 6.0 1684 1405 A 48 LEU HDy% A 49 VAL H 1.0 1.8 5.0 1685 1406 A 48 LEU HBx A 49 VAL H 1.0 1.8 5.0 1686 1407 A 48 LEU HDx% A 49 VAL H 1.0 1.8 5.0 1687 1408 A 48 LEU H A 49 VAL H 1.0 1.8 3.5 1688 1409 A 48 LEU HBy A 49 VAL H 1.0 1.8 5.0 1689 1410 A 48 LEU H A 50 ASP H 1.0 1.8 5.0 1690 1411 A 48 LEU HBy A 50 ASP H 1.0 1.8 6.0 1691 1412 A 48 LEU HA A 51 ALA HB% 1.0 1.8 3.5 1692 1413 A 48 LEU HDy% A 51 ALA HB% 1.0 1.8 5.0 1693 1414 A 51 ALA HB% A 48 LEU HBx 1.0 1.8 5.0 1694 1415 A 51 ALA HB% A 48 LEU H 1.0 1.8 5.0 1695 1416 A 48 LEU HA A 51 ALA H 1.0 1.8 3.5 1696 1417 A 48 LEU HDy% A 51 ALA H 1.0 1.8 5.0 1697 1418 A 48 LEU HBx A 51 ALA H 1.0 1.8 6.0 1698 1419 A 48 LEU H A 51 ALA H 1.0 1.8 5.0 1699 1420 A 48 LEU HA A 52 LYS H 1.0 1.8 6.0 1700 1421 A 48 LEU HDx% A 53 GLN HGy 1.0 1.8 6.0 1701 1422 A 48 LEU HDy% A 53 GLN HBy 1.0 1.8 5.0 1702 1423 A 48 LEU HDy% A 53 GLN HGx 1.0 1.8 5.0 1703 1424 A 48 LEU HDy% A 53 GLN HBx 1.0 1.8 5.0 1704 1425 A 48 LEU HDy% A 53 GLN HGy 1.0 1.8 5.0 1705 1426 A 48 LEU HDy% A 53 GLN HA 1.0 1.8 5.0 1706 1427 A 53 GLN HGy A 48 LEU HBx 1.0 1.8 5.0 1707 1428 A 48 LEU HA A 53 GLN H 1.0 1.8 5.0 1708 1429 A 48 LEU HDx% A 53 GLN HGx 1.0 1.8 6.0 1709 1430 A 53 GLN HBy A 48 LEU HBx 1.0 1.8 5.0 1710 1431 A 48 LEU HDy% A 53 GLN H 1.0 1.8 5.0 1711 1432 A 48 LEU HDy% A 53 GLN HE2y 1.0 1.8 5.0 1712 1433 A 48 LEU HBx A 53 GLN H 1.0 1.8 5.0 1713 1434 A 48 LEU HA A 54 ILE HG1y 1.0 1.8 6.0 1714 1435 A 48 LEU HBx A 54 ILE HG1y 1.0 1.8 5.0 1715 1436 A 48 LEU HBx A 54 ILE HG1x 1.0 1.8 5.0 1716 1437 A 48 LEU HBx A 54 ILE HD1% 1.0 1.8 5.0 1717 1438 A 48 LEU HBy A 54 ILE HG1y 1.0 1.8 5.0 1718 1439 A 48 LEU HDx% A 54 ILE HG2% 1.0 1.8 5.0 1719 1440 A 48 LEU HDy% A 54 ILE HD1% 1.0 1.8 5.0 1720 1441 A 48 LEU HDy% A 54 ILE H 1.0 1.8 5.0 1721 1442 A 48 LEU HBy A 54 ILE HD1% 1.0 1.8 5.0 1722 1443 A 48 LEU HDx% A 54 ILE HD1% 1.0 1.8 5.0 1723 1444 A 48 LEU HDx% A 54 ILE HG1x 1.0 1.8 5.0 1724 1445 A 48 LEU HDx% A 54 ILE HG1y 1.0 1.8 5.0 1725 1446 A 48 LEU HDy% A 54 ILE HG2% 1.0 1.8 5.0 1726 1447 A 48 LEU HBx A 54 ILE HG2% 1.0 1.8 5.0 1727 1448 A 48 LEU HBy A 54 ILE HG2% 1.0 1.8 5.0 1728 1449 A 48 LEU HDx% A 54 ILE HB 1.0 1.8 6.0 1729 1450 A 48 LEU HBx A 54 ILE HB 1.0 1.8 5.0 1730 1451 A 48 LEU HG A 54 ILE HD1% 1.0 1.8 6.0 1731 1452 A 48 LEU H A 54 ILE HD1% 1.0 1.8 5.0 1732 1453 A 48 LEU HDx% A 54 ILE H 1.0 1.8 5.0 1733 1454 A 48 LEU HBx A 54 ILE H 1.0 1.8 5.0 1734 1455 A 48 LEU HA A 54 ILE H 1.0 1.8 5.0 1735 1456 A 71 LEU HDy% A 48 LEU HDx% 1.0 1.8 3.5 1736 1457 A 71 LEU HDx% A 48 LEU HDx% 1.0 1.8 5.0 1737 1458 A 71 LEU HDy% A 48 LEU HDy% 1.0 1.8 5.0 1738 1459 A 71 LEU HDy% A 48 LEU HG 1.0 1.8 5.0 1739 1460 A 71 LEU HA A 48 LEU HDx% 1.0 1.8 5.0 1740 1461 A 71 LEU HDy% A 48 LEU HBx 1.0 1.8 5.0 1741 1462 A 71 LEU HDy% A 48 LEU H 1.0 1.8 5.0 1742 1463 A 74 TRP HH2 A 48 LEU HDx% 1.0 1.8 5.0 1743 1464 A 48 LEU HDy% A 74 TRP HZ2 1.0 1.8 5.0 1744 1465 A 74 TRP HH2 A 48 LEU HDy% 1.0 1.8 5.0 1745 1466 A 74 TRP HZ3 A 48 LEU HDx% 1.0 1.8 5.0 1746 1467 A 74 TRP HZ2 A 48 LEU HDx% 1.0 1.8 5.0 1747 1468 A 48 LEU HDx% A 74 TRP HBx 1.0 1.8 5.0 1748 1469 A 48 LEU HDx% A 74 TRP HBy 1.0 1.8 5.0 1749 1470 A 48 LEU HBx A 74 TRP HD1 1.0 1.8 5.0 1750 1471 A 48 LEU HDy% A 74 TRP HE1 1.0 1.8 5.0 1751 1472 A 48 LEU HDx% A 74 TRP HE1 1.0 1.8 5.0 1752 1473 A 75 ILE HG2% A 48 LEU HDx% 1.0 1.8 6.0 1753 1474 A 49 VAL HGy% A 49 VAL HA 1.0 1.8 3.5 1754 1475 A 49 VAL HGx% A 49 VAL HA 1.0 1.8 3.5 1755 1476 A 49 VAL H A 49 VAL HB 1.0 1.8 3.5 1756 1477 A 49 VAL HGy% A 49 VAL H 1.0 1.8 3.5 1757 1478 A 49 VAL HGx% A 49 VAL H 1.0 1.8 5.0 1758 1479 A 49 VAL HGx% A 50 ASP HA 1.0 1.8 5.0 1759 1480 A 49 VAL HGx% A 50 ASP HBy 1.0 1.8 5.0 1760 1481 A 49 VAL H A 50 ASP H 1.0 1.8 3.5 1761 1482 A 49 VAL HB A 50 ASP H 1.0 1.8 3.5 1762 1483 A 49 VAL HGy% A 50 ASP H 1.0 1.8 5.0 1763 1484 A 49 VAL HGx% A 50 ASP H 1.0 1.8 5.0 1764 1485 A 51 ALA H A 49 VAL HA 1.0 1.8 5.0 1765 1486 A 49 VAL HB A 51 ALA H 1.0 1.8 5.0 1766 1487 A 49 VAL HGx% A 51 ALA H 1.0 1.8 6.0 1767 1488 A 49 VAL HA A 52 LYS HA 1.0 1.8 5.0 1768 1489 A 49 VAL HA A 52 LYS H 1.0 1.8 5.0 1769 1490 A 49 VAL HGx% A 52 LYS H 1.0 1.8 5.0 1770 1491 A 53 GLN HBy A 49 VAL HGy% 1.0 1.8 6.0 1771 1492 A 49 VAL H A 53 GLN H 1.0 1.8 6.0 1772 1493 A 49 VAL HA A 53 GLN H 1.0 1.8 5.0 1773 1494 A 49 VAL HA A 54 ILE HG1x 1.0 1.8 5.0 1774 1495 A 49 VAL HA A 54 ILE HG2% 1.0 1.8 5.0 1775 1496 A 49 VAL HA A 54 ILE HG1y 1.0 1.8 5.0 1776 1497 A 49 VAL HGy% A 54 ILE HG1x 1.0 1.8 5.0 1777 1498 A 49 VAL HGy% A 54 ILE HB 1.0 1.8 5.0 1778 1499 A 49 VAL HGy% A 54 ILE HD1% 1.0 1.8 5.0 1779 1500 A 49 VAL H A 54 ILE HD1% 1.0 1.8 5.0 1780 1501 A 49 VAL HGy% A 54 ILE HG1y 1.0 1.8 5.0 1781 1502 A 49 VAL HGy% A 54 ILE HG2% 1.0 1.8 5.0 1782 1503 A 49 VAL HGx% A 54 ILE H 1.0 1.8 5.0 1783 1504 A 49 VAL HGx% A 54 ILE HG1x 1.0 1.8 5.0 1784 1505 A 49 VAL HGx% A 54 ILE HD1% 1.0 1.8 6.0 1785 1506 A 49 VAL HGx% A 54 ILE HB 1.0 1.8 6.0 1786 1507 A 49 VAL H A 54 ILE HG1x 1.0 1.8 5.0 1787 1508 A 49 VAL H A 54 ILE HG2% 1.0 1.8 6.0 1788 1509 A 49 VAL H A 54 ILE H 1.0 1.8 5.0 1789 1510 A 49 VAL H A 54 ILE HG1y 1.0 1.8 5.0 1790 1511 A 49 VAL HGy% A 54 ILE H 1.0 1.8 5.0 1791 1512 A 49 VAL HA A 54 ILE H 1.0 1.8 3.5 1792 1513 A 49 VAL HGx% A 55 ALA HA 1.0 1.8 5.0 1793 1514 A 49 VAL HGx% A 55 ALA H 1.0 1.8 5.0 1794 1515 A 49 VAL HGx% A 55 ALA HB% 1.0 1.8 5.0 1795 1516 A 49 VAL HGy% A 55 ALA HA 1.0 1.8 5.0 1796 1517 A 49 VAL HGy% A 55 ALA H 1.0 1.8 5.0 1797 1518 A 49 VAL HGy% A 56 PRO HGx 1.0 1.8 5.0 1798 1518 A 49 VAL HGy% A 56 PRO HGy 1.0 1.8 5.0 1799 1519 A 49 VAL HGy% A 56 PRO HBx 1.0 1.8 5.0 1800 1520 A 49 VAL HGx% A 56 PRO HBx 1.0 1.8 5.0 1801 1521 A 49 VAL HGx% A 56 PRO HGx 1.0 1.8 5.0 1802 1521 A 49 VAL HGx% A 56 PRO HGy 1.0 1.8 5.0 1803 1522 A 49 VAL HGy% A 56 PRO HA 1.0 1.8 5.0 1804 1523 A 49 VAL HGx% A 56 PRO HA 1.0 1.8 5.0 1805 1524 A 49 VAL HGy% A 56 PRO HBy 1.0 1.8 5.0 1806 1525 A 49 VAL HGx% A 56 PRO HBy 1.0 1.8 5.0 1807 1526 A 49 VAL HGx% A 56 PRO HDx 1.0 1.8 5.0 1808 1526 A 49 VAL HGx% A 56 PRO HDy 1.0 1.8 5.0 1809 1527 A 49 VAL HGy% A 56 PRO HDx 1.0 1.8 5.0 1810 1527 A 49 VAL HGy% A 56 PRO HDy 1.0 1.8 5.0 1811 1528 A 56 PRO HBx A 49 VAL HB 1.0 1.8 5.0 1812 1529 A 49 VAL HGx% A 57 LEU H 1.0 1.8 5.0 1813 1530 A 49 VAL HGy% A 57 LEU H 1.0 1.8 5.0 1814 1531 A 49 VAL HGy% A 70 ARG HBx 1.0 1.8 5.0 1815 1532 A 50 ASP H A 50 ASP HBx 1.0 1.8 3.5 1816 1533 A 50 ASP H A 50 ASP HBy 1.0 1.8 3.5 1817 1534 A 51 ALA HB% A 50 ASP HBy 1.0 1.8 5.0 1818 1535 A 51 ALA HB% A 50 ASP HA 1.0 1.8 6.0 1819 1536 A 51 ALA HB% A 50 ASP HBx 1.0 1.8 5.0 1820 1537 A 51 ALA HB% A 50 ASP H 1.0 1.8 5.0 1821 1538 A 50 ASP H A 51 ALA HA 1.0 1.8 6.0 1822 1539 A 50 ASP HBx A 51 ALA H 1.0 1.8 5.0 1823 1540 A 50 ASP HBy A 51 ALA H 1.0 1.8 5.0 1824 1541 A 50 ASP H A 51 ALA H 1.0 1.8 3.5 1825 1542 A 52 LYS H A 50 ASP HA 1.0 1.8 5.0 1826 1543 A 51 ALA HB% A 51 ALA H 1.0 1.8 2.7 1827 1544 A 52 LYS H A 51 ALA HA 1.0 1.8 5.0 1828 1545 A 51 ALA HB% A 52 LYS H 1.0 1.8 5.0 1829 1546 A 51 ALA H A 52 LYS H 1.0 1.8 3.5 1830 1547 A 51 ALA HB% A 53 GLN HGy 1.0 1.8 5.0 1831 1548 A 53 GLN H A 51 ALA HA 1.0 1.8 6.0 1832 1549 A 51 ALA HB% A 53 GLN HA 1.0 1.8 5.0 1833 1550 A 51 ALA HB% A 53 GLN HGx 1.0 1.8 5.0 1834 1551 A 51 ALA HB% A 53 GLN HBy 1.0 1.8 5.0 1835 1552 A 53 GLN HGy A 51 ALA HA 1.0 1.8 5.0 1836 1553 A 51 ALA H A 53 GLN H 1.0 1.8 5.0 1837 1554 A 51 ALA HB% A 53 GLN H 1.0 1.8 5.0 1838 1555 A 51 ALA HB% A 53 GLN HE2y 1.0 1.8 5.0 1839 1556 A 51 ALA HB% A 53 GLN HE2x 1.0 1.8 6.0 1840 1557 A 53 GLN HE2y A 51 ALA HA 1.0 1.8 6.0 1841 1558 A 51 ALA H A 54 ILE H 1.0 1.8 6.0 1842 1559 A 52 LYS HA A 52 LYS HDy 1.0 1.8 5.0 1843 1560 A 52 LYS HA A 52 LYS HGx 1.0 1.8 5.0 1844 1561 A 52 LYS HA A 52 LYS HGy 1.0 1.8 5.0 1845 1562 A 52 LYS HA A 52 LYS HDx 1.0 1.8 5.0 1846 1563 A 52 LYS HGx A 52 LYS HEx 1.0 1.8 5.0 1847 1563 A 52 LYS HEy A 52 LYS HGx 1.0 1.8 5.0 1848 1564 A 52 LYS HEy A 52 LYS HGy 1.0 1.8 5.0 1849 1564 A 52 LYS HEx A 52 LYS HGy 1.0 1.8 5.0 1850 1565 A 52 LYS H A 52 LYS HEx 1.0 1.8 5.0 1851 1565 A 52 LYS H A 52 LYS HEy 1.0 1.8 5.0 1852 1566 A 52 LYS H A 52 LYS HA 1.0 1.8 2.7 1853 1567 A 52 LYS H A 52 LYS HBx 1.0 1.8 5.0 1854 1568 A 52 LYS H A 52 LYS HBy 1.0 1.8 5.0 1855 1569 A 52 LYS H A 52 LYS HBx 1.0 1.8 5.0 1856 1569 A 52 LYS H A 52 LYS HBy 1.0 1.8 5.0 1857 1570 A 52 LYS H A 52 LYS HGy 1.0 1.8 5.0 1858 1570 A 52 LYS H A 52 LYS HGx 1.0 1.8 5.0 1859 1571 A 52 LYS H A 52 LYS HDx 1.0 1.8 5.0 1860 1571 A 52 LYS H A 52 LYS HDy 1.0 1.8 5.0 1861 1572 A 52 LYS HA A 52 LYS HGy 1.0 1.8 5.0 1862 1572 A 52 LYS HA A 52 LYS HGx 1.0 1.8 5.0 1863 1573 A 52 LYS HA A 52 LYS HDx 1.0 1.8 5.0 1864 1573 A 52 LYS HA A 52 LYS HDy 1.0 1.8 5.0 1865 1574 A 52 LYS HBx A 52 LYS HDx 1.0 1.8 3.5 1866 1574 A 52 LYS HDy A 52 LYS HBx 1.0 1.8 3.5 1867 1574 A 52 LYS HBy A 52 LYS HDy 1.0 1.8 3.5 1868 1574 A 52 LYS HBy A 52 LYS HDx 1.0 1.8 3.5 1869 1575 A 52 LYS HBx A 52 LYS HEx 1.0 1.8 5.0 1870 1575 A 52 LYS HBy A 52 LYS HEx 1.0 1.8 5.0 1871 1575 A 52 LYS HEy A 52 LYS HBx 1.0 1.8 5.0 1872 1575 A 52 LYS HEy A 52 LYS HBy 1.0 1.8 5.0 1873 1576 A 52 LYS HEy A 52 LYS HGy 1.0 1.8 3.5 1874 1576 A 52 LYS HEx A 52 LYS HGy 1.0 1.8 3.5 1875 1576 A 52 LYS HGx A 52 LYS HEx 1.0 1.8 3.5 1876 1576 A 52 LYS HEy A 52 LYS HGx 1.0 1.8 3.5 1877 1577 A 53 GLN HBy A 52 LYS H 1.0 1.8 6.0 1878 1578 A 52 LYS H A 53 GLN H 1.0 1.8 3.5 1879 1579 A 53 GLN H A 52 LYS HA 1.0 1.8 3.5 1880 1580 A 53 GLN H A 52 LYS HGy 1.0 1.8 5.0 1881 1580 A 53 GLN H A 52 LYS HGx 1.0 1.8 5.0 1882 1581 A 53 GLN H A 52 LYS HDx 1.0 1.8 6.0 1883 1581 A 53 GLN H A 52 LYS HDy 1.0 1.8 6.0 1884 1582 A 54 ILE H A 52 LYS HA 1.0 1.8 5.0 1885 1583 A 52 LYS H A 54 ILE H 1.0 1.8 5.0 1886 1584 A 53 GLN HGx A 53 GLN HA 1.0 1.8 5.0 1887 1585 A 53 GLN HGy A 53 GLN HA 1.0 1.8 5.0 1888 1586 A 53 GLN HGx A 53 GLN H 1.0 1.8 5.0 1889 1587 A 53 GLN HE2y A 53 GLN H 1.0 1.8 5.0 1890 1588 A 53 GLN HGy A 53 GLN H 1.0 1.8 3.5 1891 1589 A 53 GLN HBy A 53 GLN H 1.0 1.8 5.0 1892 1590 A 53 GLN HBx A 53 GLN H 1.0 1.8 5.0 1893 1591 A 53 GLN HE2x A 53 GLN H 1.0 1.8 6.0 1894 1592 A 53 GLN HE2y A 53 GLN HA 1.0 1.8 5.0 1895 1593 A 53 GLN HE2x A 53 GLN HA 1.0 1.8 5.0 1896 1594 A 53 GLN HE2y A 53 GLN HBx 1.0 1.8 5.0 1897 1595 A 53 GLN HE2x A 53 GLN HBx 1.0 1.8 5.0 1898 1596 A 53 GLN HGy A 53 GLN HE2x 1.0 1.8 5.0 1899 1597 A 53 GLN HBx A 54 ILE HG1y 1.0 1.8 5.0 1900 1598 A 53 GLN H A 54 ILE H 1.0 1.8 3.5 1901 1599 A 53 GLN HBy A 54 ILE H 1.0 1.8 5.0 1902 1600 A 53 GLN HBx A 54 ILE H 1.0 1.8 5.0 1903 1601 A 53 GLN HGx A 54 ILE H 1.0 1.8 6.0 1904 1602 A 53 GLN HGy A 54 ILE H 1.0 1.8 5.0 1905 1603 A 53 GLN HA A 74 TRP HD1 1.0 1.8 5.0 1906 1604 A 53 GLN HBy A 74 TRP HD1 1.0 1.8 5.0 1907 1605 A 53 GLN HBx A 74 TRP HD1 1.0 1.8 5.0 1908 1606 A 74 TRP HZ2 A 53 GLN HGx 1.0 1.8 5.0 1909 1607 A 74 TRP HE1 A 53 GLN HA 1.0 1.8 5.0 1910 1608 A 53 GLN HBy A 74 TRP HE1 1.0 1.8 5.0 1911 1609 A 53 GLN HGx A 74 TRP HE1 1.0 1.8 5.0 1912 1610 A 74 TRP HE1 A 53 GLN HBx 1.0 1.8 3.5 1913 1611 A 53 GLN HGy A 74 TRP HE1 1.0 1.8 5.0 1914 1612 A 54 ILE HD1% A 54 ILE HA 1.0 1.8 5.0 1915 1613 A 54 ILE HD1% A 54 ILE HB 1.0 1.8 5.0 1916 1614 A 54 ILE HD1% A 54 ILE H 1.0 1.8 5.0 1917 1615 A 54 ILE HG1y A 54 ILE HA 1.0 1.8 5.0 1918 1616 A 54 ILE HG1x A 54 ILE HG2% 1.0 1.8 5.0 1919 1617 A 54 ILE HG2% A 54 ILE HA 1.0 1.8 5.0 1920 1618 A 54 ILE HD1% A 54 ILE HG2% 1.0 1.8 3.5 1921 1619 A 54 ILE HG1y A 54 ILE HG2% 1.0 1.8 5.0 1922 1620 A 54 ILE H A 54 ILE HB 1.0 1.8 5.0 1923 1621 A 54 ILE HG1x A 54 ILE H 1.0 1.8 5.0 1924 1622 A 54 ILE HG1y A 54 ILE H 1.0 1.8 5.0 1925 1623 A 54 ILE HG2% A 54 ILE H 1.0 1.8 5.0 1926 1624 A 55 ALA HB% A 54 ILE HA 1.0 1.8 5.0 1927 1625 A 54 ILE H A 55 ALA HB% 1.0 1.8 6.0 1928 1626 A 54 ILE H A 55 ALA H 1.0 1.8 5.0 1929 1627 A 55 ALA H A 54 ILE HA 1.0 1.8 3.5 1930 1628 A 54 ILE HB A 55 ALA H 1.0 1.8 5.0 1931 1629 A 54 ILE HG1x A 55 ALA H 1.0 1.8 6.0 1932 1630 A 54 ILE HD1% A 55 ALA H 1.0 1.8 6.0 1933 1631 A 54 ILE HG2% A 55 ALA H 1.0 1.8 5.0 1934 1632 A 54 ILE HD1% A 56 PRO HA 1.0 1.8 5.0 1935 1633 A 54 ILE HD1% A 57 LEU HG 1.0 1.8 6.0 1936 1634 A 54 ILE HD1% A 70 ARG HGx 1.0 1.8 5.0 1937 1635 A 54 ILE HD1% A 70 ARG HBy 1.0 1.8 5.0 1938 1636 A 70 ARG HBy A 54 ILE HG2% 1.0 1.8 5.0 1939 1637 A 54 ILE HG2% A 70 ARG HDy 1.0 1.8 5.0 1940 1638 A 70 ARG HGx A 54 ILE HG2% 1.0 1.8 6.0 1941 1639 A 54 ILE HG2% A 70 ARG HGy 1.0 1.8 6.0 1942 1640 A 54 ILE HD1% A 70 ARG HGy 1.0 1.8 5.0 1943 1641 A 70 ARG HBx A 54 ILE HG2% 1.0 1.8 5.0 1944 1642 A 54 ILE HD1% A 70 ARG HBx 1.0 1.8 5.0 1945 1643 A 70 ARG HBy A 54 ILE HB 1.0 1.8 6.0 1946 1644 A 71 LEU HDy% A 54 ILE HG2% 1.0 1.8 5.0 1947 1645 A 71 LEU HA A 54 ILE HD1% 1.0 1.8 5.0 1948 1646 A 71 LEU HDy% A 54 ILE HD1% 1.0 1.8 3.5 1949 1647 A 71 LEU HDy% A 54 ILE HB 1.0 1.8 6.0 1950 1648 A 71 LEU H A 54 ILE HD1% 1.0 1.8 5.0 1951 1649 A 54 ILE HG2% A 73 LEU HBy 1.0 1.8 5.0 1952 1650 A 54 ILE HG1y A 74 TRP HBy 1.0 1.8 6.0 1953 1651 A 54 ILE HD1% A 74 TRP HBy 1.0 1.8 5.0 1954 1652 A 54 ILE HG2% A 74 TRP HBy 1.0 1.8 5.0 1955 1653 A 74 TRP H A 54 ILE HG2% 1.0 1.8 5.0 1956 1654 A 54 ILE HG2% A 74 TRP HA 1.0 1.8 5.0 1957 1655 A 54 ILE HD1% A 74 TRP HBx 1.0 1.8 5.0 1958 1656 A 54 ILE HG2% A 74 TRP HBx 1.0 1.8 5.0 1959 1657 A 54 ILE HG1y A 74 TRP HD1 1.0 1.8 5.0 1960 1658 A 54 ILE HG2% A 74 TRP HD1 1.0 1.8 5.0 1961 1659 A 54 ILE HD1% A 74 TRP HD1 1.0 1.8 5.0 1962 1660 A 74 TRP H A 54 ILE HD1% 1.0 1.8 6.0 1963 1661 A 74 TRP HE1 A 54 ILE HG2% 1.0 1.8 5.0 1964 1662 A 74 TRP HE1 A 54 ILE HG1y 1.0 1.8 6.0 1965 1663 A 75 ILE H A 54 ILE HG2% 1.0 1.8 6.0 1966 1664 A 55 ALA H A 55 ALA HB% 1.0 1.8 3.5 1967 1665 A 55 ALA HA A 56 PRO HDx 1.0 1.8 3.5 1968 1665 A 55 ALA HA A 56 PRO HDy 1.0 1.8 3.5 1969 1666 A 55 ALA HA A 56 PRO HGx 1.0 1.8 5.0 1970 1666 A 55 ALA HA A 56 PRO HGy 1.0 1.8 5.0 1971 1667 A 55 ALA HB% A 56 PRO HGx 1.0 1.8 5.0 1972 1667 A 55 ALA HB% A 56 PRO HGy 1.0 1.8 5.0 1973 1668 A 55 ALA HB% A 56 PRO HDx 1.0 1.8 3.5 1974 1668 A 55 ALA HB% A 56 PRO HDy 1.0 1.8 3.5 1975 1669 A 55 ALA H A 56 PRO HDx 1.0 1.8 5.0 1976 1669 A 55 ALA H A 56 PRO HDy 1.0 1.8 5.0 1977 1670 A 56 PRO HA A 57 LEU HDx% 1.0 1.8 5.0 1978 1671 A 57 LEU H A 56 PRO HDx 1.0 1.8 6.0 1979 1671 A 57 LEU H A 56 PRO HDy 1.0 1.8 6.0 1980 1672 A 56 PRO HA A 57 LEU H 1.0 1.8 3.5 1981 1673 A 56 PRO HBx A 57 LEU H 1.0 1.8 5.0 1982 1674 A 57 LEU H A 56 PRO HBy 1.0 1.8 5.0 1983 1675 A 57 LEU H A 56 PRO HGx 1.0 1.8 5.0 1984 1675 A 57 LEU H A 56 PRO HGy 1.0 1.8 5.0 1985 1676 A 57 LEU HDy% A 57 LEU HBx 1.0 1.8 3.5 1986 1677 A 57 LEU HG A 57 LEU HA 1.0 1.8 5.0 1987 1678 A 57 LEU HDx% A 57 LEU HA 1.0 1.8 5.0 1988 1679 A 57 LEU HDx% A 57 LEU HBy 1.0 1.8 5.0 1989 1680 A 57 LEU HDy% A 57 LEU HA 1.0 1.8 3.5 1990 1681 A 57 LEU HDy% A 57 LEU HBy 1.0 1.8 3.5 1991 1682 A 57 LEU HDx% A 57 LEU HBx 1.0 1.8 5.0 1992 1683 A 57 LEU H A 57 LEU HBy 1.0 1.8 5.0 1993 1684 A 57 LEU H A 57 LEU HBx 1.0 1.8 5.0 1994 1685 A 57 LEU HDx% A 57 LEU H 1.0 1.8 5.0 1995 1686 A 57 LEU HDy% A 57 LEU H 1.0 1.8 5.0 1996 1687 A 57 LEU HG A 57 LEU H 1.0 1.8 3.5 1997 1688 A 57 LEU HA A 58 PRO HDx 1.0 1.8 5.0 1998 1689 A 57 LEU HA A 58 PRO HDy 1.0 1.8 3.5 1999 1690 A 57 LEU HBx A 58 PRO HDx 1.0 1.8 5.0 2000 1691 A 57 LEU HA A 58 PRO HGx 1.0 1.8 5.0 2001 1692 A 57 LEU HDy% A 58 PRO HDy 1.0 1.8 5.0 2002 1693 A 57 LEU HDy% A 58 PRO HDx 1.0 1.8 5.0 2003 1694 A 57 LEU HBy A 58 PRO HDx 1.0 1.8 6.0 2004 1695 A 57 LEU HBy A 58 PRO HDy 1.0 1.8 5.0 2005 1696 A 57 LEU HDy% A 61 LYS HBy 1.0 1.8 5.0 2006 1697 A 57 LEU HDy% A 61 LYS HBx 1.0 1.8 5.0 2007 1698 A 57 LEU HBx A 61 LYS HBx 1.0 1.8 5.0 2008 1699 A 57 LEU HBx A 61 LYS HBy 1.0 1.8 5.0 2009 1700 A 57 LEU HBx A 61 LYS H 1.0 1.8 6.0 2010 1701 A 57 LEU HBx A 61 LYS HBx 1.0 1.8 5.0 2011 1701 A 57 LEU HBx A 61 LYS HBy 1.0 1.8 5.0 2012 1702 A 57 LEU HDy% A 61 LYS HBx 1.0 1.8 3.5 2013 1702 A 57 LEU HDy% A 61 LYS HBy 1.0 1.8 3.5 2014 1703 A 57 LEU HDy% A 61 LYS HGy 1.0 1.8 5.0 2015 1703 A 57 LEU HDy% A 61 LYS HGx 1.0 1.8 5.0 2016 1704 A 62 LEU HDy% A 57 LEU HBy 1.0 1.8 5.0 2017 1705 A 57 LEU HDx% A 62 LEU HA 1.0 1.8 5.0 2018 1706 A 57 LEU HG A 62 LEU HA 1.0 1.8 6.0 2019 1707 A 57 LEU HDx% A 62 LEU HDy% 1.0 1.8 3.5 2020 1708 A 62 LEU HDx% A 57 LEU HBy 1.0 1.8 5.0 2021 1709 A 62 LEU HDx% A 57 LEU HDx% 1.0 1.8 5.0 2022 1710 A 57 LEU HG A 62 LEU HDy% 1.0 1.8 5.0 2023 1711 A 62 LEU HA A 57 LEU HBx 1.0 1.8 5.0 2024 1712 A 62 LEU HDy% A 57 LEU HBx 1.0 1.8 3.5 2025 1713 A 57 LEU H A 62 LEU HDy% 1.0 1.8 5.0 2026 1714 A 62 LEU HDx% A 57 LEU H 1.0 1.8 6.0 2027 1715 A 57 LEU H A 62 LEU HA 1.0 1.8 6.0 2028 1716 A 57 LEU HDx% A 63 ASP H 1.0 1.8 5.0 2029 1717 A 57 LEU HDx% A 66 ASN HBx 1.0 1.8 5.0 2030 1718 A 57 LEU HDy% A 66 ASN HBx 1.0 1.8 5.0 2031 1719 A 57 LEU HDy% A 66 ASN H 1.0 1.8 6.0 2032 1720 A 57 LEU HDx% A 66 ASN HBy 1.0 1.8 5.0 2033 1721 A 57 LEU HDy% A 66 ASN HBy 1.0 1.8 5.0 2034 1722 A 57 LEU HG A 66 ASN HBx 1.0 1.8 6.0 2035 1723 A 57 LEU HDx% A 66 ASN HD2y 1.0 1.8 6.0 2036 1724 A 57 LEU HDy% A 66 ASN HD2y 1.0 1.8 6.0 2037 1725 A 67 ILE HD1% A 57 LEU HDx% 1.0 1.8 5.0 2038 1726 A 57 LEU HDx% A 67 ILE HA 1.0 1.8 3.5 2039 1727 A 67 ILE H A 57 LEU HDy% 1.0 1.8 6.0 2040 1728 A 67 ILE HD1% A 57 LEU H 1.0 1.8 5.0 2041 1729 A 67 ILE HG2% A 57 LEU HDx% 1.0 1.8 5.0 2042 1730 A 57 LEU HDx% A 67 ILE HG1x 1.0 1.8 5.0 2043 1731 A 57 LEU HDy% A 67 ILE HA 1.0 1.8 5.0 2044 1732 A 67 ILE HG1y A 57 LEU HDx% 1.0 1.8 3.5 2045 1733 A 67 ILE H A 57 LEU HDx% 1.0 1.8 5.0 2046 1734 A 57 LEU HDx% A 70 ARG HBy 1.0 1.8 5.0 2047 1735 A 57 LEU HG A 70 ARG HBx 1.0 1.8 5.0 2048 1736 A 57 LEU HDy% A 70 ARG HDy 1.0 1.8 5.0 2049 1737 A 57 LEU HDy% A 70 ARG HDx 1.0 1.8 5.0 2050 1738 A 57 LEU HDx% A 70 ARG HBx 1.0 1.8 5.0 2051 1739 A 57 LEU HDx% A 70 ARG HGx 1.0 1.8 5.0 2052 1740 A 57 LEU HDy% A 70 ARG HGy 1.0 1.8 5.0 2053 1741 A 57 LEU HDy% A 70 ARG HBx 1.0 1.8 6.0 2054 1742 A 57 LEU HG A 70 ARG HBy 1.0 1.8 5.0 2055 1743 A 57 LEU HDy% A 70 ARG HGx 1.0 1.8 5.0 2056 1744 A 57 LEU HDx% A 70 ARG HGy 1.0 1.8 5.0 2057 1745 A 57 LEU HG A 70 ARG HGx 1.0 1.8 5.0 2058 1746 A 57 LEU HDx% A 70 ARG HDy 1.0 1.8 5.0 2059 1747 A 57 LEU HDy% A 70 ARG H 1.0 1.8 5.0 2060 1748 A 57 LEU HDx% A 70 ARG H 1.0 1.8 5.0 2061 1749 A 58 PRO HBy A 59 ASP HA 1.0 1.8 6.0 2062 1750 A 58 PRO HBy A 60 SER HA 1.0 1.8 6.0 2063 1751 A 58 PRO HBy A 60 SER HBy 1.0 1.8 5.0 2064 1751 A 58 PRO HBy A 60 SER HBx 1.0 1.8 5.0 2065 1752 A 61 LYS H A 58 PRO HBx 1.0 1.8 6.0 2066 1753 A 61 LYS H A 58 PRO HGy 1.0 1.8 5.0 2067 1754 A 58 PRO HGx A 61 LYS H 1.0 1.8 5.0 2068 1755 A 58 PRO HGx A 61 LYS HBx 1.0 1.8 5.0 2069 1755 A 58 PRO HGx A 61 LYS HBy 1.0 1.8 5.0 2070 1756 A 58 PRO HDy A 61 LYS HBx 1.0 1.8 5.0 2071 1756 A 58 PRO HDy A 61 LYS HBy 1.0 1.8 5.0 2072 1757 A 58 PRO HDy A 61 LYS HGy 1.0 1.8 5.0 2073 1757 A 58 PRO HDy A 61 LYS HGx 1.0 1.8 5.0 2074 1758 A 58 PRO HDx A 61 LYS HBx 1.0 1.8 5.0 2075 1758 A 58 PRO HDx A 61 LYS HBy 1.0 1.8 5.0 2076 1759 A 58 PRO HDx A 61 LYS HGy 1.0 1.8 6.0 2077 1759 A 58 PRO HDx A 61 LYS HGx 1.0 1.8 6.0 2078 1760 A 62 LEU HA A 58 PRO HDy 1.0 1.8 6.0 2079 1761 A 58 PRO HGy A 62 LEU H 1.0 1.8 6.0 2080 1762 A 61 LYS H A 59 ASP H 1.0 1.8 5.0 2081 1763 A 62 LEU HG A 59 ASP HA 1.0 1.8 5.0 2082 1764 A 59 ASP HA A 62 LEU H 1.0 1.8 5.0 2083 1765 A 62 LEU HDy% A 59 ASP HA 1.0 1.8 5.0 2084 1766 A 59 ASP HA A 62 LEU HBx 1.0 1.8 5.0 2085 1767 A 59 ASP HA A 62 LEU HBy 1.0 1.8 5.0 2086 1768 A 61 LYS H A 60 SER HBx 1.0 1.8 6.0 2087 1769 A 61 LYS H A 60 SER HBy 1.0 1.8 6.0 2088 1770 A 61 LYS H A 60 SER HBy 1.0 1.8 5.0 2089 1770 A 61 LYS H A 60 SER HBx 1.0 1.8 5.0 2090 1771 A 61 LYS HA A 61 LYS HDx 1.0 1.8 5.0 2091 1772 A 61 LYS HA A 61 LYS HDy 1.0 1.8 5.0 2092 1773 A 61 LYS HA A 61 LYS HEx 1.0 1.8 5.0 2093 1774 A 61 LYS HA A 61 LYS HEy 1.0 1.8 5.0 2094 1775 A 61 LYS HGx A 61 LYS HA 1.0 1.8 5.0 2095 1776 A 61 LYS HA A 61 LYS HGy 1.0 1.8 5.0 2096 1777 A 61 LYS HGx A 61 LYS HEx 1.0 1.8 5.0 2097 1778 A 61 LYS HGx A 61 LYS HEy 1.0 1.8 5.0 2098 1779 A 61 LYS HEx A 61 LYS HGy 1.0 1.8 5.0 2099 1780 A 61 LYS HEy A 61 LYS HGy 1.0 1.8 5.0 2100 1781 A 61 LYS H A 61 LYS HBy 1.0 1.8 5.0 2101 1782 A 61 LYS H A 61 LYS HBx 1.0 1.8 5.0 2102 1783 A 61 LYS H A 61 LYS HGx 1.0 1.8 5.0 2103 1784 A 61 LYS H A 61 LYS HGy 1.0 1.8 5.0 2104 1785 A 61 LYS H A 61 LYS HGy 1.0 1.8 5.0 2105 1785 A 61 LYS H A 61 LYS HGx 1.0 1.8 5.0 2106 1786 A 61 LYS H A 61 LYS HDx 1.0 1.8 5.0 2107 1786 A 61 LYS H A 61 LYS HDy 1.0 1.8 5.0 2108 1787 A 61 LYS HA A 61 LYS HGy 1.0 1.8 5.0 2109 1787 A 61 LYS HGx A 61 LYS HA 1.0 1.8 5.0 2110 1788 A 61 LYS HA A 61 LYS HDx 1.0 1.8 5.0 2111 1788 A 61 LYS HA A 61 LYS HDy 1.0 1.8 5.0 2112 1789 A 61 LYS HA A 61 LYS HEy 1.0 1.8 5.0 2113 1789 A 61 LYS HA A 61 LYS HEx 1.0 1.8 5.0 2114 1790 A 61 LYS HBx A 61 LYS HDx 1.0 1.8 3.5 2115 1790 A 61 LYS HBy A 61 LYS HDx 1.0 1.8 3.5 2116 1790 A 61 LYS HDy A 61 LYS HBx 1.0 1.8 3.5 2117 1790 A 61 LYS HBy A 61 LYS HDy 1.0 1.8 3.5 2118 1791 A 61 LYS HBy A 61 LYS HEy 1.0 1.8 5.0 2119 1791 A 61 LYS HBx A 61 LYS HEy 1.0 1.8 5.0 2120 1791 A 61 LYS HEx A 61 LYS HBx 1.0 1.8 5.0 2121 1791 A 61 LYS HBy A 61 LYS HEx 1.0 1.8 5.0 2122 1792 A 61 LYS HEx A 61 LYS HGy 1.0 1.8 3.5 2123 1792 A 61 LYS HEy A 61 LYS HGy 1.0 1.8 3.5 2124 1792 A 61 LYS HGx A 61 LYS HEy 1.0 1.8 3.5 2125 1792 A 61 LYS HGx A 61 LYS HEx 1.0 1.8 3.5 2126 1793 A 62 LEU H A 61 LYS HBx 1.0 1.8 5.0 2127 1794 A 61 LYS HBy A 62 LEU H 1.0 1.8 5.0 2128 1795 A 61 LYS H A 62 LEU H 1.0 1.8 3.5 2129 1796 A 62 LEU H A 61 LYS HBx 1.0 1.8 5.0 2130 1796 A 61 LYS HBy A 62 LEU H 1.0 1.8 5.0 2131 1797 A 62 LEU H A 61 LYS HGy 1.0 1.8 5.0 2132 1797 A 61 LYS HGx A 62 LEU H 1.0 1.8 5.0 2133 1798 A 62 LEU H A 61 LYS HDx 1.0 1.8 6.0 2134 1798 A 62 LEU H A 61 LYS HDy 1.0 1.8 6.0 2135 1799 A 62 LEU H A 61 LYS HEy 1.0 1.8 6.0 2136 1799 A 62 LEU H A 61 LYS HEx 1.0 1.8 6.0 2137 1800 A 63 ASP H A 61 LYS HA 1.0 1.8 5.0 2138 1801 A 66 ASN HBy A 61 LYS HA 1.0 1.8 6.0 2139 1802 A 66 ASN HBx A 61 LYS HBx 1.0 1.8 5.0 2140 1802 A 61 LYS HBy A 66 ASN HBx 1.0 1.8 5.0 2141 1803 A 66 ASN HBx A 61 LYS HDx 1.0 1.8 6.0 2142 1803 A 66 ASN HBx A 61 LYS HDy 1.0 1.8 6.0 2143 1804 A 62 LEU HDx% A 62 LEU HBy 1.0 1.8 5.0 2144 1805 A 62 LEU H A 62 LEU HBx 1.0 1.8 5.0 2145 1806 A 62 LEU HDx% A 62 LEU HA 1.0 1.8 5.0 2146 1807 A 62 LEU HDx% A 62 LEU HBx 1.0 1.8 5.0 2147 1808 A 62 LEU HDy% A 62 LEU HA 1.0 1.8 3.5 2148 1809 A 62 LEU HDy% A 62 LEU HBx 1.0 1.8 5.0 2149 1810 A 62 LEU HDy% A 62 LEU HBy 1.0 1.8 5.0 2150 1811 A 62 LEU HDy% A 62 LEU H 1.0 1.8 5.0 2151 1812 A 62 LEU HG A 62 LEU H 1.0 1.8 6.0 2152 1813 A 62 LEU H A 62 LEU HBy 1.0 1.8 5.0 2153 1814 A 62 LEU HDx% A 62 LEU H 1.0 1.8 5.0 2154 1815 A 62 LEU H A 62 LEU HBy 1.0 1.8 3.5 2155 1815 A 62 LEU H A 62 LEU HBx 1.0 1.8 3.5 2156 1816 A 62 LEU HDx% A 62 LEU HBy 1.0 1.8 3.5 2157 1816 A 62 LEU HDx% A 62 LEU HBx 1.0 1.8 3.5 2158 1817 A 62 LEU HDy% A 62 LEU HBy 1.0 1.8 3.5 2159 1817 A 62 LEU HDy% A 62 LEU HBx 1.0 1.8 3.5 2160 1818 A 62 LEU HDx% A 63 ASP H 1.0 1.8 5.0 2161 1819 A 62 LEU HDy% A 63 ASP H 1.0 1.8 5.0 2162 1820 A 63 ASP H A 62 LEU H 1.0 1.8 5.0 2163 1821 A 62 LEU HA A 63 ASP H 1.0 1.8 3.5 2164 1822 A 62 LEU H A 63 ASP HBx 1.0 1.8 6.0 2165 1822 A 62 LEU H A 63 ASP HBy 1.0 1.8 6.0 2166 1823 A 62 LEU HA A 66 ASN HBx 1.0 1.8 5.0 2167 1824 A 62 LEU HDy% A 66 ASN HBy 1.0 1.8 5.0 2168 1825 A 66 ASN HBx A 62 LEU H 1.0 1.8 6.0 2169 1826 A 67 ILE HD1% A 62 LEU HDy% 1.0 1.8 5.0 2170 1827 A 62 LEU HDx% A 67 ILE HD1% 1.0 1.8 5.0 2171 1828 A 67 ILE HD1% A 62 LEU HA 1.0 1.8 5.0 2172 1829 A 62 LEU HDx% A 67 ILE HG1y 1.0 1.8 5.0 2173 1830 A 62 LEU HDy% A 67 ILE HG1x 1.0 1.8 5.0 2174 1831 A 67 ILE HG1y A 62 LEU HDy% 1.0 1.8 5.0 2175 1832 A 62 LEU HDx% A 67 ILE HG1x 1.0 1.8 5.0 2176 1833 A 67 ILE H A 62 LEU HDx% 1.0 1.8 6.0 2177 1834 A 67 ILE H A 62 LEU HA 1.0 1.8 5.0 2178 1835 A 67 ILE HD1% A 62 LEU HBy 1.0 1.8 6.0 2179 1835 A 67 ILE HD1% A 62 LEU HBx 1.0 1.8 6.0 2180 1836 A 63 ASP H A 63 ASP HBx 1.0 1.8 5.0 2181 1837 A 63 ASP H A 63 ASP HBy 1.0 1.8 5.0 2182 1838 A 63 ASP H A 63 ASP HBx 1.0 1.8 3.5 2183 1838 A 63 ASP H A 63 ASP HBy 1.0 1.8 3.5 2184 1839 A 63 ASP HA A 65 ALA H 1.0 1.8 5.0 2185 1840 A 63 ASP H A 65 ALA H 1.0 1.8 6.0 2186 1841 A 65 ALA HB% A 63 ASP HBx 1.0 1.8 5.0 2187 1841 A 63 ASP HBy A 65 ALA HB% 1.0 1.8 5.0 2188 1842 A 63 ASP H A 66 ASN HBx 1.0 1.8 5.0 2189 1843 A 66 ASN HBy A 63 ASP HA 1.0 1.8 6.0 2190 1844 A 63 ASP H A 66 ASN HBy 1.0 1.8 3.5 2191 1845 A 63 ASP H A 66 ASN H 1.0 1.8 5.0 2192 1846 A 63 ASP H A 66 ASN HD2y 1.0 1.8 5.0 2193 1847 A 66 ASN H A 63 ASP HA 1.0 1.8 5.0 2194 1848 A 63 ASP H A 66 ASN HD2x 1.0 1.8 5.0 2195 1849 A 66 ASN H A 63 ASP HBx 1.0 1.8 5.0 2196 1849 A 66 ASN H A 63 ASP HBy 1.0 1.8 5.0 2197 1850 A 66 ASN HD2y A 63 ASP HBx 1.0 1.8 5.0 2198 1850 A 66 ASN HD2y A 63 ASP HBy 1.0 1.8 5.0 2199 1851 A 66 ASN HD2x A 63 ASP HBx 1.0 1.8 5.0 2200 1851 A 63 ASP HBy A 66 ASN HD2x 1.0 1.8 5.0 2201 1852 A 67 ILE HD1% A 63 ASP H 1.0 1.8 5.0 2202 1853 A 67 ILE HD1% A 63 ASP HA 1.0 1.8 6.0 2203 1854 A 67 ILE HG1y A 63 ASP H 1.0 1.8 5.0 2204 1855 A 67 ILE H A 63 ASP H 1.0 1.8 5.0 2205 1856 A 67 ILE H A 63 ASP HBx 1.0 1.8 6.0 2206 1856 A 67 ILE H A 63 ASP HBy 1.0 1.8 6.0 2207 1857 A 66 ASN H A 64 GLY HAy 1.0 1.8 5.0 2208 1858 A 67 ILE HD1% A 64 GLY HAy 1.0 1.8 5.0 2209 1859 A 67 ILE HG1x A 64 GLY HAy 1.0 1.8 5.0 2210 1860 A 67 ILE HG1y A 64 GLY HAy 1.0 1.8 5.0 2211 1861 A 67 ILE HB A 64 GLY HAy 1.0 1.8 5.0 2212 1862 A 67 ILE H A 64 GLY HAy 1.0 1.8 5.0 2213 1863 A 68 LYS H A 64 GLY HAy 1.0 1.8 5.0 2214 1864 A 65 ALA H A 65 ALA HB% 1.0 1.8 5.0 2215 1865 A 66 ASN H A 65 ALA HB% 1.0 1.8 5.0 2216 1866 A 66 ASN H A 65 ALA H 1.0 1.8 5.0 2217 1867 A 68 LYS HBx A 65 ALA HA 1.0 1.8 6.0 2218 1868 A 68 LYS HBy A 65 ALA HA 1.0 1.8 5.0 2219 1869 A 65 ALA HA A 68 LYS HDx 1.0 1.8 5.0 2220 1869 A 68 LYS HDy A 65 ALA HA 1.0 1.8 5.0 2221 1870 A 65 ALA HA A 68 LYS HEx 1.0 1.8 5.0 2222 1870 A 68 LYS HEy A 65 ALA HA 1.0 1.8 5.0 2223 1871 A 68 LYS HGx A 65 ALA HA 1.0 1.8 5.0 2224 1872 A 65 ALA HB% A 68 LYS HDx 1.0 1.8 5.0 2225 1872 A 68 LYS HDy A 65 ALA HB% 1.0 1.8 5.0 2226 1873 A 68 LYS HBy A 65 ALA HB% 1.0 1.8 5.0 2227 1874 A 68 LYS H A 65 ALA HA 1.0 1.8 5.0 2228 1875 A 68 LYS H A 65 ALA HB% 1.0 1.8 6.0 2229 1876 A 69 HIS H A 65 ALA HA 1.0 1.8 6.0 2230 1877 A 69 HIS H A 65 ALA HB% 1.0 1.8 6.0 2231 1878 A 66 ASN HD2x A 66 ASN HA 1.0 1.8 5.0 2232 1879 A 66 ASN H A 66 ASN HBy 1.0 1.8 5.0 2233 1880 A 66 ASN H A 66 ASN HD2y 1.0 1.8 5.0 2234 1881 A 66 ASN H A 66 ASN HD2x 1.0 1.8 5.0 2235 1882 A 66 ASN HD2y A 66 ASN HA 1.0 1.8 5.0 2236 1883 A 67 ILE HG1y A 66 ASN HBy 1.0 1.8 6.0 2237 1884 A 67 ILE H A 66 ASN HBx 1.0 1.8 5.0 2238 1885 A 67 ILE H A 66 ASN HBy 1.0 1.8 3.5 2239 1886 A 67 ILE H A 66 ASN HD2y 1.0 1.8 5.0 2240 1887 A 67 ILE H A 66 ASN HD2x 1.0 1.8 6.0 2241 1888 A 68 LYS H A 66 ASN H 1.0 1.8 5.0 2242 1889 A 68 LYS H A 66 ASN HA 1.0 1.8 5.0 2243 1890 A 66 ASN HA A 69 HIS HBx 1.0 1.8 5.0 2244 1891 A 66 ASN HA A 69 HIS HBy 1.0 1.8 5.0 2245 1892 A 69 HIS H A 66 ASN HA 1.0 1.8 5.0 2246 1893 A 66 ASN HA A 69 HIS HBx 1.0 1.8 3.5 2247 1893 A 66 ASN HA A 69 HIS HBy 1.0 1.8 3.5 2248 1894 A 70 ARG H A 66 ASN HA 1.0 1.8 5.0 2249 1895 A 67 ILE HD1% A 67 ILE HA 1.0 1.8 5.0 2250 1896 A 67 ILE HA A 67 ILE HG1x 1.0 1.8 5.0 2251 1897 A 67 ILE HG1y A 67 ILE HA 1.0 1.8 5.0 2252 1898 A 67 ILE HB A 67 ILE HD1% 1.0 1.8 3.5 2253 1899 A 67 ILE HG2% A 67 ILE HD1% 1.0 1.8 3.5 2254 1900 A 67 ILE HG2% A 67 ILE HA 1.0 1.8 5.0 2255 1901 A 67 ILE HG2% A 67 ILE HG1x 1.0 1.8 5.0 2256 1902 A 67 ILE HG2% A 67 ILE HG1y 1.0 1.8 5.0 2257 1903 A 67 ILE HB A 67 ILE H 1.0 1.8 3.5 2258 1904 A 67 ILE H A 67 ILE HD1% 1.0 1.8 5.0 2259 1905 A 67 ILE H A 67 ILE HG1x 1.0 1.8 5.0 2260 1906 A 67 ILE H A 67 ILE HG1y 1.0 1.8 3.5 2261 1907 A 67 ILE HG2% A 67 ILE H 1.0 1.8 5.0 2262 1908 A 67 ILE HG2% A 68 LYS HEx 1.0 1.8 6.0 2263 1908 A 68 LYS HEy A 67 ILE HG2% 1.0 1.8 6.0 2264 1909 A 68 LYS HGx A 67 ILE HG2% 1.0 1.8 6.0 2265 1910 A 68 LYS HA A 67 ILE HG2% 1.0 1.8 5.0 2266 1911 A 68 LYS HBy A 67 ILE H 1.0 1.8 5.0 2267 1912 A 68 LYS HGx A 67 ILE H 1.0 1.8 6.0 2268 1913 A 67 ILE H A 68 LYS HEx 1.0 1.8 6.0 2269 1913 A 68 LYS HEy A 67 ILE H 1.0 1.8 6.0 2270 1914 A 68 LYS H A 67 ILE HB 1.0 1.8 3.5 2271 1915 A 68 LYS H A 67 ILE HD1% 1.0 1.8 5.0 2272 1916 A 68 LYS H A 67 ILE HG1x 1.0 1.8 6.0 2273 1917 A 68 LYS H A 67 ILE HG1y 1.0 1.8 5.0 2274 1918 A 68 LYS H A 67 ILE HG2% 1.0 1.8 5.0 2275 1919 A 68 LYS H A 67 ILE H 1.0 1.8 3.5 2276 1920 A 69 HIS H A 67 ILE HG2% 1.0 1.8 5.0 2277 1921 A 69 HIS H A 67 ILE H 1.0 1.8 5.0 2278 1922 A 69 HIS H A 67 ILE HA 1.0 1.8 5.0 2279 1923 A 67 ILE HA A 70 ARG HBy 1.0 1.8 5.0 2280 1924 A 67 ILE HA A 70 ARG HBx 1.0 1.8 5.0 2281 1925 A 67 ILE HA A 70 ARG HGx 1.0 1.8 5.0 2282 1926 A 67 ILE HG2% A 70 ARG HBy 1.0 1.8 5.0 2283 1927 A 67 ILE HA A 70 ARG H 1.0 1.8 5.0 2284 1928 A 67 ILE HG2% A 70 ARG H 1.0 1.8 5.0 2285 1929 A 67 ILE H A 70 ARG H 1.0 1.8 6.0 2286 1930 A 71 LEU HDy% A 67 ILE HG2% 1.0 1.8 5.0 2287 1931 A 71 LEU HDx% A 67 ILE HG2% 1.0 1.8 3.5 2288 1932 A 71 LEU HG A 67 ILE HG2% 1.0 1.8 5.0 2289 1933 A 71 LEU HDx% A 67 ILE HB 1.0 1.8 5.0 2290 1934 A 71 LEU HDx% A 67 ILE HD1% 1.0 1.8 5.0 2291 1935 A 71 LEU HBy A 67 ILE HG2% 1.0 1.8 5.0 2292 1936 A 71 LEU H A 67 ILE HG2% 1.0 1.8 5.0 2293 1937 A 72 ALA H A 67 ILE HG2% 1.0 1.8 6.0 2294 1938 A 68 LYS HA A 68 LYS HGy 1.0 1.8 5.0 2295 1939 A 68 LYS HGy A 68 LYS HEx 1.0 1.8 5.0 2296 1939 A 68 LYS HGy A 68 LYS HEy 1.0 1.8 5.0 2297 1940 A 68 LYS HGx A 68 LYS HA 1.0 1.8 5.0 2298 1941 A 68 LYS HBx A 68 LYS HDx 1.0 1.8 3.5 2299 1941 A 68 LYS HBx A 68 LYS HDy 1.0 1.8 3.5 2300 1942 A 68 LYS HBy A 68 LYS HDx 1.0 1.8 5.0 2301 1942 A 68 LYS HBy A 68 LYS HDy 1.0 1.8 5.0 2302 1943 A 68 LYS HBy A 68 LYS HEx 1.0 1.8 5.0 2303 1943 A 68 LYS HBy A 68 LYS HEy 1.0 1.8 5.0 2304 1944 A 68 LYS H A 68 LYS HBx 1.0 1.8 5.0 2305 1945 A 68 LYS HA A 68 LYS HDx 1.0 1.8 5.0 2306 1945 A 68 LYS HA A 68 LYS HDy 1.0 1.8 5.0 2307 1946 A 68 LYS HGx A 68 LYS HEx 1.0 1.8 5.0 2308 1946 A 68 LYS HGx A 68 LYS HEy 1.0 1.8 5.0 2309 1947 A 68 LYS H A 68 LYS HGy 1.0 1.8 5.0 2310 1948 A 68 LYS HGx A 68 LYS H 1.0 1.8 3.5 2311 1949 A 68 LYS H A 68 LYS HBy 1.0 1.8 3.5 2312 1950 A 68 LYS H A 68 LYS HDx 1.0 1.8 5.0 2313 1950 A 68 LYS H A 68 LYS HDy 1.0 1.8 5.0 2314 1951 A 68 LYS H A 69 HIS HA 1.0 1.8 6.0 2315 1952 A 68 LYS HBx A 69 HIS H 1.0 1.8 5.0 2316 1953 A 68 LYS HBy A 69 HIS H 1.0 1.8 5.0 2317 1954 A 69 HIS H A 68 LYS HDx 1.0 1.8 5.0 2318 1954 A 68 LYS HDy A 69 HIS H 1.0 1.8 5.0 2319 1955 A 68 LYS H A 69 HIS H 1.0 1.8 3.5 2320 1956 A 68 LYS H A 70 ARG H 1.0 1.8 5.0 2321 1957 A 68 LYS HA A 71 LEU HBx 1.0 1.8 5.0 2322 1958 A 68 LYS HA A 71 LEU HBy 1.0 1.8 5.0 2323 1959 A 68 LYS HA A 71 LEU HDx% 1.0 1.8 5.0 2324 1960 A 68 LYS HBx A 71 LEU HBy 1.0 1.8 6.0 2325 1961 A 68 LYS HGy A 71 LEU HDx% 1.0 1.8 5.0 2326 1962 A 68 LYS HA A 71 LEU H 1.0 1.8 5.0 2327 1963 A 68 LYS H A 71 LEU HDx% 1.0 1.8 6.0 2328 1964 A 72 ALA HB% A 68 LYS HBx 1.0 1.8 5.0 2329 1965 A 72 ALA H A 68 LYS HA 1.0 1.8 5.0 2330 1966 A 69 HIS HA A 69 HIS HD2 1.0 1.8 5.0 2331 1967 A 69 HIS H A 69 HIS HBx 1.0 1.8 3.5 2332 1968 A 69 HIS H A 69 HIS HBy 1.0 1.8 3.5 2333 1969 A 69 HIS H A 69 HIS HD2 1.0 1.8 6.0 2334 1970 A 70 ARG H A 69 HIS HBx 1.0 1.8 5.0 2335 1971 A 70 ARG H A 69 HIS HBy 1.0 1.8 5.0 2336 1972 A 70 ARG H A 69 HIS HD2 1.0 1.8 6.0 2337 1973 A 69 HIS H A 70 ARG H 1.0 1.8 3.5 2338 1974 A 70 ARG H A 69 HIS HBx 1.0 1.8 3.5 2339 1974 A 70 ARG H A 69 HIS HBy 1.0 1.8 3.5 2340 1975 A 69 HIS H A 71 LEU H 1.0 1.8 5.0 2341 1976 A 69 HIS H A 71 LEU HBy 1.0 1.8 6.0 2342 1977 A 72 ALA HB% A 69 HIS HA 1.0 1.8 5.0 2343 1978 A 72 ALA H A 69 HIS HA 1.0 1.8 5.0 2344 1979 A 72 ALA HB% A 69 HIS H 1.0 1.8 5.0 2345 1980 A 72 ALA H A 69 HIS H 1.0 1.8 5.0 2346 1981 A 73 LEU HDx% A 69 HIS HD2 1.0 1.8 5.0 2347 1982 A 69 HIS HA A 73 LEU HBy 1.0 1.8 6.0 2348 1983 A 73 LEU H A 69 HIS HA 1.0 1.8 5.0 2349 1984 A 73 LEU HDx% A 69 HIS HBx 1.0 1.8 6.0 2350 1984 A 73 LEU HDx% A 69 HIS HBy 1.0 1.8 6.0 2351 1985 A 70 ARG HDy A 70 ARG HA 1.0 1.8 5.0 2352 1986 A 70 ARG HBy A 70 ARG HGy 1.0 1.8 3.5 2353 1987 A 70 ARG HDx A 70 ARG HA 1.0 1.8 5.0 2354 1988 A 70 ARG HDx A 70 ARG H 1.0 1.8 5.0 2355 1989 A 70 ARG HBy A 70 ARG H 1.0 1.8 3.5 2356 1990 A 70 ARG HBx A 70 ARG H 1.0 1.8 5.0 2357 1991 A 70 ARG HDy A 70 ARG H 1.0 1.8 5.0 2358 1992 A 70 ARG HGx A 70 ARG H 1.0 1.8 5.0 2359 1993 A 70 ARG HGy A 70 ARG H 1.0 1.8 5.0 2360 1994 A 71 LEU HDy% A 70 ARG HGx 1.0 1.8 6.0 2361 1995 A 71 LEU HBy A 70 ARG H 1.0 1.8 6.0 2362 1996 A 71 LEU H A 70 ARG H 1.0 1.8 3.5 2363 1997 A 71 LEU H A 70 ARG HBy 1.0 1.8 5.0 2364 1998 A 71 LEU H A 70 ARG HBx 1.0 1.8 5.0 2365 1999 A 71 LEU H A 70 ARG HGx 1.0 1.8 5.0 2366 2000 A 71 LEU H A 70 ARG HGy 1.0 1.8 5.0 2367 2001 A 72 ALA HB% A 70 ARG HA 1.0 1.8 6.0 2368 2002 A 72 ALA H A 70 ARG H 1.0 1.8 5.0 2369 2003 A 72 ALA HB% A 70 ARG H 1.0 1.8 5.0 2370 2004 A 72 ALA H A 70 ARG HA 1.0 1.8 5.0 2371 2005 A 73 LEU HDx% A 70 ARG HA 1.0 1.8 5.0 2372 2006 A 70 ARG HA A 73 LEU HBx 1.0 1.8 6.0 2373 2007 A 73 LEU HBy A 70 ARG HA 1.0 1.8 5.0 2374 2008 A 73 LEU HDx% A 70 ARG HDy 1.0 1.8 6.0 2375 2009 A 73 LEU HDx% A 70 ARG HDx 1.0 1.8 5.0 2376 2010 A 73 LEU HDx% A 70 ARG HBx 1.0 1.8 6.0 2377 2011 A 73 LEU HDx% A 70 ARG H 1.0 1.8 5.0 2378 2012 A 73 LEU H A 70 ARG HA 1.0 1.8 5.0 2379 2013 A 73 LEU HBy A 70 ARG H 1.0 1.8 6.0 2380 2014 A 74 TRP H A 70 ARG HA 1.0 1.8 5.0 2381 2015 A 71 LEU HDx% A 71 LEU HA 1.0 1.8 5.0 2382 2016 A 71 LEU HBy A 71 LEU HDx% 1.0 1.8 5.0 2383 2017 A 71 LEU HDx% A 71 LEU HBx 1.0 1.8 5.0 2384 2018 A 71 LEU HA A 71 LEU HDy% 1.0 1.8 3.5 2385 2019 A 71 LEU HBy A 71 LEU HDy% 1.0 1.8 3.5 2386 2020 A 71 LEU HBx A 71 LEU HDy% 1.0 1.8 5.0 2387 2021 A 71 LEU HBy A 71 LEU H 1.0 1.8 5.0 2388 2022 A 71 LEU HBx A 71 LEU H 1.0 1.8 5.0 2389 2023 A 71 LEU HDx% A 71 LEU H 1.0 1.8 5.0 2390 2024 A 71 LEU H A 71 LEU HDy% 1.0 1.8 5.0 2391 2025 A 71 LEU H A 71 LEU HG 1.0 1.8 3.5 2392 2026 A 72 ALA HB% A 71 LEU H 1.0 1.8 5.0 2393 2027 A 72 ALA H A 71 LEU HBy 1.0 1.8 5.0 2394 2028 A 72 ALA H A 71 LEU HBx 1.0 1.8 5.0 2395 2029 A 72 ALA H A 71 LEU HDx% 1.0 1.8 6.0 2396 2030 A 72 ALA H A 71 LEU HDy% 1.0 1.8 5.0 2397 2031 A 72 ALA H A 71 LEU HG 1.0 1.8 5.0 2398 2032 A 73 LEU H A 71 LEU H 1.0 1.8 5.0 2399 2033 A 73 LEU H A 71 LEU HA 1.0 1.8 5.0 2400 2034 A 71 LEU HA A 74 TRP HBy 1.0 1.8 5.0 2401 2035 A 71 LEU HA A 74 TRP HBx 1.0 1.8 5.0 2402 2036 A 71 LEU H A 74 TRP HBy 1.0 1.8 6.0 2403 2037 A 71 LEU HA A 74 TRP HA 1.0 1.8 6.0 2404 2038 A 71 LEU HDy% A 74 TRP HZ3 1.0 1.8 5.0 2405 2039 A 74 TRP H A 71 LEU HA 1.0 1.8 5.0 2406 2040 A 71 LEU H A 74 TRP HBx 1.0 1.8 6.0 2407 2041 A 74 TRP H A 71 LEU HBy 1.0 1.8 6.0 2408 2042 A 75 ILE HG2% A 71 LEU HBx 1.0 1.8 5.0 2409 2043 A 71 LEU HDy% A 75 ILE HB 1.0 1.8 6.0 2410 2044 A 75 ILE HG2% A 71 LEU HA 1.0 1.8 5.0 2411 2045 A 75 ILE H A 71 LEU HA 1.0 1.8 5.0 2412 2046 A 75 ILE H A 71 LEU HDy% 1.0 1.8 6.0 2413 2047 A 72 ALA HB% A 72 ALA H 1.0 1.8 3.5 2414 2048 A 72 ALA HB% A 73 LEU HBy 1.0 1.8 5.0 2415 2049 A 73 LEU HDx% A 72 ALA HB% 1.0 1.8 5.0 2416 2050 A 72 ALA H A 73 LEU HBy 1.0 1.8 6.0 2417 2051 A 73 LEU HDx% A 72 ALA H 1.0 1.8 6.0 2418 2052 A 72 ALA HB% A 73 LEU H 1.0 1.8 3.5 2419 2053 A 73 LEU H A 72 ALA H 1.0 1.8 3.5 2420 2054 A 72 ALA HA A 74 TRP H 1.0 1.8 6.0 2421 2055 A 72 ALA H A 74 TRP H 1.0 1.8 5.0 2422 2056 A 72 ALA HA A 75 ILE HG2% 1.0 1.8 3.5 2423 2057 A 72 ALA HB% A 75 ILE HG2% 1.0 1.8 5.0 2424 2058 A 72 ALA HA A 75 ILE HB 1.0 1.8 5.0 2425 2059 A 72 ALA HA A 75 ILE H 1.0 1.8 5.0 2426 2060 A 72 ALA HB% A 75 ILE H 1.0 1.8 6.0 2427 2061 A 72 ALA HB% A 76 HIS HBy 1.0 1.8 5.0 2428 2062 A 72 ALA HB% A 76 HIS H 1.0 1.8 6.0 2429 2063 A 73 LEU HDx% A 73 LEU HA 1.0 1.8 5.0 2430 2064 A 73 LEU HA A 73 LEU HG 1.0 1.8 5.0 2431 2065 A 73 LEU HDx% A 73 LEU HBx 1.0 1.8 3.5 2432 2066 A 73 LEU H A 73 LEU HBx 1.0 1.8 5.0 2433 2067 A 73 LEU HDx% A 73 LEU HBy 1.0 1.8 3.5 2434 2068 A 73 LEU HDy% A 73 LEU HA 1.0 1.8 3.5 2435 2069 A 73 LEU HDy% A 73 LEU HBx 1.0 1.8 3.5 2436 2070 A 73 LEU HDy% A 73 LEU HBy 1.0 1.8 3.5 2437 2071 A 73 LEU H A 73 LEU HBy 1.0 1.8 3.5 2438 2072 A 73 LEU HDx% A 73 LEU H 1.0 1.8 3.5 2439 2073 A 73 LEU HDy% A 73 LEU H 1.0 1.8 5.0 2440 2074 A 73 LEU HG A 73 LEU H 1.0 1.8 5.0 2441 2075 A 74 TRP HA A 73 LEU HBx 1.0 1.8 5.0 2442 2076 A 73 LEU HDy% A 74 TRP HA 1.0 1.8 6.0 2443 2077 A 73 LEU HDx% A 74 TRP H 1.0 1.8 5.0 2444 2078 A 73 LEU HDy% A 74 TRP H 1.0 1.8 6.0 2445 2079 A 73 LEU H A 74 TRP HBy 1.0 1.8 6.0 2446 2080 A 73 LEU H A 74 TRP HBx 1.0 1.8 5.0 2447 2081 A 73 LEU H A 74 TRP H 1.0 1.8 3.5 2448 2082 A 74 TRP H A 73 LEU HBx 1.0 1.8 5.0 2449 2083 A 74 TRP H A 73 LEU HBy 1.0 1.8 3.5 2450 2084 A 73 LEU H A 75 ILE HG2% 1.0 1.8 6.0 2451 2085 A 73 LEU H A 75 ILE H 1.0 1.8 5.0 2452 2086 A 73 LEU HA A 76 HIS HBy 1.0 1.8 5.0 2453 2087 A 73 LEU HA A 76 HIS HBx 1.0 1.8 5.0 2454 2088 A 73 LEU HDx% A 76 HIS HBy 1.0 1.8 6.0 2455 2089 A 73 LEU HDy% A 76 HIS HBx 1.0 1.8 5.0 2456 2090 A 76 HIS HBx A 73 LEU HBx 1.0 1.8 5.0 2457 2091 A 73 LEU HA A 76 HIS H 1.0 1.8 5.0 2458 2092 A 73 LEU H A 76 HIS HBy 1.0 1.8 5.0 2459 2093 A 73 LEU HA A 77 ALA H 1.0 1.8 5.0 2460 2094 A 73 LEU HDy% A 77 ALA H 1.0 1.8 6.0 2461 2095 A 74 TRP HD1 A 74 TRP HA 1.0 1.8 3.5 2462 2096 A 74 TRP H A 74 TRP HBy 1.0 1.8 3.5 2463 2097 A 74 TRP H A 74 TRP HBx 1.0 1.8 3.5 2464 2098 A 74 TRP HE1 A 74 TRP HA 1.0 1.8 6.0 2465 2099 A 74 TRP HE1 A 74 TRP HBy 1.0 1.8 6.0 2466 2100 A 75 ILE HD1% A 74 TRP HZ3 1.0 1.8 5.0 2467 2101 A 75 ILE HD1% A 74 TRP HH2 1.0 1.8 5.0 2468 2102 A 75 ILE HG2% A 74 TRP HBx 1.0 1.8 5.0 2469 2103 A 75 ILE HG2% A 74 TRP HZ3 1.0 1.8 6.0 2470 2104 A 74 TRP H A 75 ILE HG2% 1.0 1.8 5.0 2471 2105 A 75 ILE H A 74 TRP HBy 1.0 1.8 5.0 2472 2106 A 75 ILE H A 74 TRP HBx 1.0 1.8 3.5 2473 2107 A 75 ILE H A 74 TRP HZ3 1.0 1.8 5.0 2474 2108 A 76 HIS H A 74 TRP H 1.0 1.8 5.0 2475 2109 A 76 HIS H A 74 TRP HA 1.0 1.8 5.0 2476 2110 A 74 TRP HA A 77 ALA HB% 1.0 1.8 5.0 2477 2111 A 74 TRP HA A 77 ALA H 1.0 1.8 5.0 2478 2112 A 74 TRP H A 77 ALA H 1.0 1.8 6.0 2479 2113 A 74 TRP HA A 78 ALA H 1.0 1.8 5.0 2480 2114 A 74 TRP HA A 78 ALA HB% 1.0 1.8 5.0 2481 2115 A 74 TRP HE1 A 78 ALA HB% 1.0 1.8 5.0 2482 2116 A 75 ILE HA A 75 ILE HG1x 1.0 1.8 5.0 2483 2117 A 75 ILE HG2% A 75 ILE HA 1.0 1.8 5.0 2484 2118 A 75 ILE HD1% A 75 ILE HA 1.0 1.8 3.5 2485 2119 A 75 ILE HD1% A 75 ILE HB 1.0 1.8 3.5 2486 2120 A 75 ILE HD1% A 75 ILE H 1.0 1.8 5.0 2487 2121 A 75 ILE H A 75 ILE HG1y 1.0 1.8 6.0 2488 2122 A 75 ILE HG2% A 75 ILE HD1% 1.0 1.8 5.0 2489 2123 A 75 ILE HG2% A 75 ILE HG1x 1.0 1.8 2.7 2490 2124 A 75 ILE H A 75 ILE HB 1.0 1.8 3.5 2491 2125 A 75 ILE HG2% A 75 ILE H 1.0 1.8 3.5 2492 2126 A 75 ILE HG2% A 76 HIS HA 1.0 1.8 5.0 2493 2127 A 75 ILE HG1x A 76 HIS HA 1.0 1.8 5.0 2494 2128 A 76 HIS HBy A 75 ILE HG2% 1.0 1.8 5.0 2495 2129 A 76 HIS HBx A 75 ILE HG2% 1.0 1.8 5.0 2496 2130 A 76 HIS HD2 A 75 ILE HG2% 1.0 1.8 5.0 2497 2131 A 76 HIS HBy A 75 ILE H 1.0 1.8 5.0 2498 2132 A 76 HIS H A 75 ILE H 1.0 1.8 3.5 2499 2133 A 76 HIS H A 75 ILE HB 1.0 1.8 5.0 2500 2134 A 76 HIS H A 75 ILE HD1% 1.0 1.8 5.0 2501 2135 A 76 HIS H A 75 ILE HG1x 1.0 1.8 5.0 2502 2136 A 76 HIS H A 75 ILE HG2% 1.0 1.8 3.5 2503 2137 A 75 ILE H A 77 ALA H 1.0 1.8 5.0 2504 2138 A 75 ILE HA A 78 ALA HB% 1.0 1.8 5.0 2505 2139 A 75 ILE HD1% A 78 ALA HB% 1.0 1.8 3.5 2506 2140 A 75 ILE HD1% A 78 ALA HA 1.0 1.8 6.0 2507 2141 A 75 ILE HG1y A 78 ALA HB% 1.0 1.8 5.0 2508 2142 A 75 ILE HG1x A 78 ALA HB% 1.0 1.8 5.0 2509 2143 A 75 ILE HA A 78 ALA H 1.0 1.8 5.0 2510 2144 A 75 ILE HD1% A 78 ALA H 1.0 1.8 5.0 2511 2145 A 75 ILE HG2% A 78 ALA H 1.0 1.8 6.0 2512 2146 A 75 ILE HG1x A 78 ALA H 1.0 1.8 6.0 2513 2147 A 75 ILE H A 78 ALA H 1.0 1.8 5.0 2514 2148 A 75 ILE HD1% A 79 LEU HDy% 1.0 1.8 5.0 2515 2149 A 75 ILE HG2% A 79 LEU HDx% 1.0 1.8 5.0 2516 2150 A 75 ILE HG2% A 79 LEU H 1.0 1.8 6.0 2517 2151 A 79 LEU HDx% A 75 ILE HG1y 1.0 1.8 5.0 2518 2152 A 75 ILE HG1y A 79 LEU HDy% 1.0 1.8 6.0 2519 2153 A 75 ILE HD1% A 79 LEU HDx% 1.0 1.8 5.0 2520 2154 A 75 ILE HD1% A 79 LEU HA 1.0 1.8 5.0 2521 2155 A 75 ILE HG1x A 79 LEU HDx% 1.0 1.8 5.0 2522 2156 A 75 ILE HG1x A 79 LEU HG 1.0 1.8 5.0 2523 2157 A 75 ILE HA A 79 LEU H 1.0 1.8 5.0 2524 2158 A 75 ILE HD1% A 79 LEU H 1.0 1.8 5.0 2525 2159 A 85 LEU HDy% A 75 ILE HD1% 1.0 1.8 5.0 2526 2160 A 85 LEU HDx% A 75 ILE HG2% 1.0 1.8 5.0 2527 2161 A 85 LEU HDy% A 75 ILE HG1x 1.0 1.8 5.0 2528 2162 A 85 LEU HDy% A 75 ILE HG2% 1.0 1.8 5.0 2529 2163 A 85 LEU HDy% A 75 ILE HG1y 1.0 1.8 5.0 2530 2164 A 76 HIS HD2 A 76 HIS HA 1.0 1.8 5.0 2531 2165 A 76 HIS HBy A 76 HIS H 1.0 1.8 3.5 2532 2166 A 76 HIS HBx A 76 HIS H 1.0 1.8 3.5 2533 2167 A 76 HIS HD2 A 76 HIS H 1.0 1.8 5.0 2534 2168 A 76 HIS H A 77 ALA HB% 1.0 1.8 6.0 2535 2169 A 76 HIS HBy A 77 ALA H 1.0 1.8 5.0 2536 2170 A 76 HIS HBx A 77 ALA H 1.0 1.8 5.0 2537 2171 A 76 HIS H A 77 ALA H 1.0 1.8 3.5 2538 2172 A 76 HIS HA A 78 ALA H 1.0 1.8 5.0 2539 2173 A 76 HIS H A 78 ALA H 1.0 1.8 5.0 2540 2174 A 76 HIS H A 78 ALA HB% 1.0 1.8 5.0 2541 2175 A 76 HIS HA A 79 LEU HBy 1.0 1.8 5.0 2542 2176 A 76 HIS HA A 79 LEU HDx% 1.0 1.8 3.5 2543 2177 A 76 HIS HA A 79 LEU HG 1.0 1.8 5.0 2544 2178 A 76 HIS HD2 A 79 LEU HBy 1.0 1.8 6.0 2545 2179 A 76 HIS HD2 A 79 LEU HDx% 1.0 1.8 5.0 2546 2180 A 76 HIS HA A 79 LEU H 1.0 1.8 5.0 2547 2181 A 76 HIS H A 79 LEU H 1.0 1.8 6.0 2548 2182 A 85 LEU HDx% A 76 HIS HA 1.0 1.8 5.0 2549 2183 A 77 ALA H A 77 ALA HB% 1.0 1.8 2.7 2550 2184 A 77 ALA HB% A 78 ALA HA 1.0 1.8 5.0 2551 2185 A 77 ALA HB% A 78 ALA HB% 1.0 1.8 5.0 2552 2186 A 78 ALA H A 77 ALA HA 1.0 1.8 5.0 2553 2187 A 77 ALA HB% A 78 ALA H 1.0 1.8 3.5 2554 2188 A 77 ALA H A 78 ALA H 1.0 1.8 3.5 2555 2189 A 79 LEU H A 77 ALA HA 1.0 1.8 5.0 2556 2190 A 77 ALA H A 79 LEU H 1.0 1.8 5.0 2557 2191 A 78 ALA H A 78 ALA HB% 1.0 1.8 2.7 2558 2192 A 79 LEU HDy% A 78 ALA HB% 1.0 1.8 5.0 2559 2193 A 78 ALA H A 79 LEU HG 1.0 1.8 5.0 2560 2194 A 78 ALA H A 79 LEU H 1.0 1.8 3.5 2561 2195 A 78 ALA HB% A 79 LEU H 1.0 1.8 3.5 2562 2196 A 79 LEU HDx% A 79 LEU HA 1.0 1.8 5.0 2563 2197 A 79 LEU HDx% A 79 LEU HBx 1.0 1.8 5.0 2564 2198 A 79 LEU HDx% A 79 LEU HBy 1.0 1.8 5.0 2565 2199 A 79 LEU HDy% A 79 LEU HA 1.0 1.8 3.5 2566 2200 A 79 LEU HDy% A 79 LEU HBx 1.0 1.8 3.5 2567 2201 A 79 LEU HDy% A 79 LEU HBy 1.0 1.8 5.0 2568 2202 A 79 LEU H A 79 LEU HBx 1.0 1.8 5.0 2569 2203 A 79 LEU H A 79 LEU HBy 1.0 1.8 3.5 2570 2204 A 79 LEU HDx% A 79 LEU H 1.0 1.8 5.0 2571 2205 A 79 LEU HDy% A 79 LEU H 1.0 1.8 3.5 2572 2206 A 79 LEU H A 79 LEU HG 1.0 1.8 3.5 2573 2207 A 79 LEU HBx A 80 PRO HDy 1.0 1.8 5.0 2574 2208 A 79 LEU HA A 80 PRO HDx 1.0 1.8 3.5 2575 2209 A 79 LEU HA A 80 PRO HDy 1.0 1.8 3.5 2576 2210 A 79 LEU HBy A 80 PRO HDy 1.0 1.8 5.0 2577 2211 A 79 LEU HDy% A 80 PRO HDx 1.0 1.8 5.0 2578 2212 A 79 LEU HBy A 80 PRO HDx 1.0 1.8 6.0 2579 2213 A 79 LEU HBx A 80 PRO HDx 1.0 1.8 5.0 2580 2214 A 79 LEU HDy% A 80 PRO HDy 1.0 1.8 5.0 2581 2215 A 79 LEU H A 80 PRO HDx 1.0 1.8 6.0 2582 2216 A 79 LEU HBx A 81 ASP HBy 1.0 1.8 5.0 2583 2216 A 79 LEU HBx A 81 ASP HBx 1.0 1.8 5.0 2584 2217 A 79 LEU HDx% A 81 ASP HBy 1.0 1.8 6.0 2585 2217 A 79 LEU HDx% A 81 ASP HBx 1.0 1.8 6.0 2586 2218 A 85 LEU HG A 79 LEU HDy% 1.0 1.8 6.0 2587 2219 A 79 LEU HDx% A 85 LEU HA 1.0 1.8 5.0 2588 2220 A 85 LEU HDx% A 79 LEU HDx% 1.0 1.8 5.0 2589 2221 A 85 LEU HBy A 79 LEU HDx% 1.0 1.8 6.0 2590 2222 A 85 LEU HBx A 79 LEU HDx% 1.0 1.8 5.0 2591 2223 A 85 LEU HDy% A 79 LEU HDx% 1.0 1.8 3.5 2592 2224 A 85 LEU HDy% A 79 LEU HDy% 1.0 1.8 5.0 2593 2225 A 79 LEU HDx% A 85 LEU HG 1.0 1.8 5.0 2594 2226 A 79 LEU HDx% A 85 LEU H 1.0 1.8 5.0 2595 2227 A 81 ASP H A 80 PRO HGx 1.0 1.8 6.0 2596 2227 A 80 PRO HGy A 81 ASP H 1.0 1.8 6.0 2597 2228 A 80 PRO HDy A 81 ASP HBy 1.0 1.8 5.0 2598 2228 A 80 PRO HDy A 81 ASP HBx 1.0 1.8 5.0 2599 2229 A 83 ASP HA A 81 ASP HBy 1.0 1.8 5.0 2600 2229 A 81 ASP HBx A 83 ASP HA 1.0 1.8 5.0 2601 2230 A 81 ASP HBx A 83 ASP HBy 1.0 1.8 6.0 2602 2230 A 81 ASP HBy A 83 ASP HBy 1.0 1.8 6.0 2603 2230 A 83 ASP HBx A 81 ASP HBy 1.0 1.8 6.0 2604 2230 A 81 ASP HBx A 83 ASP HBx 1.0 1.8 6.0 2605 2231 A 83 ASP HA A 84 PRO HDx 1.0 1.8 3.5 2606 2232 A 83 ASP HA A 84 PRO HDy 1.0 1.8 3.5 2607 2233 A 85 LEU H A 83 ASP HA 1.0 1.8 5.0 2608 2234 A 85 LEU H A 84 PRO HBx 1.0 1.8 5.0 2609 2235 A 85 LEU H A 84 PRO HBy 1.0 1.8 5.0 2610 2236 A 85 LEU H A 84 PRO HGx 1.0 1.8 5.0 2611 2236 A 85 LEU H A 84 PRO HGy 1.0 1.8 5.0 2612 2237 A 85 LEU H A 84 PRO HBy 1.0 1.8 5.0 2613 2237 A 85 LEU H A 84 PRO HBx 1.0 1.8 5.0 2614 2238 A 85 LEU H A 84 PRO HDx 1.0 1.8 5.0 2615 2238 A 85 LEU H A 84 PRO HDy 1.0 1.8 5.0 2616 2239 A 84 PRO HA A 86 LYS H 1.0 1.8 5.0 2617 2240 A 86 LYS H A 84 PRO HGx 1.0 1.8 3.5 2618 2240 A 84 PRO HGy A 86 LYS H 1.0 1.8 3.5 2619 2241 A 86 LYS H A 84 PRO HBy 1.0 1.8 5.0 2620 2241 A 84 PRO HBx A 86 LYS H 1.0 1.8 5.0 2621 2242 A 86 LYS H A 84 PRO HDx 1.0 1.8 5.0 2622 2242 A 84 PRO HDy A 86 LYS H 1.0 1.8 5.0 2623 2243 A 85 LEU HG A 85 LEU HA 1.0 1.8 5.0 2624 2244 A 85 LEU HDx% A 85 LEU HA 1.0 1.8 5.0 2625 2245 A 85 LEU HDx% A 85 LEU HBx 1.0 1.8 3.5 2626 2246 A 85 LEU HDx% A 85 LEU HBy 1.0 1.8 3.5 2627 2247 A 85 LEU HDy% A 85 LEU HA 1.0 1.8 3.5 2628 2248 A 85 LEU HDy% A 85 LEU HBx 1.0 1.8 3.5 2629 2249 A 85 LEU HDy% A 85 LEU HBy 1.0 1.8 3.5 2630 2250 A 85 LEU HDy% A 85 LEU H 1.0 1.8 5.0 2631 2251 A 85 LEU HBx A 85 LEU H 1.0 1.8 5.0 2632 2252 A 85 LEU HBy A 85 LEU H 1.0 1.8 5.0 2633 2253 A 85 LEU HDx% A 85 LEU H 1.0 1.8 5.0 2634 2254 A 85 LEU HG A 85 LEU H 1.0 1.8 3.5 2635 2255 A 85 LEU HA A 86 LYS H 1.0 1.8 3.5 2636 2256 A 85 LEU HBy A 86 LYS H 1.0 1.8 5.0 2637 2257 A 85 LEU HDx% A 86 LYS H 1.0 1.8 5.0 2638 2258 A 85 LEU HG A 86 LYS H 1.0 1.8 5.0 2639 2259 A 85 LEU H A 86 LYS H 1.0 1.8 3.5 2640 2260 A 86 LYS HA A 86 LYS HDx 1.0 1.8 5.0 2641 2261 A 86 LYS HA A 86 LYS HGx 1.0 1.8 5.0 2642 2261 A 86 LYS HA A 86 LYS HGy 1.0 1.8 5.0 2643 2262 A 86 LYS HA A 86 LYS HDy 1.0 1.8 5.0 2644 2263 A 86 LYS HEy A 86 LYS HGx 1.0 1.8 5.0 2645 2263 A 86 LYS HGy A 86 LYS HEy 1.0 1.8 5.0 2646 2264 A 86 LYS HEx A 86 LYS HGx 1.0 1.8 5.0 2647 2264 A 86 LYS HGy A 86 LYS HEx 1.0 1.8 5.0 2648 2265 A 86 LYS H A 86 LYS HBx 1.0 1.8 3.5 2649 2266 A 86 LYS H A 86 LYS HBy 1.0 1.8 3.5 2650 2267 A 86 LYS H A 86 LYS HGx 1.0 1.8 5.0 2651 2267 A 86 LYS H A 86 LYS HGy 1.0 1.8 5.0 2652 2268 A 86 LYS H A 86 LYS HBx 1.0 1.8 3.5 2653 2268 A 86 LYS H A 86 LYS HBy 1.0 1.8 3.5 2654 2269 A 86 LYS H A 86 LYS HDx 1.0 1.8 5.0 2655 2269 A 86 LYS H A 86 LYS HDy 1.0 1.8 5.0 2656 2270 A 86 LYS HA A 86 LYS HDx 1.0 1.8 5.0 2657 2270 A 86 LYS HA A 86 LYS HDy 1.0 1.8 5.0 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _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 14 VAL H A 10 GLU O 1.0 1.8 2.1 2 2 A 10 GLU O A 14 VAL N 1.0 2.7 3.1 3 3 A 15 LYS H A 11 GLU O 1.0 1.8 2.1 4 4 A 11 GLU O A 15 LYS N 1.0 2.7 3.1 5 5 A 16 LYS H A 12 LYS O 1.0 1.8 2.1 6 6 A 12 LYS O A 16 LYS N 1.0 2.7 3.1 7 7 A 17 ALA H A 13 LEU O 1.0 1.8 2.1 8 8 A 13 LEU O A 17 ALA N 1.0 2.7 3.1 9 9 A 18 LEU H A 14 VAL O 1.0 1.8 2.1 10 10 A 14 VAL O A 18 LEU N 1.0 2.7 3.1 11 11 A 19 GLU H A 15 LYS O 1.0 1.8 2.1 12 12 A 15 LYS O A 19 GLU N 1.0 2.7 3.1 13 13 A 20 ILE H A 16 LYS O 1.0 1.8 2.1 14 14 A 16 LYS O A 20 ILE N 1.0 2.7 3.1 15 15 A 21 GLY H A 17 ALA O 1.0 1.8 2.1 16 16 A 17 ALA O A 21 GLY N 1.0 2.7 3.1 17 17 A 22 GLY H A 18 LEU O 1.0 1.8 2.1 18 18 A 18 LEU O A 22 GLY N 1.0 2.7 3.1 19 19 A 23 LYS H A 19 GLU O 1.0 1.8 2.1 20 20 A 19 GLU O A 23 LYS N 1.0 2.7 3.1 21 21 A 24 MET H A 20 ILE O 1.0 1.8 2.1 22 22 A 20 ILE O A 24 MET N 1.0 2.7 3.1 23 23 A 25 ALA H A 21 GLY O 1.0 1.8 2.1 24 24 A 21 GLY O A 25 ALA N 1.0 2.7 3.1 25 25 A 26 LYS H A 22 GLY O 1.0 1.8 2.1 26 26 A 22 GLY O A 26 LYS N 1.0 2.7 3.1 27 27 A 27 MET H A 23 LYS O 1.0 1.8 2.1 28 28 A 23 LYS O A 27 MET N 1.0 2.7 3.1 29 29 A 28 GLN H A 24 MET O 1.0 1.8 2.1 30 30 A 24 MET O A 28 GLN N 1.0 2.7 3.1 31 31 A 29 GLY H A 25 ALA O 1.0 1.8 2.1 32 32 A 25 ALA O A 29 GLY N 1.0 2.7 3.1 33 33 A 30 PHE H A 26 LYS O 1.0 1.8 2.1 34 34 A 26 LYS O A 30 PHE N 1.0 2.7 3.1 35 35 A 43 ALA H A 39 VAL O 1.0 1.8 2.1 36 36 A 39 VAL O A 43 ALA N 1.0 2.7 3.1 37 37 A 44 VAL H A 40 ARG O 1.0 1.8 2.1 38 38 A 40 ARG O A 44 VAL N 1.0 2.7 3.1 39 39 A 45 TYR H A 41 VAL O 1.0 1.8 2.1 40 40 A 41 VAL O A 45 TYR N 1.0 2.7 3.1 41 41 A 46 LEU H A 42 LYS O 1.0 1.8 2.1 42 42 A 42 LYS O A 46 LEU N 1.0 2.7 3.1 43 43 A 47 PHE H A 43 ALA O 1.0 1.8 2.1 44 44 A 43 ALA O A 47 PHE N 1.0 2.7 3.1 45 45 A 48 LEU H A 44 VAL O 1.0 1.8 2.1 46 46 A 44 VAL O A 48 LEU N 1.0 2.7 3.1 47 47 A 49 VAL H A 45 TYR O 1.0 1.8 2.1 48 48 A 45 TYR O A 49 VAL N 1.0 2.7 3.1 49 49 A 50 ASP H A 46 LEU O 1.0 1.8 2.1 50 50 A 46 LEU O A 50 ASP N 1.0 2.7 3.1 51 51 A 51 ALA H A 47 PHE O 1.0 1.8 2.1 52 52 A 47 PHE O A 51 ALA N 1.0 2.7 3.1 53 53 A 71 LEU H A 67 ILE O 1.0 1.8 2.1 54 54 A 67 ILE O A 71 LEU N 1.0 2.7 3.1 55 55 A 72 ALA H A 68 LYS O 1.0 1.8 2.1 56 56 A 68 LYS O A 72 ALA N 1.0 2.7 3.1 57 57 A 73 LEU H A 69 HIS O 1.0 1.8 2.1 58 58 A 69 HIS O A 73 LEU N 1.0 2.7 3.1 59 59 A 74 TRP H A 70 ARG O 1.0 1.8 2.1 60 60 A 70 ARG O A 74 TRP N 1.0 2.7 3.1 61 61 A 75 ILE H A 71 LEU O 1.0 1.8 2.1 62 62 A 71 LEU O A 75 ILE N 1.0 2.7 3.1 63 63 A 76 HIS H A 72 ALA O 1.0 1.8 2.1 64 64 A 72 ALA O A 76 HIS N 1.0 2.7 3.1 65 65 A 77 ALA H A 73 LEU O 1.0 1.8 2.1 66 66 A 73 LEU O A 77 ALA N 1.0 2.7 3.1 67 67 A 78 ALA H A 74 TRP O 1.0 1.8 2.1 68 68 A 74 TRP O A 78 ALA N 1.0 2.7 3.1 69 69 A 79 LEU H A 75 ILE O 1.0 1.8 2.1 70 70 A 75 ILE O A 79 LEU N 1.0 2.7 3.1 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _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 9 ASN C A 10 GLU N A 10 GLU CA A 10 GLU C 1.0 -76.0 -36.0 PHI 2 2 A 10 GLU N A 10 GLU CA A 10 GLU C A 11 GLU N 1.0 -67.0 -27.0 PSI 3 3 A 10 GLU C A 11 GLU N A 11 GLU CA A 11 GLU C 1.0 -78.0 -38.0 PHI 4 4 A 11 GLU N A 11 GLU CA A 11 GLU C A 12 LYS N 1.0 -64.0 -24.0 PSI 5 5 A 11 GLU C A 12 LYS N A 12 LYS CA A 12 LYS C 1.0 -86.0 -46.0 PHI 6 6 A 12 LYS N A 12 LYS CA A 12 LYS C A 13 LEU N 1.0 -59.0 -19.0 PSI 7 7 A 12 LYS C A 13 LEU N A 13 LEU CA A 13 LEU C 1.0 -87.0 -47.0 PHI 8 8 A 13 LEU N A 13 LEU CA A 13 LEU C A 14 VAL N 1.0 -62.0 -22.0 PSI 9 9 A 13 LEU C A 14 VAL N A 14 VAL CA A 14 VAL C 1.0 -82.0 -42.0 PHI 10 10 A 14 VAL N A 14 VAL CA A 14 VAL C A 15 LYS N 1.0 -64.0 -24.0 PSI 11 11 A 14 VAL C A 15 LYS N A 15 LYS CA A 15 LYS C 1.0 -81.0 -41.0 PHI 12 12 A 15 LYS N A 15 LYS CA A 15 LYS C A 16 LYS N 1.0 -60.0 -20.0 PSI 13 13 A 15 LYS C A 16 LYS N A 16 LYS CA A 16 LYS C 1.0 -84.0 -44.0 PHI 14 14 A 16 LYS N A 16 LYS CA A 16 LYS C A 17 ALA N 1.0 -60.0 -20.0 PSI 15 15 A 16 LYS C A 17 ALA N A 17 ALA CA A 17 ALA C 1.0 -84.0 -44.0 PHI 16 16 A 17 ALA N A 17 ALA CA A 17 ALA C A 18 LEU N 1.0 -65.0 -25.0 PSI 17 17 A 17 ALA C A 18 LEU N A 18 LEU CA A 18 LEU C 1.0 -83.0 -43.0 PHI 18 18 A 18 LEU N A 18 LEU CA A 18 LEU C A 19 GLU N 1.0 -64.0 -24.0 PSI 19 19 A 18 LEU C A 19 GLU N A 19 GLU CA A 19 GLU C 1.0 -85.0 -45.0 PHI 20 20 A 19 GLU N A 19 GLU CA A 19 GLU C A 20 ILE N 1.0 -61.0 -21.0 PSI 21 21 A 19 GLU C A 20 ILE N A 20 ILE CA A 20 ILE C 1.0 -87.0 -47.0 PHI 22 22 A 20 ILE N A 20 ILE CA A 20 ILE C A 21 GLY N 1.0 -58.0 -18.0 PSI 23 23 A 20 ILE C A 21 GLY N A 21 GLY CA A 21 GLY C 1.0 -85.0 -45.0 PHI 24 24 A 21 GLY N A 21 GLY CA A 21 GLY C A 22 GLY N 1.0 -66.0 18.0 PSI 25 25 A 21 GLY C A 22 GLY N A 22 GLY CA A 22 GLY C 1.0 -87.0 -47.0 PHI 26 26 A 22 GLY N A 22 GLY CA A 22 GLY C A 23 LYS N 1.0 -60.0 -20.0 PSI 27 27 A 22 GLY C A 23 LYS N A 23 LYS CA A 23 LYS C 1.0 -85.0 -45.0 PHI 28 28 A 23 LYS N A 23 LYS CA A 23 LYS C A 24 MET N 1.0 -62.0 -22.0 PSI 29 29 A 23 LYS C A 24 MET N A 24 MET CA A 24 MET C 1.0 -83.0 -43.0 PHI 30 30 A 24 MET N A 24 MET CA A 24 MET C A 25 ALA N 1.0 -66.0 -26.0 PSI 31 31 A 24 MET C A 25 ALA N A 25 ALA CA A 25 ALA C 1.0 -80.0 -40.0 PHI 32 32 A 25 ALA N A 25 ALA CA A 25 ALA C A 26 LYS N 1.0 -63.0 -23.0 PSI 33 33 A 25 ALA C A 26 LYS N A 26 LYS CA A 26 LYS C 1.0 -97.0 -37.0 PHI 34 34 A 26 LYS N A 26 LYS CA A 26 LYS C A 27 MET N 1.0 -70.0 -10.0 PSI 35 35 A 26 LYS C A 27 MET N A 27 MET CA A 27 MET C 1.0 -86.0 -46.0 PHI 36 36 A 27 MET N A 27 MET CA A 27 MET C A 28 GLN N 1.0 -51.0 1.0 PSI 37 37 A 27 MET C A 28 GLN N A 28 GLN CA A 28 GLN C 1.0 -119.0 -59.0 PHI 38 38 A 28 GLN N A 28 GLN CA A 28 GLN C A 29 GLY N 1.0 -30.0 30.0 PSI 39 39 A 28 GLN C A 29 GLY N A 29 GLY CA A 29 GLY C 1.0 27.0 139.0 PHI 40 40 A 29 GLY N A 29 GLY CA A 29 GLY C A 30 PHE N 1.0 -25.0 55.0 PSI 41 41 A 29 GLY C A 30 PHE N A 30 PHE CA A 30 PHE C 1.0 -143.0 -39.0 PHI 42 42 A 30 PHE N A 30 PHE CA A 30 PHE C A 31 ASP N 1.0 74.0 190.0 PSI 43 43 A 38 PRO C A 39 VAL N A 39 VAL CA A 39 VAL C 1.0 -108.0 -28.0 PHI 44 44 A 39 VAL N A 39 VAL CA A 39 VAL C A 40 ARG N 1.0 -63.0 -19.0 PSI 45 45 A 39 VAL C A 40 ARG N A 40 ARG CA A 40 ARG C 1.0 -82.0 -42.0 PHI 46 46 A 40 ARG N A 40 ARG CA A 40 ARG C A 41 VAL N 1.0 -63.0 -23.0 PSI 47 47 A 40 ARG C A 41 VAL N A 41 VAL CA A 41 VAL C 1.0 -84.0 -44.0 PHI 48 48 A 41 VAL N A 41 VAL CA A 41 VAL C A 42 LYS N 1.0 -60.0 -20.0 PSI 49 49 A 41 VAL C A 42 LYS N A 42 LYS CA A 42 LYS C 1.0 -80.0 -40.0 PHI 50 50 A 42 LYS N A 42 LYS CA A 42 LYS C A 43 ALA N 1.0 -62.0 -22.0 PSI 51 51 A 42 LYS C A 43 ALA N A 43 ALA CA A 43 ALA C 1.0 -83.0 -43.0 PHI 52 52 A 43 ALA N A 43 ALA CA A 43 ALA C A 44 VAL N 1.0 -63.0 -23.0 PSI 53 53 A 43 ALA C A 44 VAL N A 44 VAL CA A 44 VAL C 1.0 -90.0 -46.0 PHI 54 54 A 44 VAL N A 44 VAL CA A 44 VAL C A 45 TYR N 1.0 -66.0 -26.0 PSI 55 55 A 44 VAL C A 45 TYR N A 45 TYR CA A 45 TYR C 1.0 -83.0 -43.0 PHI 56 56 A 45 TYR N A 45 TYR CA A 45 TYR C A 46 LEU N 1.0 -62.0 -22.0 PSI 57 57 A 45 TYR C A 46 LEU N A 46 LEU CA A 46 LEU C 1.0 -82.0 -42.0 PHI 58 58 A 46 LEU N A 46 LEU CA A 46 LEU C A 47 PHE N 1.0 -62.0 -22.0 PSI 59 59 A 46 LEU C A 47 PHE N A 47 PHE CA A 47 PHE C 1.0 -84.0 -44.0 PHI 60 60 A 47 PHE N A 47 PHE CA A 47 PHE C A 48 LEU N 1.0 -65.0 -25.0 PSI 61 61 A 47 PHE C A 48 LEU N A 48 LEU CA A 48 LEU C 1.0 -86.0 -46.0 PHI 62 62 A 48 LEU N A 48 LEU CA A 48 LEU C A 49 VAL N 1.0 -57.0 -17.0 PSI 63 63 A 48 LEU C A 49 VAL N A 49 VAL CA A 49 VAL C 1.0 -86.0 -46.0 PHI 64 64 A 49 VAL N A 49 VAL CA A 49 VAL C A 50 ASP N 1.0 -63.0 -23.0 PSI 65 65 A 49 VAL C A 50 ASP N A 50 ASP CA A 50 ASP C 1.0 -85.0 -45.0 PHI 66 66 A 50 ASP N A 50 ASP CA A 50 ASP C A 51 ALA N 1.0 -48.0 -8.0 PSI 67 67 A 50 ASP C A 51 ALA N A 51 ALA CA A 51 ALA C 1.0 -109.0 -69.0 PHI 68 68 A 51 ALA N A 51 ALA CA A 51 ALA C A 52 LYS N 1.0 -14.0 26.0 PSI 69 69 A 51 ALA C A 52 LYS N A 52 LYS CA A 52 LYS C 1.0 38.0 78.0 PHI 70 70 A 52 LYS N A 52 LYS CA A 52 LYS C A 53 GLN N 1.0 19.0 59.0 PSI 71 71 A 53 GLN C A 54 ILE N A 54 ILE CA A 54 ILE C 1.0 -172.0 -92.0 PHI 72 72 A 54 ILE N A 54 ILE CA A 54 ILE C A 55 ALA N 1.0 135.0 179.0 PSI 73 73 A 54 ILE C A 55 ALA N A 55 ALA CA A 55 ALA C 1.0 -121.0 -57.0 PHI 74 74 A 55 ALA N A 55 ALA CA A 55 ALA C A 56 PRO N 1.0 111.0 175.0 PSI 75 75 A 56 PRO C A 57 LEU N A 57 LEU CA A 57 LEU C 1.0 -106.0 -58.0 PHI 76 76 A 57 LEU N A 57 LEU CA A 57 LEU C A 58 PRO N 1.0 109.0 177.0 PSI 77 77 A 58 PRO C A 59 ASP N A 59 ASP CA A 59 ASP C 1.0 -76.0 -36.0 PHI 78 78 A 59 ASP N A 59 ASP CA A 59 ASP C A 60 SER N 1.0 -57.0 -9.0 PSI 79 79 A 59 ASP C A 60 SER N A 60 SER CA A 60 SER C 1.0 -94.0 -46.0 PHI 80 80 A 60 SER N A 60 SER CA A 60 SER C A 61 LYS N 1.0 -48.0 6.0 PSI 81 81 A 63 ASP C A 64 GLY N A 64 GLY CA A 64 GLY C 1.0 -81.0 -41.0 PHI 82 82 A 64 GLY N A 64 GLY CA A 64 GLY C A 65 ALA N 1.0 -52.0 -12.0 PSI 83 83 A 64 GLY C A 65 ALA N A 65 ALA CA A 65 ALA C 1.0 -85.0 -45.0 PHI 84 84 A 65 ALA N A 65 ALA CA A 65 ALA C A 66 ASN N 1.0 -61.0 -21.0 PSI 85 85 A 65 ALA C A 66 ASN N A 66 ASN CA A 66 ASN C 1.0 -84.0 -44.0 PHI 86 86 A 66 ASN N A 66 ASN CA A 66 ASN C A 67 ILE N 1.0 -62.0 -22.0 PSI 87 87 A 66 ASN C A 67 ILE N A 67 ILE CA A 67 ILE C 1.0 -85.0 -45.0 PHI 88 88 A 67 ILE N A 67 ILE CA A 67 ILE C A 68 LYS N 1.0 -62.0 -22.0 PSI 89 89 A 67 ILE C A 68 LYS N A 68 LYS CA A 68 LYS C 1.0 -82.0 -42.0 PHI 90 90 A 68 LYS N A 68 LYS CA A 68 LYS C A 69 HIS N 1.0 -61.0 -21.0 PSI 91 91 A 68 LYS C A 69 HIS N A 69 HIS CA A 69 HIS C 1.0 -81.0 -41.0 PHI 92 92 A 69 HIS N A 69 HIS CA A 69 HIS C A 70 ARG N 1.0 -65.0 -25.0 PSI 93 93 A 69 HIS C A 70 ARG N A 70 ARG CA A 70 ARG C 1.0 -86.0 -46.0 PHI 94 94 A 70 ARG N A 70 ARG CA A 70 ARG C A 71 LEU N 1.0 -58.0 -18.0 PSI 95 95 A 70 ARG C A 71 LEU N A 71 LEU CA A 71 LEU C 1.0 -86.0 -46.0 PHI 96 96 A 71 LEU N A 71 LEU CA A 71 LEU C A 72 ALA N 1.0 -59.0 -19.0 PSI 97 97 A 71 LEU C A 72 ALA N A 72 ALA CA A 72 ALA C 1.0 -83.0 -43.0 PHI 98 98 A 72 ALA N A 72 ALA CA A 72 ALA C A 73 LEU N 1.0 -63.0 -23.0 PSI 99 99 A 72 ALA C A 73 LEU N A 73 LEU CA A 73 LEU C 1.0 -87.0 -47.0 PHI 100 100 A 73 LEU N A 73 LEU CA A 73 LEU C A 74 TRP N 1.0 -62.0 -22.0 PSI 101 101 A 73 LEU C A 74 TRP N A 74 TRP CA A 74 TRP C 1.0 -84.0 -44.0 PHI 102 102 A 74 TRP N A 74 TRP CA A 74 TRP C A 75 ILE N 1.0 -62.0 4.0 PSI 103 103 A 74 TRP C A 75 ILE N A 75 ILE CA A 75 ILE C 1.0 -135.0 -43.0 PHI 104 104 A 75 ILE N A 75 ILE CA A 75 ILE C A 76 HIS N 1.0 -71.0 57.0 PSI 105 105 A 75 ILE C A 76 HIS N A 76 HIS CA A 76 HIS C 1.0 -79.0 -39.0 PHI 106 106 A 76 HIS N A 76 HIS CA A 76 HIS C A 77 ALA N 1.0 -61.0 -21.0 PSI 107 107 A 76 HIS C A 77 ALA N A 77 ALA CA A 77 ALA C 1.0 -90.0 -50.0 PHI 108 108 A 77 ALA N A 77 ALA CA A 77 ALA C A 78 ALA N 1.0 -44.0 12.0 PSI 109 109 A 77 ALA C A 78 ALA N A 78 ALA CA A 78 ALA C 1.0 -116.0 -60.0 PHI 110 110 A 78 ALA N A 78 ALA CA A 78 ALA C A 79 LEU N 1.0 -53.0 35.0 PSI 111 111 A 78 ALA C A 79 LEU N A 79 LEU CA A 79 LEU C 1.0 -138.0 -22.0 PHI 112 112 A 79 LEU N A 79 LEU CA A 79 LEU C A 80 PRO N 1.0 65.0 193.0 PSI 113 113 A 80 PRO C A 81 ASP N A 81 ASP CA A 81 ASP C 1.0 -119.0 -11.0 PHI 114 114 A 81 ASP N A 81 ASP CA A 81 ASP C A 82 ASN N 1.0 -57.0 7.0 PSI stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 15N 2270.664 2 1H 12004.802 3 1H 11160.714 stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 15293.019 2 1H 11203.133 3 1H 11160.714 stop_ save_ save_spectral_peak_list_3 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_3 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 6439.694 2 1H 12820.545 3 1H 12820.513 stop_ save_