data_nef_c19403_2mbk 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_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 12 CYS SG 1 34 CYS SG 1 29 CYS SG 1 63 CYS SG 1 32 CYS SG 1 41 CYS SG 1 46 CYS SG 1 64 CYS SG 1 53 CYS SG 1 67 CYS SG stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A -3 GLY start . false 2 A -2 SER middle . . 3 A -1 TRP middle . . 4 A 1 LEU middle . . 5 A 2 ILE middle . . 6 A 3 THR middle . . 7 A 4 GLY middle . false 8 A 5 THR middle . . 9 A 6 GLU middle . . 10 A 7 ALA middle . . 11 A 8 SER middle . . 12 A 9 CYS middle -HG . 13 A 10 GLU middle . . 14 A 11 ASN middle . . 15 A 12 GLU middle . . 16 A 13 GLY middle . false 17 A 14 GLU middle . . 18 A 15 VAL middle . . 19 A 16 LEU middle . . 20 A 17 HIS middle . . 21 A 18 ILE middle . . 22 A 19 PRO middle . false 23 A 20 ASN middle . . 24 A 21 ILE middle . . 25 A 22 THR middle . . 26 A 23 ASP middle . . 27 A 24 ASN middle . . 28 A 25 PRO middle . false 29 A 26 CYS middle -HG . 30 A 27 ILE middle . . 31 A 28 SER middle . . 32 A 29 CYS middle -HG . 33 A 30 VAL middle . . 34 A 31 CYS middle -HG . 35 A 32 LEU middle . . 36 A 33 ASN middle . . 37 A 34 GLN middle . . 38 A 35 LYS middle . . 39 A 36 ALA middle . . 40 A 37 GLU middle . . 41 A 38 CYS middle -HG . 42 A 39 LYS middle . . 43 A 40 GLN middle . . 44 A 41 GLU middle . . 45 A 42 LYS middle . . 46 A 43 CYS middle -HG . 47 A 44 ALA middle . . 48 A 45 PRO middle . false 49 A 46 LEU middle . . 50 A 47 ALA middle . . 51 A 48 GLU middle . . 52 A 49 ASP middle . . 53 A 50 CYS middle -HG . 54 A 51 ALA middle . . 55 A 52 LEU middle . . 56 A 53 VAL middle . . 57 A 54 VAL middle . . 58 A 55 LYS middle . . 59 A 56 GLN middle . . 60 A 57 THR middle . . 61 A 58 GLY middle . false 62 A 59 ALA middle . . 63 A 60 CYS middle -HG . 64 A 61 CYS middle -HG . 65 A 62 GLU middle . . 66 A 63 LYS middle . . 67 A 64 CYS middle -HG . 68 A 65 LYS middle . . 69 A 66 GLY end . false 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 -1 TRP H H 1 8.180 0.02 A -1 TRP HA H 1 4.690 0.02 A -1 TRP HBx H 1 3.100 0.02 A -1 TRP HBy H 1 3.180 0.02 A -1 TRP HD1 H 1 7.070 0.02 A -1 TRP HE1 H 1 10.020 0.02 A -1 TRP HE3 H 1 7.460 0.02 A -1 TRP HH2 H 1 7.080 0.02 A -1 TRP HZ2 H 1 7.360 0.02 A -1 TRP HZ3 H 1 6.990 0.02 A -1 TRP C C 13 177.310 0.30 A -1 TRP CA C 13 56.670 0.30 A -1 TRP CB C 13 29.770 0.30 A -1 TRP N N 15 122.420 0.30 A 1 LEU H H 1 8.050 0.02 A 1 LEU HA H 1 4.320 0.02 A 1 LEU HBx H 1 1.360 0.02 A 1 LEU HBy H 1 1.360 0.02 A 1 LEU HDx% H 1 0.710 0.02 A 1 LEU HDy% H 1 0.710 0.02 A 1 LEU C C 13 178.720 0.30 A 1 LEU CA C 13 54.670 0.30 A 1 LEU CB C 13 42.440 0.30 A 1 LEU N N 15 123.770 0.30 A 2 ILE H H 1 8.080 0.02 A 2 ILE HA H 1 4.210 0.02 A 2 ILE HB H 1 1.744 0.02 A 2 ILE HD1% H 1 0.790 0.02 A 2 ILE HG1y H 1 1.150 0.02 A 2 ILE HG2% H 1 0.830 0.02 A 2 ILE C C 13 178.250 0.30 A 2 ILE CA C 13 60.400 0.30 A 2 ILE CB C 13 38.270 0.30 A 2 ILE N N 15 122.420 0.30 A 3 THR H H 1 8.250 0.02 A 3 THR HA H 1 4.300 0.02 A 3 THR HB H 1 4.160 0.02 A 3 THR HG2% H 1 1.110 0.02 A 3 THR C C 13 177.090 0.30 A 3 THR CA C 13 61.440 0.30 A 3 THR CB C 13 69.950 0.30 A 3 THR N N 15 117.190 0.30 A 4 GLY H H 1 8.430 0.02 A 4 GLY HAx H 1 3.860 0.02 A 4 GLY HAy H 1 4.070 0.02 A 4 GLY C C 13 177.090 0.30 A 4 GLY CA C 13 45.220 0.30 A 4 GLY N N 15 110.030 0.30 A 5 THR H H 1 8.430 0.02 A 5 THR HA H 1 4.160 0.02 A 5 THR HB H 1 4.160 0.02 A 5 THR HG2% H 1 1.110 0.02 A 5 THR C C 13 177.130 0.30 A 5 THR CA C 13 62.660 0.30 A 5 THR CB C 13 69.170 0.30 A 5 THR N N 15 113.900 0.30 A 6 GLU H H 1 8.610 0.02 A 6 GLU HA H 1 4.260 0.02 A 6 GLU HBx H 1 1.950 0.02 A 6 GLU HBy H 1 1.950 0.02 A 6 GLU HGx H 1 2.200 0.02 A 6 GLU HGy H 1 2.200 0.02 A 6 GLU C C 13 177.900 0.30 A 6 GLU CA C 13 56.670 0.30 A 6 GLU CB C 13 29.420 0.30 A 6 GLU N N 15 122.220 0.30 A 7 ALA H H 1 7.910 0.02 A 7 ALA HA H 1 4.260 0.02 A 7 ALA HB% H 1 1.290 0.02 A 7 ALA C C 13 179.120 0.30 A 7 ALA CA C 13 52.070 0.30 A 7 ALA CB C 13 19.530 0.30 A 7 ALA N N 15 122.990 0.30 A 8 SER H H 1 7.990 0.02 A 8 SER HA H 1 4.780 0.02 A 8 SER HBx H 1 3.850 0.02 A 8 SER HBy H 1 3.850 0.02 A 8 SER C C 13 175.196 0.30 A 8 SER CA C 13 57.880 0.30 A 8 SER CB C 13 64.130 0.30 A 8 SER N N 15 114.870 0.30 A 9 CYS H H 1 7.950 0.02 A 9 CYS HA H 1 4.760 0.02 A 9 CYS HBy H 1 3.300 0.02 A 9 CYS HBx H 1 3.040 0.02 A 9 CYS C C 13 175.254 0.30 A 9 CYS CA C 13 54.240 0.30 A 9 CYS CB C 13 45.910 0.30 A 9 CYS N N 15 118.160 0.30 A 10 GLU H H 1 8.390 0.02 A 10 GLU HA H 1 4.460 0.02 A 10 GLU HBx H 1 1.770 0.02 A 10 GLU HBy H 1 1.960 0.02 A 10 GLU HGx H 1 2.100 0.02 A 10 GLU HGy H 1 2.100 0.02 A 10 GLU C C 13 178.450 0.30 A 10 GLU CA C 13 56.840 0.30 A 10 GLU CB C 13 32.200 0.30 A 10 GLU N N 15 117.380 0.30 A 11 ASN H H 1 8.430 0.02 A 11 ASN HA H 1 4.870 0.02 A 11 ASN HBx H 1 2.480 0.02 A 11 ASN HBy H 1 2.750 0.02 A 11 ASN C C 13 175.920 0.30 A 11 ASN CA C 13 51.640 0.30 A 11 ASN CB C 13 37.660 0.03 A 11 ASN N N 15 119.320 0.30 A 12 GLU H H 1 8.290 0.02 A 12 GLU HA H 1 3.570 0.02 A 12 GLU HBx H 1 1.870 0.02 A 12 GLU HBy H 1 1.870 0.02 A 12 GLU HGx H 1 2.150 0.02 A 12 GLU HGy H 1 2.300 0.02 A 12 GLU C C 13 180.140 0.30 A 12 GLU CA C 13 57.800 0.30 A 12 GLU CB C 13 29.340 0.30 A 12 GLU N N 15 124.740 0.30 A 13 GLY H H 1 9.480 0.02 A 13 GLY HAx H 1 3.540 0.02 A 13 GLY HAy H 1 4.150 0.02 A 13 GLY C C 13 175.910 0.30 A 13 GLY CA C 13 44.960 0.30 A 13 GLY N N 15 114.870 0.30 A 14 GLU H H 1 7.610 0.02 A 14 GLU HA H 1 4.160 0.02 A 14 GLU HBx H 1 1.860 0.02 A 14 GLU HBy H 1 1.930 0.02 A 14 GLU HGx H 1 2.170 0.02 A 14 GLU HGy H 1 2.170 0.02 A 14 GLU C C 13 177.760 0.30 A 14 GLU CA C 13 56.320 0.30 A 14 GLU CB C 13 31.160 0.30 A 14 GLU N N 15 121.060 0.30 A 15 VAL H H 1 8.310 0.02 A 15 VAL HA H 1 3.960 0.02 A 15 VAL HB H 1 1.870 0.02 A 15 VAL HGx% H 1 0.990 0.02 A 15 VAL HGy% H 1 0.820 0.02 A 15 VAL C C 13 177.870 0.30 A 15 VAL CA C 13 63.350 0.30 A 15 VAL CB C 13 31.510 0.30 A 15 VAL N N 15 123.960 0.30 A 16 LEU H H 1 8.000 0.02 A 16 LEU HA H 1 4.450 0.02 A 16 LEU HBx H 1 1.110 0.02 A 16 LEU HBy H 1 1.110 0.02 A 16 LEU HDx% H 1 0.740 0.02 A 16 LEU HDy% H 1 0.600 0.02 A 16 LEU HG H 1 1.470 0.02 A 16 LEU C C 13 177.600 0.30 A 16 LEU CA C 13 53.030 0.30 A 16 LEU CB C 13 44.440 0.30 A 16 LEU N N 15 127.250 0.30 A 17 HIS H H 1 8.560 0.02 A 17 HIS HA H 1 4.770 0.02 A 17 HIS HBx H 1 2.840 0.02 A 17 HIS HBy H 1 2.840 0.02 A 17 HIS HD2 H 1 6.970 0.02 A 17 HIS HE1 H 1 8.030 0.02 A 17 HIS C C 13 176.690 0.30 A 17 HIS CA C 13 54.670 0.30 A 17 HIS CB C 13 30.380 0.30 A 17 HIS N N 15 121.450 0.30 A 18 ILE H H 1 8.650 0.02 A 18 ILE HA H 1 4.420 0.02 A 18 ILE HB H 1 1.560 0.02 A 18 ILE HD1% H 1 0.650 0.02 A 18 ILE HG1x H 1 1.200 0.02 A 18 ILE HG1y H 1 1.200 0.02 A 18 ILE HG2% H 1 0.820 0.02 A 18 ILE C C 13 175.600 0.30 A 18 ILE CA C 13 57.710 0.30 A 18 ILE CB C 13 40.530 0.30 A 18 ILE N N 15 126.290 0.30 A 19 PRO HA H 1 4.060 0.02 A 19 PRO HBy H 1 2.260 0.02 A 19 PRO HBx H 1 1.790 0.02 A 19 PRO HDx H 1 3.660 0.02 A 19 PRO HDy H 1 3.660 0.02 A 19 PRO HGx H 1 2.010 0.02 A 19 PRO HGy H 1 2.010 0.02 A 19 PRO C C 13 178.800 0.30 A 19 PRO CA C 13 57.710 0.30 A 19 PRO CB C 13 40.530 0.30 A 20 ASN H H 1 8.820 0.02 A 20 ASN HA H 1 4.290 0.02 A 20 ASN HBx H 1 2.880 0.02 A 20 ASN HBy H 1 3.050 0.02 A 20 ASN C C 13 176.710 0.30 A 20 ASN CA C 13 55.710 0.30 A 20 ASN CB C 13 37.750 0.30 A 20 ASN N N 15 115.256 0.30 A 21 ILE H H 1 8.120 0.02 A 21 ILE HA H 1 4.280 0.02 A 21 ILE HB H 1 1.700 0.02 A 21 ILE HD1% H 1 0.620 0.02 A 21 ILE HG1x H 1 1.100 0.02 A 21 ILE HG1y H 1 1.250 0.02 A 21 ILE HG2% H 1 0.770 0.02 A 21 ILE C C 13 179.210 0.30 A 21 ILE CA C 13 62.390 0.30 A 21 ILE CB C 13 38.790 0.30 A 21 ILE N N 15 118.350 0.30 A 22 THR H H 1 8.250 0.02 A 22 THR HA H 1 4.760 0.20 A 22 THR HB H 1 4.230 0.02 A 22 THR HG2% H 1 1.140 0.02 A 22 THR C C 13 176.840 0.30 A 22 THR CA C 13 62.660 0.30 A 22 THR CB C 13 67.950 0.30 A 22 THR N N 15 107.130 0.30 A 23 ASP H H 1 7.940 0.02 A 23 ASP HA H 1 4.380 0.02 A 23 ASP HBx H 1 2.550 0.02 A 23 ASP HBy H 1 2.650 0.02 A 23 ASP C C 13 178.530 0.30 A 23 ASP CA C 13 54.940 0.30 A 23 ASP CB C 13 39.310 0.30 A 23 ASP N N 15 119.900 0.30 A 24 ASN H H 1 7.230 0.02 A 24 ASN HA H 1 4.810 0.02 A 24 ASN HBx H 1 2.720 0.02 A 24 ASN HBy H 1 2.940 0.02 A 24 ASN C C 13 176.490 0.30 A 24 ASN CA C 13 49.900 0.30 A 24 ASN CB C 13 39.230 0.30 A 24 ASN N N 15 119.320 0.30 A 25 PRO HA H 1 4.500 0.02 A 25 PRO HBy H 1 2.190 0.02 A 25 PRO HBx H 1 1.630 0.02 A 25 PRO HDx H 1 3.850 0.02 A 25 PRO HDy H 1 3.850 0.02 A 25 PRO HGx H 1 1.820 0.02 A 25 PRO HGy H 1 1.820 0.02 A 25 PRO C C 13 179.560 0.30 A 25 PRO CA C 13 63.530 0.30 A 25 PRO CB C 13 32.290 0.30 A 26 CYS H H 1 8.380 0.02 A 26 CYS HA H 1 4.550 0.02 A 26 CYS HBy H 1 3.500 0.02 A 26 CYS HBx H 1 2.770 0.02 A 26 CYS C C 13 175.810 0.30 A 26 CYS CA C 13 54.760 0.30 A 26 CYS CB C 13 42.090 0.30 A 26 CYS N N 15 114.680 0.30 A 27 ILE H H 1 7.990 0.02 A 27 ILE HA H 1 4.790 0.02 A 27 ILE HB H 1 1.840 0.02 A 27 ILE HD1% H 1 0.570 0.02 A 27 ILE HG1x H 1 1.380 0.02 A 27 ILE HG1y H 1 1.380 0.02 A 27 ILE HG2% H 1 0.570 0.02 A 27 ILE C C 13 176.240 0.30 A 27 ILE CA C 13 59.710 0.30 A 27 ILE CB C 13 38.360 0.30 A 27 ILE N N 15 121.450 0.30 A 28 SER H H 1 8.300 0.02 A 28 SER HA H 1 4.780 0.02 A 28 SER HBx H 1 3.740 0.02 A 28 SER HBy H 1 3.780 0.02 A 28 SER C C 13 175.920 0.30 A 28 SER CA C 13 56.240 0.30 A 28 SER CB C 13 65.520 0.30 A 28 SER N N 15 119.510 0.30 A 29 CYS H H 1 9.400 0.02 A 29 CYS HA H 1 5.600 0.02 A 29 CYS HBy H 1 2.920 0.02 A 29 CYS HBx H 1 2.300 0.02 A 29 CYS C C 13 174.960 0.30 A 29 CYS CA C 13 55.020 0.30 A 29 CYS CB C 13 49.730 0.30 A 29 CYS N N 15 121.260 0.30 A 30 VAL H H 1 8.780 0.02 A 30 VAL HA H 1 4.920 0.02 A 30 VAL HB H 1 1.720 0.02 A 30 VAL HGx% H 1 0.810 0.02 A 30 VAL HGy% H 1 0.760 0.02 A 30 VAL C C 13 175.780 0.30 A 30 VAL CA C 13 58.750 0.30 A 30 VAL CB C 13 35.930 0.30 A 30 VAL N N 15 120.670 0.30 A 31 CYS H H 1 8.300 0.02 A 31 CYS HA H 1 4.660 0.02 A 31 CYS HBy H 1 3.420 0.02 A 31 CYS HBx H 1 2.600 0.02 A 31 CYS C C 13 175.600 0.30 A 31 CYS CA C 13 55.110 0.30 A 31 CYS CB C 13 41.380 0.30 A 31 CYS N N 15 123.190 0.30 A 32 LEU H H 1 9.170 0.02 A 32 LEU HA H 1 4.810 0.02 A 32 LEU HBx H 1 1.310 0.02 A 32 LEU HBy H 1 1.560 0.02 A 32 LEU HDx% H 1 0.820 0.02 A 32 LEU HDy% H 1 0.820 0.02 A 32 LEU HG H 1 1.340 0.02 A 32 LEU C C 13 178.770 0.30 A 32 LEU CA C 13 53.810 0.30 A 32 LEU CB C 13 44.690 0.30 A 32 LEU N N 15 133.450 0.30 A 33 ASN H H 1 11.750 0.02 A 33 ASN HA H 1 4.190 0.02 A 33 ASN HBx H 1 2.690 0.02 A 33 ASN HBy H 1 2.880 0.02 A 33 ASN C C 13 177.740 0.30 A 33 ASN CA C 13 53.890 0.30 A 33 ASN CB C 13 36.880 0.30 A 33 ASN N N 15 131.310 0.30 A 34 GLN H H 1 8.830 0.03 A 34 GLN HA H 1 3.760 0.02 A 34 GLN HBx H 1 2.300 0.02 A 34 GLN HBy H 1 2.740 0.02 A 34 GLN HGx H 1 2.240 0.02 A 34 GLN HGy H 1 2.240 0.02 A 34 GLN C C 13 177.610 0.30 A 34 GLN CA C 13 58.070 0.30 A 34 GLN CB C 13 26.320 0.30 A 34 GLN N N 15 106.930 0.30 A 35 LYS H H 1 7.740 0.02 A 35 LYS HA H 1 4.900 0.02 A 35 LYS HBx H 1 1.700 0.02 A 35 LYS HBy H 1 1.700 0.02 A 35 LYS HDx H 1 1.370 0.02 A 35 LYS HDy H 1 1.370 0.02 A 35 LYS HGx H 1 1.640 0.02 A 35 LYS HGy H 1 1.640 0.02 A 35 LYS C C 13 177.100 0.30 A 35 LYS CA C 13 54.120 0.30 A 35 LYS CB C 13 35.840 0.30 A 35 LYS N N 15 120.290 0.30 A 36 ALA H H 1 8.250 0.02 A 36 ALA HA H 1 4.160 0.02 A 36 ALA HB% H 1 1.060 0.02 A 36 ALA C C 13 178.910 0.30 A 36 ALA CA C 13 52.150 0.30 A 36 ALA CB C 13 19.200 0.30 A 36 ALA N N 15 122.800 0.30 A 37 GLU H H 1 9.130 0.02 A 37 GLU HA H 1 4.700 0.02 A 37 GLU HBx H 1 1.830 0.02 A 37 GLU HBy H 1 1.990 0.02 A 37 GLU HGx H 1 2.090 0.02 A 37 GLU HGy H 1 2.090 0.02 A 37 GLU C C 13 178.730 0.30 A 37 GLU CA C 13 55.120 0.30 A 37 GLU CB C 13 30.690 0.30 A 37 GLU N N 15 126.480 0.30 A 38 CYS H H 1 9.080 0.02 A 38 CYS HA H 1 5.710 0.02 A 38 CYS HBy H 1 2.680 0.02 A 38 CYS HBx H 1 2.410 0.02 A 38 CYS C C 13 175.220 0.30 A 38 CYS CA C 13 54.980 0.30 A 38 CYS CB C 13 47.000 0.30 A 38 CYS N N 15 126.290 0.30 A 39 LYS H H 1 9.040 0.02 A 39 LYS HA H 1 4.670 0.02 A 39 LYS HBx H 1 1.650 0.02 A 39 LYS HBy H 1 1.690 0.02 A 39 LYS HDx H 1 1.260 0.02 A 39 LYS HDy H 1 1.260 0.02 A 39 LYS HGx H 1 1.480 0.02 A 39 LYS HGy H 1 1.480 0.02 A 39 LYS C C 13 176.480 0.30 A 39 LYS CA C 13 54.550 0.30 A 39 LYS CB C 13 36.020 0.30 A 39 LYS N N 15 120.670 0.30 A 40 GLN H H 1 8.650 0.02 A 40 GLN HA H 1 4.980 0.02 A 40 GLN HBx H 1 1.750 0.02 A 40 GLN HBy H 1 1.880 0.02 A 40 GLN HGx H 1 2.010 0.02 A 40 GLN HGy H 1 2.160 0.02 A 40 GLN C C 13 177.600 0.30 A 40 GLN CA C 13 53.480 0.30 A 40 GLN CB C 13 30.400 0.30 A 40 GLN N N 15 122.800 0.30 A 41 GLU H H 1 9.010 0.02 A 41 GLU HA H 1 4.070 0.02 A 41 GLU HBx H 1 1.990 0.02 A 41 GLU HBy H 1 2.120 0.02 A 41 GLU C C 13 176.940 0.30 A 41 GLU CA C 13 56.610 0.30 A 41 GLU CB C 13 30.520 0.30 A 41 GLU N N 15 129.770 0.30 A 42 LYS H H 1 8.480 0.02 A 42 LYS HA H 1 4.420 0.02 A 42 LYS HBx H 1 1.640 0.02 A 42 LYS HBy H 1 1.730 0.02 A 42 LYS HDx H 1 1.320 0.02 A 42 LYS HDy H 1 1.320 0.02 A 42 LYS HGx H 1 1.570 0.02 A 42 LYS HGy H 1 1.570 0.02 A 42 LYS C C 13 178.530 0.30 A 42 LYS CA C 13 54.550 0.30 A 42 LYS CB C 13 33.910 0.30 A 42 LYS N N 15 125.510 0.30 A 43 CYS H H 1 8.700 0.02 A 43 CYS HA H 1 4.560 0.02 A 43 CYS HBy H 1 3.240 0.02 A 43 CYS HBx H 1 2.560 0.02 A 43 CYS C C 13 176.990 0.30 A 43 CYS CA C 13 53.090 0.30 A 43 CYS CB C 13 37.900 0.30 A 43 CYS N N 15 123.770 0.30 A 44 ALA H H 1 8.780 0.02 A 44 ALA HA H 1 4.560 0.02 A 44 ALA HB% H 1 1.360 0.02 A 44 ALA C C 13 177.700 0.30 A 44 ALA CA C 13 50.000 0.30 A 44 ALA CB C 13 17.390 0.30 A 44 ALA N N 15 128.990 0.30 A 45 PRO HA H 1 4.310 0.02 A 45 PRO HBy H 1 2.220 0.02 A 45 PRO HBx H 1 1.780 0.02 A 45 PRO HDx H 1 3.570 0.02 A 45 PRO HDy H 1 3.760 0.02 A 45 PRO HGx H 1 1.970 0.02 A 45 PRO HGy H 1 1.970 0.02 A 45 PRO C C 13 179.070 0.30 A 45 PRO CA C 13 62.570 0.30 A 45 PRO CB C 13 31.850 0.30 A 46 LEU H H 1 8.480 0.02 A 46 LEU HA H 1 4.250 0.02 A 46 LEU HBx H 1 1.390 0.02 A 46 LEU HBy H 1 1.590 0.02 A 46 LEU HDx% H 1 0.780 0.02 A 46 LEU HDy% H 1 0.780 0.02 A 46 LEU HG H 1 1.660 0.02 A 46 LEU C C 13 179.490 0.30 A 46 LEU CA C 13 53.720 0.30 A 46 LEU CB C 13 42.350 0.30 A 46 LEU N N 15 123.190 0.30 A 47 ALA H H 1 8.430 0.02 A 47 ALA HA H 1 4.130 0.02 A 47 ALA HB% H 1 1.350 0.02 A 47 ALA C C 13 181.090 0.30 A 47 ALA CA C 13 52.240 0.30 A 47 ALA CB C 13 19.180 0.30 A 47 ALA N N 15 124.930 0.30 A 48 GLU H H 1 8.740 0.02 A 48 GLU HA H 1 3.950 0.02 A 48 GLU HBx H 1 1.930 0.02 A 48 GLU HBy H 1 1.930 0.02 A 48 GLU HGx H 1 2.220 0.02 A 48 GLU HGy H 1 2.220 0.02 A 48 GLU C C 13 178.590 0.30 A 48 GLU CA C 13 58.150 0.30 A 48 GLU CB C 13 29.340 0.30 A 48 GLU N N 15 121.250 0.30 A 49 ASP H H 1 8.170 0.02 A 49 ASP HA H 1 4.450 0.02 A 49 ASP HBx H 1 2.500 0.02 A 49 ASP HBy H 1 2.720 0.02 A 49 ASP C C 13 178.090 0.30 A 49 ASP CA C 13 52.760 0.30 A 49 ASP CB C 13 39.400 0.30 A 49 ASP N N 15 115.640 0.30 A 50 CYS H H 1 7.420 0.02 A 50 CYS HA H 1 4.280 0.02 A 50 CYS HBy H 1 3.110 0.02 A 50 CYS HBx H 1 2.960 0.02 A 50 CYS C C 13 177.290 0.30 A 50 CYS CA C 13 57.620 0.30 A 50 CYS CB C 13 42.000 0.30 A 50 CYS N N 15 118.930 0.30 A 51 ALA H H 1 9.040 0.02 A 51 ALA HA H 1 4.190 0.02 A 51 ALA HB% H 1 1.360 0.02 A 51 ALA CA C 13 53.460 0.30 A 51 ALA CB C 13 19.180 0.30 A 51 ALA N N 15 131.890 0.30 A 52 LEU H H 1 7.680 0.02 A 52 LEU HA H 1 4.400 0.02 A 52 LEU HBx H 1 1.380 0.02 A 52 LEU HBy H 1 1.440 0.02 A 52 LEU HDx% H 1 0.860 0.02 A 52 LEU HDy% H 1 0.780 0.02 A 52 LEU HG H 1 1.540 0.02 A 52 LEU CA C 13 54.670 0.30 A 52 LEU CB C 13 43.319 0.30 A 52 LEU N N 15 120.480 0.30 A 53 VAL HA H 1 4.320 0.02 A 53 VAL HB H 1 1.840 0.02 A 53 VAL HGx% H 1 0.770 0.02 A 53 VAL HGy% H 1 0.770 0.02 A 53 VAL C C 13 178.340 0.30 A 53 VAL CA C 13 61.620 0.30 A 53 VAL CB C 13 32.550 0.30 A 54 VAL H H 1 8.880 0.02 A 54 VAL HA H 1 4.290 0.02 A 54 VAL HB H 1 1.860 0.02 A 54 VAL HGx% H 1 0.790 0.02 A 54 VAL HGy% H 1 0.790 0.02 A 54 VAL C C 13 176.710 0.30 A 54 VAL CA C 13 60.660 0.30 A 54 VAL CB C 13 34.540 0.30 A 54 VAL N N 15 124.350 0.30 A 55 LYS H H 1 8.520 0.02 A 55 LYS HA H 1 4.410 0.02 A 55 LYS HBx H 1 1.510 0.02 A 55 LYS HBy H 1 1.760 0.02 A 55 LYS HDx H 1 1.220 0.02 A 55 LYS HDy H 1 1.220 0.02 A 55 LYS HGx H 1 1.500 0.02 A 55 LYS HGy H 1 1.500 0.02 A 55 LYS C C 13 177.890 0.30 A 55 LYS CA C 13 55.280 0.30 A 55 LYS CB C 13 33.760 0.30 A 55 LYS N N 15 126.480 0.30 A 56 GLN H H 1 8.770 0.02 A 56 GLN HA H 1 4.310 0.02 A 56 GLN HBx H 1 1.890 0.02 A 56 GLN HBy H 1 1.890 0.02 A 56 GLN HGx H 1 2.290 0.02 A 56 GLN HGy H 1 2.290 0.02 A 56 GLN C C 13 178.280 0.30 A 56 GLN CA C 13 55.020 0.30 A 56 GLN CB C 13 29.600 0.30 A 56 GLN N N 15 126.290 0.30 A 57 THR H H 1 8.570 0.02 A 57 THR HA H 1 3.950 0.02 A 57 THR HB H 1 3.950 0.02 A 57 THR HG2% H 1 1.180 0.02 A 57 THR C C 13 178.060 0.30 A 57 THR CA C 13 64.480 0.30 A 57 THR CB C 13 68.560 0.30 A 57 THR N N 15 120.090 0.30 A 58 GLY H H 1 8.960 0.02 A 58 GLY HAx H 1 3.690 0.02 A 58 GLY HAy H 1 4.060 0.02 A 58 GLY C C 13 175.240 0.30 A 58 GLY CA C 13 45.040 0.30 A 58 GLY N N 15 114.680 0.30 A 59 ALA H H 1 7.780 0.02 A 59 ALA HA H 1 4.490 0.02 A 59 ALA HB% H 1 1.320 0.02 A 59 ALA C C 13 179.430 0.30 A 59 ALA CA C 13 50.680 0.30 A 59 ALA CB C 13 20.750 0.30 A 59 ALA N N 15 121.450 0.30 A 60 CYS H H 1 8.690 0.02 A 60 CYS HA H 1 4.150 0.02 A 60 CYS HBy H 1 2.960 0.02 A 60 CYS HBx H 1 2.670 0.02 A 60 CYS C C 13 177.330 0.30 A 60 CYS CA C 13 58.150 0.30 A 60 CYS CB C 13 41.830 0.30 A 60 CYS N N 15 118.160 0.30 A 61 CYS H H 1 8.310 0.02 A 61 CYS HA H 1 4.880 0.02 A 61 CYS HBy H 1 3.250 0.02 A 61 CYS HBx H 1 2.580 0.02 A 61 CYS C C 13 177.510 0.30 A 61 CYS CA C 13 52.510 0.30 A 61 CYS CB C 13 39.400 0.30 A 61 CYS N N 15 115.360 0.30 A 62 GLU H H 1 8.910 0.02 A 62 GLU HA H 1 4.270 0.02 A 62 GLU HBx H 1 1.830 0.02 A 62 GLU HBy H 1 1.830 0.02 A 62 GLU HGx H 1 2.170 0.02 A 62 GLU HGy H 1 2.170 0.02 A 62 GLU C C 13 177.380 0.30 A 62 GLU CA C 13 56.410 0.30 A 62 GLU CB C 13 30.550 0.30 A 62 GLU N N 15 122.610 0.30 A 63 LYS H H 1 8.610 0.03 A 63 LYS HA H 1 4.550 0.02 A 63 LYS HBx H 1 1.560 0.02 A 63 LYS HBy H 1 1.670 0.02 A 63 LYS HDx H 1 1.270 0.02 A 63 LYS HDy H 1 1.270 0.02 A 63 LYS HGx H 1 1.550 0.02 A 63 LYS HGy H 1 1.550 0.02 A 63 LYS C C 13 176.490 0.30 A 63 LYS CA C 13 54.530 0.30 A 63 LYS CB C 13 36.110 0.30 A 63 LYS N N 15 118.930 0.30 A 64 CYS H H 1 8.870 0.02 A 64 CYS HA H 1 5.710 0.02 A 64 CYS HBy H 1 2.690 0.02 A 64 CYS HBx H 1 2.410 0.02 A 64 CYS C C 13 177.430 0.30 A 64 CYS CA C 13 55.940 0.30 A 64 CYS CB C 13 42.950 0.30 A 64 CYS N N 15 120.670 0.30 A 65 LYS H H 1 9.020 0.02 A 65 LYS HA H 1 4.210 0.02 A 65 LYS HBx H 1 1.540 0.02 A 65 LYS HBy H 1 1.820 0.02 A 65 LYS HDx H 1 1.350 0.02 A 65 LYS HDy H 1 1.350 0.02 A 65 LYS HGx H 1 1.560 0.02 A 65 LYS HGy H 1 1.560 0.02 A 65 LYS C C 13 176.870 0.30 A 65 LYS CA C 13 56.500 0.30 A 65 LYS CB C 13 33.070 0.30 A 65 LYS N N 15 129.770 0.30 A 66 GLY H H 1 7.870 0.02 A 66 GLY HAx H 1 3.680 0.02 A 66 GLY HAy H 1 3.770 0.02 A 66 GLY C C 13 178.510 0.30 A 66 GLY CA C 13 46.170 0.30 A 66 GLY N N 15 117.000 0.30 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 -2 SER HBy A 1 LEU H 1.0 1.8 5.5 2 2 A -2 SER HBy A 1 LEU H 1.0 1.8 5.5 3 3 A 1 LEU H A -2 SER HBx 1.0 1.8 5.5 4 4 A 2 ILE HG1x A 1 LEU HBx 1.0 1.8 5.0 5 4 A 1 LEU HBy A 2 ILE HG1x 1.0 1.8 5.0 6 5 A 2 ILE H A 1 LEU HA 1.0 1.8 4.0 7 6 A 3 THR H A 2 ILE HG2% 1.0 1.8 5.0 8 7 A 3 THR H A 2 ILE HA 1.0 1.8 4.0 9 8 A 3 THR H A 4 GLY H 1.0 1.8 5.5 10 9 A 4 GLY H A 3 THR HA 1.0 1.8 4.0 11 10 A 4 GLY H A 3 THR HB 1.0 1.8 5.0 12 11 A 4 GLY H A 3 THR HG2% 1.0 1.8 5.0 13 11 A 4 GLY H A 3 THR HG1 1.0 1.8 5.0 14 12 A 4 GLY H A 5 THR H 1.0 1.8 5.5 15 13 A 5 THR H A 4 GLY HAy 1.0 1.8 4.0 16 14 A 5 THR H A 4 GLY HAx 1.0 1.8 4.0 17 15 A 5 THR H A 6 GLU H 1.0 1.8 4.0 18 16 A 6 GLU H A 5 THR HA 1.0 1.8 5.5 19 17 A 5 THR H A 6 GLU H 1.0 1.8 4.0 20 18 A 6 GLU H A 5 THR HA 1.0 1.8 4.0 21 19 A 6 GLU HBy A 7 ALA H 1.0 1.8 5.5 22 20 A 7 ALA H A 6 GLU HBx 1.0 1.8 5.5 23 21 A 6 GLU H A 7 ALA H 1.0 1.8 5.0 24 22 A 7 ALA H A 6 GLU HA 1.0 1.8 4.0 25 23 A 6 GLU HBy A 7 ALA H 1.0 1.8 4.0 26 24 A 7 ALA H A 6 GLU HBx 1.0 1.8 4.0 27 25 A 7 ALA H A 6 GLU HGx 1.0 1.8 5.0 28 25 A 7 ALA H A 6 GLU HGy 1.0 1.8 5.0 29 26 A 7 ALA H A 8 SER HBx 1.0 1.8 6.5 30 26 A 7 ALA H A 8 SER HBy 1.0 1.8 6.5 31 27 A 7 ALA HA A 8 SER H 1.0 1.8 5.5 32 28 A 8 SER H A 7 ALA HB% 1.0 1.8 5.0 33 29 A 7 ALA HB% A 16 LEU HDy% 1.0 1.8 6.0 34 30 A 7 ALA HB% A 36 ALA H 1.0 1.8 6.5 35 31 A 7 ALA HB% A 36 ALA HB% 1.0 1.8 5.0 36 32 A 7 ALA H A 8 SER H 1.0 1.8 5.5 37 33 A 7 ALA HA A 8 SER H 1.0 1.8 4.0 38 34 A 8 SER H A 7 ALA HB% 1.0 1.8 4.0 39 35 A 7 ALA HB% A 8 SER HBx 1.0 1.8 7.5 40 35 A 8 SER HBy A 7 ALA HB% 1.0 1.8 7.5 41 36 A 9 CYS H A 8 SER HBx 1.0 1.8 4.0 42 36 A 8 SER HBy A 9 CYS H 1.0 1.8 4.0 43 37 A 34 GLN HBy A 8 SER HBx 1.0 1.8 6.5 44 37 A 8 SER HBy A 34 GLN HBy 1.0 1.8 6.5 45 38 A 34 GLN HBx A 8 SER HBx 1.0 1.8 7.5 46 38 A 8 SER HBy A 34 GLN HBx 1.0 1.8 7.5 47 39 A 35 LYS HA A 8 SER HBx 1.0 1.8 6.5 48 39 A 8 SER HBy A 35 LYS HA 1.0 1.8 6.5 49 40 A 9 CYS H A 8 SER HA 1.0 1.8 5.5 50 41 A 9 CYS H A 8 SER HBx 1.0 1.8 4.0 51 41 A 8 SER HBy A 9 CYS H 1.0 1.8 4.0 52 42 A 9 CYS H A 10 GLU HA 1.0 1.8 5.5 53 43 A 16 LEU HDy% A 9 CYS H 1.0 1.8 6.5 54 44 A 9 CYS H A 34 GLN HA 1.0 1.8 4.0 55 45 A 9 CYS H A 34 GLN HBy 1.0 1.8 4.0 56 46 A 9 CYS H A 34 GLN HBx 1.0 1.8 5.5 57 47 A 9 CYS H A 35 LYS H 1.0 1.8 5.5 58 48 A 9 CYS H A 35 LYS HA 1.0 1.8 4.0 59 49 A 9 CYS H A 35 LYS HGx 1.0 1.8 6.5 60 49 A 9 CYS H A 35 LYS HGy 1.0 1.8 6.5 61 50 A 9 CYS HBx A 10 GLU H 1.0 1.8 4.0 62 51 A 9 CYS HBx A 16 LEU HDx% 1.0 1.8 5.0 63 52 A 16 LEU HDy% A 9 CYS HBx 1.0 1.8 5.0 64 53 A 9 CYS HBx A 31 CYS HBy 1.0 1.8 4.0 65 54 A 10 GLU H A 9 CYS HBy 1.0 1.8 4.0 66 55 A 10 GLU HA A 9 CYS HBy 1.0 1.8 5.5 67 56 A 16 LEU HDx% A 9 CYS HBy 1.0 1.8 5.0 68 57 A 16 LEU HDy% A 9 CYS HBy 1.0 1.8 5.0 69 58 A 31 CYS HBy A 9 CYS HBy 1.0 1.8 5.5 70 59 A 36 ALA HB% A 9 CYS HBy 1.0 1.8 6.5 71 60 A 10 GLU H A 9 CYS HA 1.0 1.8 4.0 72 61 A 9 CYS HBx A 10 GLU H 1.0 1.8 4.0 73 62 A 10 GLU H A 9 CYS HBy 1.0 1.8 4.0 74 63 A 10 GLU H A 31 CYS HBy 1.0 1.8 5.5 75 64 A 9 CYS HA A 10 GLU HGx 1.0 1.8 5.0 76 64 A 9 CYS HA A 10 GLU HGy 1.0 1.8 5.0 77 65 A 9 CYS HA A 11 ASN H 1.0 1.8 5.5 78 66 A 9 CYS HBx A 11 ASN H 1.0 1.8 4.0 79 67 A 9 CYS HBy A 11 ASN H 1.0 1.8 5.5 80 68 A 10 GLU HA A 11 ASN H 1.0 1.8 5.5 81 69 A 11 ASN H A 10 GLU HBy 1.0 1.8 4.0 82 70 A 11 ASN H A 10 GLU HBx 1.0 1.8 4.0 83 71 A 11 ASN H A 10 GLU HGx 1.0 1.8 6.5 84 71 A 10 GLU HGy A 11 ASN H 1.0 1.8 6.5 85 72 A 11 ASN H A 12 GLU HA 1.0 1.8 5.5 86 73 A 11 ASN H A 14 GLU HGy 1.0 1.8 5.5 87 74 A 11 ASN H A 31 CYS HBx 1.0 1.8 5.5 88 75 A 31 CYS HBy A 11 ASN H 1.0 1.8 5.5 89 76 A 11 ASN HBy A 12 GLU H 1.0 1.8 4.0 90 77 A 11 ASN HBy A 14 GLU H 1.0 1.8 5.5 91 78 A 11 ASN HBy A 14 GLU HBx 1.0 1.8 4.0 92 78 A 11 ASN HBy A 14 GLU HBy 1.0 1.8 4.0 93 79 A 11 ASN HBy A 14 GLU HGx 1.0 1.8 4.0 94 80 A 10 GLU HBy A 11 ASN HBx 1.0 1.8 5.5 95 81 A 12 GLU H A 11 ASN HBx 1.0 1.8 4.0 96 82 A 11 ASN HBx A 14 GLU HBx 1.0 1.8 5.0 97 82 A 14 GLU HBy A 11 ASN HBx 1.0 1.8 5.0 98 83 A 11 ASN H A 12 GLU H 1.0 1.8 5.5 99 84 A 12 GLU H A 11 ASN HA 1.0 1.8 4.0 100 85 A 11 ASN HBy A 12 GLU H 1.0 1.8 4.0 101 86 A 12 GLU H A 11 ASN HBx 1.0 1.8 4.0 102 87 A 12 GLU H A 13 GLY H 1.0 1.8 4.0 103 88 A 11 ASN HA A 12 GLU HBy 1.0 1.8 5.5 104 89 A 13 GLY H A 12 GLU HBy 1.0 1.8 5.5 105 90 A 13 GLY H A 12 GLU HBx 1.0 1.8 5.5 106 91 A 13 GLY H A 12 GLU HGy 1.0 1.8 5.5 107 92 A 13 GLY H A 12 GLU HGx 1.0 1.8 4.0 108 93 A 12 GLU H A 13 GLY H 1.0 1.8 4.0 109 94 A 12 GLU HA A 13 GLY H 1.0 1.8 3.0 110 95 A 13 GLY H A 12 GLU HBy 1.0 1.8 5.5 111 96 A 13 GLY H A 12 GLU HBx 1.0 1.8 5.5 112 97 A 13 GLY H A 12 GLU HGy 1.0 1.8 5.5 113 98 A 13 GLY H A 12 GLU HGx 1.0 1.8 5.5 114 99 A 14 GLU H A 13 GLY H 1.0 1.8 4.0 115 100 A 13 GLY H A 30 VAL HA 1.0 1.8 5.5 116 101 A 13 GLY H A 30 VAL HGy% 1.0 1.8 5.0 117 102 A 31 CYS HBx A 13 GLY H 1.0 1.8 4.0 118 103 A 31 CYS HBy A 13 GLY H 1.0 1.8 4.0 119 104 A 13 GLY H A 32 LEU HA 1.0 1.8 4.0 120 105 A 13 GLY H A 32 LEU HBy 1.0 1.8 6.5 121 106 A 13 GLY H A 32 LEU HDx% 1.0 1.8 7.5 122 106 A 13 GLY H A 32 LEU HDy% 1.0 1.8 7.5 123 107 A 13 GLY H A 33 ASN H 1.0 1.8 5.5 124 108 A 14 GLU H A 11 ASN HBx 1.0 1.8 5.5 125 109 A 14 GLU H A 13 GLY H 1.0 1.8 3.0 126 110 A 14 GLU H A 13 GLY HAy 1.0 1.8 5.5 127 111 A 14 GLU H A 13 GLY HAx 1.0 1.8 4.0 128 112 A 14 GLU H A 15 VAL H 1.0 1.8 4.0 129 113 A 14 GLU H A 15 VAL HA 1.0 1.8 5.5 130 114 A 16 LEU HDy% A 14 GLU H 1.0 1.8 6.5 131 115 A 16 LEU HDx% A 14 GLU H 1.0 1.8 5.0 132 116 A 14 GLU H A 16 LEU HG 1.0 1.8 5.5 133 117 A 14 GLU H A 30 VAL HA 1.0 1.8 5.5 134 118 A 14 GLU H A 30 VAL HB 1.0 1.8 5.5 135 119 A 31 CYS HBx A 14 GLU H 1.0 1.8 3.0 136 120 A 31 CYS HBy A 14 GLU H 1.0 1.8 4.0 137 121 A 15 VAL H A 14 GLU HA 1.0 1.8 3.0 138 122 A 14 GLU HA A 15 VAL HB 1.0 1.8 5.5 139 123 A 14 GLU HA A 15 VAL HGx% 1.0 1.8 6.5 140 124 A 14 GLU HA A 30 VAL HGy% 1.0 1.8 6.5 141 125 A 11 ASN HBy A 14 GLU HBx 1.0 1.8 4.0 142 125 A 11 ASN HBy A 14 GLU HBy 1.0 1.8 4.0 143 126 A 11 ASN HBx A 14 GLU HBx 1.0 1.8 5.0 144 126 A 14 GLU HBy A 11 ASN HBx 1.0 1.8 5.0 145 127 A 31 CYS HBx A 14 GLU HBx 1.0 1.8 5.0 146 127 A 31 CYS HBx A 14 GLU HBy 1.0 1.8 5.0 147 128 A 31 CYS HBy A 14 GLU HBx 1.0 1.8 6.5 148 128 A 31 CYS HBy A 14 GLU HBy 1.0 1.8 6.5 149 129 A 14 GLU HGx A 15 VAL H 1.0 1.8 4.0 150 130 A 14 GLU H A 15 VAL H 1.0 1.8 4.0 151 131 A 15 VAL H A 14 GLU HBx 1.0 1.8 5.0 152 131 A 14 GLU HBy A 15 VAL H 1.0 1.8 5.0 153 132 A 14 GLU HGy A 15 VAL H 1.0 1.8 4.0 154 133 A 14 GLU HGx A 15 VAL H 1.0 1.8 4.0 155 134 A 15 VAL H A 16 LEU H 1.0 1.8 4.0 156 135 A 15 VAL H A 16 LEU HA 1.0 1.8 5.5 157 136 A 15 VAL HA A 16 LEU H 1.0 1.8 3.0 158 137 A 15 VAL HA A 16 LEU HBx 1.0 1.8 6.5 159 137 A 15 VAL HA A 16 LEU HBy 1.0 1.8 6.5 160 138 A 15 VAL HA A 16 LEU HG 1.0 1.8 5.5 161 139 A 16 LEU HDy% A 15 VAL HA 1.0 1.8 6.5 162 140 A 30 VAL HA A 15 VAL HA 1.0 1.8 3.0 163 141 A 15 VAL HA A 30 VAL HGy% 1.0 1.8 4.0 164 142 A 14 GLU HA A 15 VAL HB 1.0 1.8 4.0 165 143 A 15 VAL HB A 16 LEU H 1.0 1.8 5.5 166 144 A 15 VAL HGx% A 16 LEU H 1.0 1.8 5.0 167 145 A 15 VAL HGx% A 30 VAL HGy% 1.0 1.8 5.0 168 146 A 15 VAL H A 16 LEU H 1.0 1.8 4.0 169 147 A 15 VAL HA A 16 LEU H 1.0 1.8 3.0 170 148 A 15 VAL HB A 16 LEU H 1.0 1.8 5.5 171 149 A 15 VAL HGx% A 16 LEU H 1.0 1.8 5.0 172 150 A 16 LEU H A 15 VAL HGy% 1.0 1.8 4.0 173 151 A 16 LEU H A 29 CYS H 1.0 1.8 5.5 174 152 A 16 LEU H A 29 CYS HA 1.0 1.8 5.5 175 153 A 16 LEU H A 29 CYS HBx 1.0 1.8 5.5 176 154 A 16 LEU H A 29 CYS HBy 1.0 1.8 5.5 177 155 A 30 VAL HA A 16 LEU H 1.0 1.8 4.0 178 156 A 16 LEU HA A 17 HIS H 1.0 1.8 7.5 179 157 A 29 CYS HBx A 16 LEU HBx 1.0 1.8 5.0 180 157 A 16 LEU HBy A 29 CYS HBx 1.0 1.8 5.0 181 158 A 29 CYS HBy A 16 LEU HBx 1.0 1.8 5.0 182 158 A 16 LEU HBy A 29 CYS HBy 1.0 1.8 5.0 183 159 A 14 GLU H A 16 LEU HG 1.0 1.8 5.5 184 160 A 15 VAL HA A 16 LEU HG 1.0 1.8 5.5 185 161 A 16 LEU HG A 31 CYS H 1.0 1.8 4.0 186 162 A 31 CYS HBy A 16 LEU HG 1.0 1.8 5.5 187 163 A 16 LEU HDy% A 9 CYS HA 1.0 1.8 5.0 188 164 A 16 LEU HDy% A 9 CYS HBx 1.0 1.8 5.0 189 165 A 16 LEU HDy% A 9 CYS HBy 1.0 1.8 4.0 190 166 A 16 LEU HDy% A 29 CYS HA 1.0 1.8 6.5 191 167 A 16 LEU HDy% A 30 VAL H 1.0 1.8 5.0 192 168 A 16 LEU HDy% A 30 VAL HA 1.0 1.8 5.0 193 169 A 16 LEU HDy% A 31 CYS H 1.0 1.8 5.0 194 170 A 16 LEU HDy% A 31 CYS HA 1.0 1.8 5.0 195 171 A 16 LEU HDy% A 31 CYS HBx 1.0 1.8 5.0 196 172 A 16 LEU HDy% A 31 CYS HBy 1.0 1.8 5.0 197 173 A 16 LEU HDy% A 32 LEU H 1.0 1.8 6.5 198 174 A 16 LEU HDy% A 36 ALA H 1.0 1.8 5.0 199 175 A 16 LEU HDy% A 36 ALA HA 1.0 1.8 4.0 200 176 A 16 LEU HDy% A 36 ALA HB% 1.0 1.8 5.0 201 177 A 16 LEU HDy% A 37 GLU H 1.0 1.8 5.0 202 178 A 15 VAL HGx% A 17 HIS H 1.0 1.8 6.5 203 179 A 15 VAL HGy% A 17 HIS H 1.0 1.8 5.0 204 180 A 16 LEU H A 17 HIS H 1.0 1.8 5.5 205 181 A 16 LEU HA A 17 HIS H 1.0 1.8 3.0 206 182 A 17 HIS H A 16 LEU HBx 1.0 1.8 5.0 207 182 A 16 LEU HBy A 17 HIS H 1.0 1.8 5.0 208 183 A 16 LEU HDx% A 17 HIS H 1.0 1.8 5.0 209 184 A 17 HIS H A 18 ILE HD1% 1.0 1.8 5.0 210 185 A 18 ILE H A 17 HIS HA 1.0 1.8 4.0 211 186 A 18 ILE H A 17 HIS HBx 1.0 1.8 5.0 212 186 A 18 ILE H A 17 HIS HBy 1.0 1.8 5.0 213 187 A 18 ILE H A 19 PRO HDy 1.0 1.8 5.5 214 188 A 18 ILE H A 19 PRO HDx 1.0 1.8 5.5 215 189 A 18 ILE H A 22 THR H 1.0 1.8 4.0 216 190 A 18 ILE H A 22 THR HG2% 1.0 1.8 5.0 217 191 A 18 ILE HA A 21 ILE HG2% 1.0 1.8 6.5 218 192 A 18 ILE HB A 21 ILE H 1.0 1.8 4.0 219 193 A 7 ALA HA A 18 ILE HD1% 1.0 1.8 5.5 220 194 A 7 ALA HB% A 18 ILE HD1% 1.0 1.8 6.0 221 195 A 18 ILE HD1% A 19 PRO HDy 1.0 1.8 6.5 222 196 A 18 ILE HD1% A 19 PRO HDx 1.0 1.8 6.5 223 197 A 18 ILE HD1% A 21 ILE HB 1.0 1.8 5.0 224 198 A 29 CYS HBx A 18 ILE HD1% 1.0 1.8 5.0 225 199 A 29 CYS HBy A 18 ILE HD1% 1.0 1.8 5.0 226 200 A 19 PRO HA A 20 ASN HA 1.0 1.8 5.5 227 201 A 19 PRO HA A 20 ASN H 1.0 1.8 4.0 228 202 A 21 ILE H A 19 PRO HA 1.0 1.8 5.5 229 203 A 20 ASN H A 19 PRO HBx 1.0 1.8 4.0 230 204 A 20 ASN H A 19 PRO HBy 1.0 1.8 5.5 231 205 A 18 ILE HG2% A 19 PRO HGx 1.0 1.8 6.0 232 205 A 19 PRO HGy A 18 ILE HG2% 1.0 1.8 6.0 233 206 A 20 ASN HBy A 19 PRO HGx 1.0 1.8 6.5 234 206 A 19 PRO HGy A 20 ASN HBy 1.0 1.8 6.5 235 207 A 19 PRO HDy A 18 ILE HA 1.0 1.8 3.0 236 208 A 19 PRO HDx A 18 ILE HA 1.0 1.8 3.0 237 209 A 19 PRO HA A 20 ASN H 1.0 1.8 4.0 238 210 A 20 ASN H A 19 PRO HBx 1.0 1.8 4.0 239 211 A 20 ASN H A 19 PRO HBy 1.0 1.8 4.0 240 212 A 20 ASN H A 19 PRO HGx 1.0 1.8 5.0 241 212 A 20 ASN H A 19 PRO HGy 1.0 1.8 5.0 242 213 A 19 PRO HDx A 20 ASN H 1.0 2.8 6.5 243 214 A 22 THR H A 20 ASN H 1.0 1.8 5.5 244 215 A 20 ASN H A 23 ASP H 1.0 1.8 5.5 245 216 A 20 ASN H A 23 ASP HBy 1.0 1.8 5.5 246 217 A 20 ASN H A 23 ASP HBx 1.0 1.8 5.5 247 218 A 18 ILE HA A 21 ILE H 1.0 1.8 5.5 248 219 A 18 ILE HB A 21 ILE H 1.0 1.8 4.0 249 220 A 18 ILE HD1% A 21 ILE H 1.0 1.8 6.5 250 221 A 21 ILE H A 19 PRO HA 1.0 1.8 5.5 251 222 A 21 ILE H A 19 PRO HBx 1.0 1.8 5.5 252 223 A 21 ILE H A 19 PRO HBy 1.0 1.8 5.5 253 224 A 21 ILE H A 20 ASN H 1.0 1.8 4.0 254 225 A 21 ILE H A 20 ASN HA 1.0 1.8 4.0 255 226 A 21 ILE H A 20 ASN HBy 1.0 1.8 4.0 256 227 A 21 ILE H A 20 ASN HBx 1.0 1.8 4.0 257 228 A 22 THR H A 21 ILE H 1.0 1.8 3.0 258 229 A 21 ILE H A 23 ASP H 1.0 1.8 4.0 259 230 A 21 ILE H A 23 ASP HBy 1.0 1.8 5.5 260 231 A 21 ILE H A 23 ASP HBy 1.0 1.8 5.5 261 232 A 21 ILE H A 24 ASN H 1.0 1.8 5.5 262 233 A 21 ILE H A 27 ILE HD1% 1.0 1.8 6.5 263 234 A 22 THR H A 21 ILE HA 1.0 1.8 5.5 264 235 A 27 ILE HD1% A 21 ILE HA 1.0 1.8 5.0 265 236 A 22 THR H A 21 ILE HB 1.0 1.8 3.0 266 237 A 22 THR H A 18 ILE HB 1.0 1.8 4.0 267 238 A 22 THR H A 18 ILE HG1x 1.0 1.8 5.5 268 239 A 22 THR H A 19 PRO HA 1.0 1.8 5.5 269 240 A 22 THR H A 21 ILE H 1.0 1.8 3.0 270 241 A 22 THR H A 21 ILE HA 1.0 1.8 5.5 271 242 A 22 THR H A 21 ILE HB 1.0 1.8 3.0 272 243 A 22 THR H A 21 ILE HG2% 1.0 1.8 5.0 273 244 A 22 THR H A 23 ASP HBx 1.0 1.8 5.5 274 245 A 22 THR H A 24 ASN H 1.0 1.8 5.5 275 246 A 22 THR H A 28 SER HA 1.0 1.8 5.5 276 247 A 24 ASN H A 22 THR HA 1.0 1.8 5.5 277 248 A 22 THR HA A 24 ASN HA 1.0 1.8 5.5 278 249 A 22 THR HA A 24 ASN HBy 1.0 1.8 5.5 279 250 A 22 THR HA A 27 ILE HG2% 1.0 1.8 5.0 280 251 A 18 ILE H A 22 THR HG2% 1.0 1.8 4.0 281 252 A 22 THR HG2% A 21 ILE H 1.0 1.8 6.5 282 253 A 22 THR HG2% A 28 SER H 1.0 1.8 6.5 283 254 A 29 CYS H A 22 THR HG2% 1.0 1.8 4.0 284 255 A 29 CYS HBx A 22 THR HG2% 1.0 1.8 6.5 285 256 A 19 PRO HA A 23 ASP H 1.0 1.8 5.5 286 257 A 20 ASN H A 23 ASP H 1.0 1.8 5.5 287 258 A 21 ILE H A 23 ASP H 1.0 1.8 4.0 288 259 A 21 ILE HB A 23 ASP H 1.0 1.8 5.5 289 260 A 22 THR H A 23 ASP H 1.0 1.8 4.0 290 261 A 23 ASP H A 22 THR HA 1.0 1.8 5.5 291 262 A 23 ASP H A 22 THR HB 1.0 1.8 5.5 292 263 A 22 THR HG2% A 23 ASP H 1.0 1.8 5.0 293 263 A 23 ASP H A 22 THR HG1 1.0 1.8 5.0 294 264 A 23 ASP H A 24 ASN HBy 1.0 1.8 5.5 295 265 A 23 ASP H A 24 ASN HBx 1.0 1.8 5.5 296 266 A 23 ASP H A 27 ILE HD1% 1.0 1.8 6.5 297 267 A 20 ASN H A 23 ASP HBy 1.0 1.8 5.5 298 268 A 23 ASP HBy A 24 ASN H 1.0 1.8 5.5 299 269 A 20 ASN H A 23 ASP HBx 1.0 1.8 5.5 300 270 A 20 ASN HA A 23 ASP HBx 1.0 1.8 5.5 301 271 A 21 ILE H A 23 ASP HBx 1.0 1.8 6.5 302 272 A 22 THR H A 23 ASP HBx 1.0 1.8 6.5 303 273 A 23 ASP HBx A 24 ASN H 1.0 1.8 5.5 304 274 A 21 ILE H A 24 ASN H 1.0 1.8 5.5 305 275 A 24 ASN H A 21 ILE HA 1.0 1.8 5.5 306 276 A 21 ILE HG2% A 24 ASN H 1.0 1.8 6.5 307 277 A 24 ASN H A 22 THR HA 1.0 1.8 4.0 308 278 A 24 ASN H A 22 THR HB 1.0 1.8 5.0 309 279 A 22 THR HG2% A 24 ASN H 1.0 1.8 6.5 310 280 A 23 ASP H A 24 ASN H 1.0 1.8 3.0 311 281 A 24 ASN H A 23 ASP HA 1.0 1.8 4.0 312 282 A 23 ASP HBy A 24 ASN H 1.0 1.8 5.5 313 283 A 23 ASP HBx A 24 ASN H 1.0 1.8 4.0 314 284 A 24 ASN H A 25 PRO HDy 1.0 1.8 6.5 315 285 A 24 ASN H A 25 PRO HDx 1.0 1.8 6.5 316 286 A 24 ASN H A 27 ILE HB 1.0 1.8 5.5 317 287 A 24 ASN H A 27 ILE HG1y 1.0 1.8 5.5 318 288 A 24 ASN H A 27 ILE HG1x 1.0 1.8 5.5 319 289 A 24 ASN H A 27 ILE HD1% 1.0 1.8 5.0 320 290 A 24 ASN HBy A 27 ILE HB 1.0 1.8 4.0 321 291 A 24 ASN HBy A 27 ILE HG1y 1.0 1.8 4.0 322 292 A 24 ASN HBy A 27 ILE HG1x 1.0 1.8 6.5 323 293 A 27 ILE HD1% A 24 ASN HBy 1.0 1.8 5.0 324 294 A 23 ASP H A 24 ASN HBx 1.0 1.8 5.5 325 295 A 24 ASN HBx A 27 ILE HB 1.0 1.8 4.0 326 296 A 27 ILE HG2% A 24 ASN HBx 1.0 1.8 6.5 327 297 A 27 ILE HD1% A 24 ASN HBx 1.0 1.8 6.5 328 298 A 25 PRO HBy A 60 CYS HA 1.0 1.8 4.0 329 299 A 25 PRO HBy A 60 CYS HBy 1.0 1.8 4.0 330 300 A 60 CYS HA A 25 PRO HGy 1.0 1.8 4.0 331 301 A 24 ASN HA A 25 PRO HGx 1.0 1.8 4.0 332 302 A 60 CYS HA A 25 PRO HGx 1.0 1.8 4.0 333 303 A 60 CYS HBy A 25 PRO HGx 1.0 1.8 5.5 334 304 A 24 ASN H A 25 PRO HDy 1.0 1.8 5.5 335 305 A 24 ASN HA A 25 PRO HDy 1.0 1.8 3.0 336 306 A 25 PRO HDy A 26 CYS H 1.0 1.8 4.0 337 307 A 24 ASN H A 25 PRO HDx 1.0 1.8 5.5 338 308 A 24 ASN HA A 25 PRO HDx 1.0 1.8 3.0 339 309 A 25 PRO HDx A 26 CYS H 1.0 1.8 4.0 340 310 A 26 CYS H A 25 PRO HA 1.0 1.8 4.0 341 311 A 26 CYS H A 25 PRO HBx 1.0 1.8 4.0 342 312 A 25 PRO HDy A 26 CYS H 1.0 1.8 5.5 343 313 A 25 PRO HDx A 26 CYS H 1.0 1.8 4.0 344 314 A 26 CYS H A 27 ILE H 1.0 1.8 3.0 345 315 A 27 ILE HG1y A 26 CYS H 1.0 1.8 4.0 346 316 A 27 ILE HD1% A 26 CYS H 1.0 1.8 6.5 347 317 A 60 CYS HA A 26 CYS H 1.0 1.8 5.5 348 318 A 26 CYS H A 60 CYS HBx 1.0 1.8 5.5 349 319 A 60 CYS HBy A 26 CYS H 1.0 1.8 4.0 350 320 A 27 ILE H A 26 CYS HBy 1.0 1.8 4.0 351 321 A 26 CYS HBy A 40 GLN HGx 1.0 1.8 4.5 352 322 A 26 CYS HBy A 41 GLU H 1.0 1.8 5.5 353 323 A 24 ASN H A 27 ILE H 1.0 1.8 5.5 354 324 A 24 ASN HBy A 27 ILE H 1.0 1.8 4.0 355 325 A 24 ASN HBx A 27 ILE H 1.0 1.8 5.5 356 326 A 26 CYS H A 27 ILE H 1.0 1.8 3.0 357 327 A 27 ILE H A 26 CYS HA 1.0 1.8 4.0 358 328 A 27 ILE H A 26 CYS HBx 1.0 1.8 5.5 359 329 A 27 ILE H A 26 CYS HBy 1.0 1.8 4.0 360 330 A 27 ILE H A 40 GLN HA 1.0 1.8 5.5 361 331 A 27 ILE H A 40 GLN HBx 1.0 1.8 5.5 362 332 A 22 THR HG2% A 27 ILE HB 1.0 1.8 5.0 363 332 A 22 THR HG1 A 27 ILE HB 1.0 1.8 5.0 364 333 A 24 ASN HBy A 27 ILE HB 1.0 1.8 4.5 365 334 A 24 ASN HBy A 27 ILE HG1y 1.0 1.8 4.0 366 335 A 22 THR HA A 27 ILE HG2% 1.0 1.8 4.0 367 336 A 22 THR HG2% A 27 ILE HG2% 1.0 1.8 5.0 368 336 A 27 ILE HG2% A 22 THR HG1 1.0 1.8 5.0 369 337 A 27 ILE HG2% A 28 SER H 1.0 1.8 4.0 370 338 A 29 CYS H A 27 ILE HG2% 1.0 1.8 6.5 371 339 A 27 ILE HG2% A 38 CYS HA 1.0 1.8 6.5 372 340 A 27 ILE HG2% A 38 CYS HBx 1.0 1.8 5.0 373 341 A 27 ILE HG2% A 38 CYS HBy 1.0 1.8 4.0 374 342 A 27 ILE HG2% A 39 LYS H 1.0 1.8 5.0 375 343 A 27 ILE HG2% A 39 LYS HA 1.0 1.8 6.5 376 344 A 27 ILE HG2% A 40 GLN HA 1.0 1.8 5.0 377 345 A 27 ILE HD1% A 21 ILE HA 1.0 1.8 5.0 378 346 A 27 ILE HD1% A 22 THR HA 1.0 1.8 6.5 379 347 A 27 ILE HD1% A 24 ASN HBy 1.0 1.8 5.0 380 348 A 27 ILE HD1% A 24 ASN HBx 1.0 1.8 6.5 381 349 A 27 ILE HD1% A 26 CYS HBy 1.0 1.8 6.5 382 350 A 27 ILE HD1% A 38 CYS HBy 1.0 1.8 6.5 383 351 A 27 ILE HD1% A 40 GLN HA 1.0 1.8 5.0 384 352 A 27 ILE HD1% A 40 GLN HBx 1.0 1.8 5.0 385 353 A 27 ILE HD1% A 40 GLN HGy 1.0 1.8 6.5 386 354 A 27 ILE HD1% A 40 GLN HGx 1.0 1.8 5.0 387 355 A 27 ILE HD1% A 41 GLU H 1.0 1.8 6.5 388 356 A 28 SER H A 27 ILE H 1.0 1.8 5.5 389 357 A 28 SER H A 27 ILE HA 1.0 1.8 3.0 390 358 A 28 SER H A 27 ILE HG1y 1.0 1.8 5.5 391 359 A 27 ILE HG2% A 28 SER H 1.0 1.8 4.0 392 360 A 29 CYS H A 28 SER H 1.0 1.8 5.5 393 361 A 29 CYS HA A 28 SER H 1.0 1.8 5.5 394 362 A 28 SER H A 38 CYS HA 1.0 1.8 4.0 395 363 A 28 SER H A 38 CYS HBy 1.0 1.8 5.5 396 364 A 28 SER H A 39 LYS H 1.0 1.8 4.0 397 365 A 28 SER H A 40 GLN HA 1.0 1.8 4.0 398 366 A 29 CYS H A 28 SER HBy 1.0 1.8 4.0 399 367 A 29 CYS H A 28 SER HBx 1.0 1.8 4.0 400 368 A 15 VAL HA A 29 CYS H 1.0 1.8 5.5 401 369 A 15 VAL HGx% A 29 CYS H 1.0 1.8 6.5 402 370 A 15 VAL HGy% A 29 CYS H 1.0 1.8 5.0 403 371 A 16 LEU H A 29 CYS H 1.0 1.8 5.5 404 372 A 29 CYS H A 16 LEU HBx 1.0 1.8 6.5 405 372 A 16 LEU HBy A 29 CYS H 1.0 1.8 6.5 406 373 A 29 CYS H A 18 ILE HD1% 1.0 1.8 6.5 407 374 A 29 CYS H A 22 THR HG2% 1.0 1.8 4.0 408 374 A 29 CYS H A 22 THR HG1 1.0 1.8 4.0 409 375 A 29 CYS H A 27 ILE HG2% 1.0 1.8 6.5 410 376 A 29 CYS H A 28 SER H 1.0 1.8 6.5 411 377 A 29 CYS H A 28 SER HA 1.0 1.8 3.0 412 378 A 29 CYS H A 28 SER HBy 1.0 1.8 4.0 413 379 A 29 CYS H A 28 SER HBx 1.0 1.8 4.0 414 380 A 29 CYS H A 30 VAL H 1.0 1.8 5.5 415 381 A 29 CYS H A 30 VAL HGy% 1.0 1.8 7.5 416 381 A 29 CYS H A 30 VAL HGx% 1.0 1.8 7.5 417 382 A 29 CYS H A 31 CYS HA 1.0 1.8 6.5 418 383 A 29 CYS H A 38 CYS HA 1.0 1.8 5.5 419 384 A 16 LEU HDy% A 29 CYS HA 1.0 1.8 6.5 420 385 A 29 CYS HA A 28 SER H 1.0 1.8 5.5 421 386 A 29 CYS HA A 30 VAL H 1.0 1.8 3.0 422 387 A 30 VAL HA A 29 CYS HA 1.0 1.8 5.5 423 388 A 30 VAL HB A 29 CYS HA 1.0 1.8 5.5 424 389 A 29 CYS HA A 30 VAL HGy% 1.0 1.8 6.0 425 389 A 29 CYS HA A 30 VAL HGx% 1.0 1.8 6.0 426 390 A 36 ALA HB% A 29 CYS HA 1.0 1.8 6.5 427 391 A 29 CYS HA A 37 GLU H 1.0 1.8 5.5 428 392 A 29 CYS HA A 38 CYS HA 1.0 1.8 3.0 429 393 A 29 CYS HA A 38 CYS HBx 1.0 1.8 5.5 430 394 A 29 CYS HA A 38 CYS HBy 1.0 1.8 5.5 431 395 A 29 CYS HA A 39 LYS H 1.0 1.8 4.0 432 396 A 29 CYS HBx A 16 LEU HBx 1.0 1.8 5.0 433 396 A 16 LEU HBy A 29 CYS HBx 1.0 1.8 5.0 434 397 A 29 CYS HBx A 18 ILE HD1% 1.0 1.8 5.0 435 398 A 29 CYS HBx A 22 THR HG2% 1.0 1.8 5.0 436 399 A 29 CYS HBy A 16 LEU HBx 1.0 1.8 5.0 437 399 A 16 LEU HBy A 29 CYS HBy 1.0 1.8 5.0 438 400 A 29 CYS HBy A 18 ILE HD1% 1.0 1.8 5.0 439 401 A 29 CYS HBy A 37 GLU H 1.0 1.8 5.5 440 402 A 29 CYS HBy A 38 CYS H 1.0 1.8 5.5 441 403 A 15 VAL HA A 30 VAL H 1.0 1.8 5.5 442 404 A 16 LEU H A 30 VAL H 1.0 1.8 5.5 443 405 A 29 CYS H A 30 VAL H 1.0 1.8 5.5 444 406 A 29 CYS HA A 30 VAL H 1.0 1.8 3.0 445 407 A 29 CYS HBx A 30 VAL H 1.0 1.8 4.0 446 408 A 29 CYS HBy A 30 VAL H 1.0 1.8 4.0 447 409 A 30 VAL H A 36 ALA HA 1.0 1.8 4.0 448 410 A 36 ALA HB% A 30 VAL H 1.0 1.8 6.5 449 411 A 30 VAL H A 37 GLU H 1.0 1.8 4.0 450 412 A 30 VAL H A 37 GLU HBy 1.0 1.8 4.0 451 413 A 30 VAL H A 37 GLU HBx 1.0 1.8 4.0 452 414 A 30 VAL H A 38 CYS HA 1.0 1.8 4.0 453 415 A 30 VAL H A 39 LYS HGy 1.0 1.8 5.5 454 416 A 30 VAL HA A 15 VAL HA 1.0 1.8 5.5 455 417 A 13 GLY H A 30 VAL HB 1.0 1.8 6.5 456 418 A 15 VAL HA A 30 VAL HB 1.0 1.8 4.0 457 419 A 30 VAL HB A 31 CYS H 1.0 1.8 4.0 458 420 A 31 CYS H A 30 VAL HGy% 1.0 1.8 4.0 459 421 A 9 CYS HBx A 31 CYS H 1.0 1.8 5.5 460 422 A 14 GLU H A 31 CYS H 1.0 1.8 4.0 461 423 A 16 LEU HDy% A 31 CYS H 1.0 1.8 5.0 462 424 A 16 LEU HG A 31 CYS H 1.0 1.8 4.0 463 425 A 31 CYS H A 30 VAL H 1.0 1.8 5.5 464 426 A 30 VAL HA A 31 CYS H 1.0 1.8 3.0 465 427 A 30 VAL HB A 31 CYS H 1.0 1.8 3.5 466 428 A 31 CYS H A 30 VAL HGy% 1.0 1.8 5.0 467 428 A 31 CYS H A 30 VAL HGx% 1.0 1.8 5.0 468 429 A 16 LEU HDy% A 31 CYS HA 1.0 1.8 5.0 469 430 A 31 CYS HBx A 14 GLU H 1.0 1.8 4.0 470 431 A 31 CYS HBx A 14 GLU HBx 1.0 1.8 4.5 471 431 A 31 CYS HBx A 14 GLU HBy 1.0 1.8 4.5 472 432 A 16 LEU HDx% A 31 CYS HBx 1.0 1.8 5.0 473 433 A 16 LEU HDy% A 31 CYS HBx 1.0 1.8 5.0 474 434 A 31 CYS HBx A 16 LEU HG 1.0 1.8 5.5 475 435 A 31 CYS HBx A 30 VAL HA 1.0 1.8 5.5 476 436 A 9 CYS HBx A 31 CYS HBy 1.0 1.8 4.0 477 437 A 31 CYS HBy A 9 CYS HBy 1.0 1.8 5.5 478 438 A 31 CYS HBy A 13 GLY H 1.0 1.8 5.5 479 439 A 31 CYS HBy A 13 GLY HAy 1.0 1.8 5.5 480 440 A 31 CYS HBy A 14 GLU H 1.0 1.8 4.0 481 441 A 31 CYS HBy A 14 GLU HBx 1.0 1.8 5.0 482 441 A 31 CYS HBy A 14 GLU HBy 1.0 1.8 5.0 483 442 A 31 CYS HBy A 16 LEU HG 1.0 1.8 4.0 484 443 A 16 LEU HDx% A 31 CYS HBy 1.0 1.8 5.0 485 444 A 16 LEU HDy% A 31 CYS HBy 1.0 1.8 5.0 486 445 A 31 CYS HBy A 32 LEU H 1.0 1.8 5.5 487 446 A 12 GLU HA A 32 LEU H 1.0 1.8 5.5 488 447 A 16 LEU HDy% A 32 LEU H 1.0 1.8 6.5 489 448 A 32 LEU H A 30 VAL HGy% 1.0 1.8 5.0 490 448 A 32 LEU H A 30 VAL HGx% 1.0 1.8 5.0 491 449 A 31 CYS H A 32 LEU H 1.0 1.8 5.5 492 450 A 31 CYS HA A 32 LEU H 1.0 1.8 4.0 493 451 A 31 CYS HBx A 32 LEU H 1.0 1.8 5.5 494 452 A 31 CYS HBy A 32 LEU H 1.0 1.8 5.5 495 453 A 33 ASN H A 32 LEU H 1.0 1.8 5.5 496 454 A 32 LEU H A 33 ASN HBx 1.0 1.8 5.5 497 455 A 32 LEU H A 34 GLN H 1.0 1.8 5.5 498 456 A 34 GLN HA A 32 LEU H 1.0 1.8 5.5 499 457 A 35 LYS H A 32 LEU H 1.0 1.8 3.0 500 458 A 35 LYS HA A 32 LEU H 1.0 1.8 5.5 501 459 A 32 LEU H A 35 LYS HBy 1.0 1.8 5.5 502 460 A 32 LEU H A 35 LYS HBx 1.0 1.8 5.5 503 461 A 32 LEU H A 36 ALA HA 1.0 1.8 4.0 504 462 A 36 ALA HB% A 32 LEU H 1.0 1.8 6.5 505 463 A 32 LEU H A 37 GLU HA 1.0 1.8 4.0 506 464 A 32 LEU H A 37 GLU HBy 1.0 1.8 5.5 507 465 A 32 LEU H A 37 GLU HBx 1.0 1.8 5.5 508 466 A 32 LEU H A 37 GLU HGx 1.0 1.8 6.5 509 466 A 32 LEU H A 37 GLU HGy 1.0 1.8 6.5 510 467 A 32 LEU HBy A 33 ASN H 1.0 1.8 5.5 511 468 A 32 LEU HBy A 33 ASN HBx 1.0 1.8 5.5 512 469 A 35 LYS H A 32 LEU HBy 1.0 1.8 5.5 513 470 A 32 LEU HBy A 37 GLU H 1.0 1.8 5.5 514 471 A 32 LEU HBy A 37 GLU HBy 1.0 1.8 4.0 515 472 A 32 LEU HBy A 37 GLU HBx 1.0 1.8 3.0 516 473 A 33 ASN HBx A 32 LEU HBx 1.0 1.8 5.5 517 474 A 32 LEU HBx A 37 GLU HGx 1.0 1.8 4.0 518 474 A 37 GLU HGy A 32 LEU HBx 1.0 1.8 4.0 519 475 A 32 LEU HG A 33 ASN HBy 1.0 1.8 4.0 520 476 A 33 ASN HBx A 32 LEU HG 1.0 1.8 4.0 521 477 A 32 LEU HA A 33 ASN H 1.0 1.8 4.0 522 478 A 33 ASN H A 32 LEU HDx% 1.0 1.8 7.5 523 478 A 32 LEU HDy% A 33 ASN H 1.0 1.8 7.5 524 479 A 33 ASN H A 34 GLN H 1.0 1.8 6.5 525 480 A 33 ASN HA A 32 LEU HDx% 1.0 1.8 7.5 526 480 A 32 LEU HDy% A 33 ASN HA 1.0 1.8 7.5 527 481 A 34 GLN H A 33 ASN HA 1.0 1.8 4.0 528 482 A 33 ASN HA A 34 GLN HGy 1.0 1.8 5.5 529 483 A 33 ASN HA A 34 GLN HGx 1.0 1.8 5.5 530 484 A 33 ASN HBx A 32 LEU HG 1.0 1.8 5.5 531 485 A 33 ASN HBx A 34 GLN H 1.0 1.8 5.5 532 486 A 9 CYS H A 34 GLN H 1.0 1.8 5.5 533 487 A 32 LEU H A 34 GLN H 1.0 1.8 5.5 534 488 A 32 LEU HA A 34 GLN H 1.0 1.8 4.0 535 489 A 33 ASN H A 34 GLN H 1.0 1.8 4.0 536 490 A 34 GLN H A 33 ASN HA 1.0 1.8 3.0 537 491 A 35 LYS H A 34 GLN H 1.0 1.8 4.0 538 492 A 34 GLN HA A 32 LEU H 1.0 1.8 5.5 539 493 A 34 GLN HA A 33 ASN H 1.0 1.8 5.5 540 494 A 34 GLN HBy A 8 SER HBx 1.0 1.8 6.5 541 494 A 8 SER HBy A 34 GLN HBy 1.0 1.8 6.5 542 495 A 9 CYS H A 34 GLN HBy 1.0 1.8 4.0 543 496 A 34 GLN HBy A 35 LYS H 1.0 1.8 5.5 544 497 A 34 GLN HBy A 35 LYS HGx 1.0 1.8 6.5 545 497 A 34 GLN HBy A 35 LYS HGy 1.0 1.8 6.5 546 498 A 34 GLN HBx A 8 SER HBx 1.0 1.8 6.5 547 498 A 8 SER HBy A 34 GLN HBx 1.0 1.8 6.5 548 499 A 9 CYS H A 34 GLN HBx 1.0 1.8 5.5 549 500 A 34 GLN HBx A 35 LYS H 1.0 1.8 5.5 550 501 A 34 GLN HGy A 8 SER HBx 1.0 1.8 6.5 551 501 A 8 SER HBy A 34 GLN HGy 1.0 1.8 6.5 552 502 A 9 CYS H A 35 LYS H 1.0 1.8 5.5 553 503 A 35 LYS H A 9 CYS HBx 1.0 1.8 5.5 554 504 A 35 LYS H A 30 VAL HGy% 1.0 1.8 7.5 555 504 A 35 LYS H A 30 VAL HGx% 1.0 1.8 7.5 556 505 A 35 LYS H A 31 CYS HBx 1.0 1.8 5.5 557 506 A 35 LYS H A 31 CYS HA 1.0 1.8 4.0 558 507 A 35 LYS H A 32 LEU H 1.0 1.8 3.0 559 508 A 35 LYS H A 32 LEU HA 1.0 1.8 4.0 560 509 A 35 LYS H A 32 LEU HBy 1.0 1.8 4.0 561 510 A 35 LYS H A 32 LEU HDx% 1.0 1.8 7.5 562 510 A 35 LYS H A 32 LEU HDy% 1.0 1.8 7.5 563 511 A 35 LYS H A 33 ASN HA 1.0 1.8 5.0 564 512 A 35 LYS H A 33 ASN HBy 1.0 1.8 5.5 565 513 A 35 LYS H A 34 GLN H 1.0 1.8 3.0 566 514 A 34 GLN HA A 35 LYS H 1.0 1.8 3.0 567 515 A 34 GLN HBy A 35 LYS H 1.0 1.8 4.0 568 516 A 34 GLN HBx A 35 LYS H 1.0 1.8 4.0 569 517 A 35 LYS H A 34 GLN HGy 1.0 1.8 5.5 570 518 A 35 LYS H A 34 GLN HGx 1.0 1.8 5.5 571 519 A 36 ALA HB% A 35 LYS H 1.0 1.8 6.5 572 520 A 35 LYS H A 37 GLU HBx 1.0 1.8 5.5 573 521 A 9 CYS H A 35 LYS HA 1.0 1.8 5.5 574 522 A 7 ALA H A 35 LYS HBy 1.0 1.8 5.5 575 523 A 32 LEU H A 35 LYS HBy 1.0 1.8 6.5 576 524 A 32 LEU H A 35 LYS HBx 1.0 1.8 6.5 577 525 A 35 LYS HBx A 33 ASN HBy 1.0 1.8 5.5 578 526 A 34 GLN HA A 35 LYS HBx 1.0 1.8 5.5 579 527 A 9 CYS H A 35 LYS HGx 1.0 1.8 6.5 580 527 A 9 CYS H A 35 LYS HGy 1.0 1.8 6.5 581 528 A 32 LEU H A 35 LYS HDx 1.0 1.8 7.5 582 528 A 32 LEU H A 35 LYS HDy 1.0 1.8 7.5 583 529 A 7 ALA HB% A 36 ALA H 1.0 1.8 5.0 584 530 A 36 ALA H A 8 SER HBx 1.0 1.8 6.5 585 530 A 8 SER HBy A 36 ALA H 1.0 1.8 6.5 586 531 A 16 LEU HDy% A 36 ALA H 1.0 1.8 5.0 587 532 A 36 ALA H A 35 LYS H 1.0 1.8 5.5 588 533 A 36 ALA H A 35 LYS HA 1.0 1.8 3.0 589 534 A 36 ALA H A 35 LYS HBx 1.0 1.8 4.0 590 535 A 36 ALA H A 35 LYS HGx 1.0 1.8 5.0 591 535 A 36 ALA H A 35 LYS HGy 1.0 1.8 5.0 592 536 A 36 ALA H A 37 GLU H 1.0 1.8 5.5 593 537 A 16 LEU HDy% A 36 ALA HA 1.0 1.8 5.0 594 538 A 31 CYS HA A 36 ALA HA 1.0 1.8 5.5 595 539 A 36 ALA HA A 37 GLU H 1.0 1.8 4.0 596 540 A 7 ALA H A 36 ALA HB% 1.0 1.8 6.5 597 541 A 7 ALA HB% A 36 ALA HB% 1.0 1.8 5.0 598 542 A 36 ALA HB% A 9 CYS HBy 1.0 1.8 6.5 599 543 A 16 LEU HDy% A 36 ALA HB% 1.0 1.8 5.0 600 544 A 36 ALA HB% A 18 ILE HG1x 1.0 1.8 4.0 601 545 A 36 ALA HB% A 30 VAL H 1.0 1.8 6.5 602 546 A 36 ALA HB% A 31 CYS HA 1.0 1.8 6.5 603 547 A 36 ALA HB% A 35 LYS H 1.0 1.8 7.5 604 548 A 36 ALA HB% A 35 LYS HA 1.0 1.8 5.0 605 549 A 36 ALA HB% A 37 GLU HA 1.0 1.8 5.0 606 550 A 36 ALA HB% A 38 CYS H 1.0 1.8 6.5 607 551 A 16 LEU HDy% A 37 GLU H 1.0 1.8 5.0 608 552 A 29 CYS HA A 37 GLU H 1.0 1.8 5.5 609 553 A 29 CYS HBx A 37 GLU H 1.0 1.8 5.5 610 554 A 29 CYS HBy A 37 GLU H 1.0 1.8 5.5 611 555 A 30 VAL H A 37 GLU H 1.0 1.8 4.0 612 556 A 30 VAL HA A 37 GLU H 1.0 1.8 4.0 613 557 A 30 VAL HB A 37 GLU H 1.0 1.8 5.5 614 558 A 37 GLU H A 30 VAL HGy% 1.0 1.8 6.0 615 558 A 37 GLU H A 30 VAL HGx% 1.0 1.8 6.0 616 559 A 32 LEU HA A 37 GLU H 1.0 1.8 5.5 617 560 A 32 LEU HBy A 37 GLU H 1.0 1.8 5.5 618 561 A 37 GLU H A 32 LEU HBx 1.0 1.8 5.5 619 562 A 37 GLU H A 32 LEU HG 1.0 1.8 5.5 620 563 A 37 GLU H A 32 LEU HDx% 1.0 1.8 7.5 621 563 A 32 LEU HDy% A 37 GLU H 1.0 1.8 7.5 622 564 A 36 ALA H A 37 GLU H 1.0 1.8 5.5 623 565 A 36 ALA HA A 37 GLU H 1.0 1.8 3.0 624 566 A 36 ALA HB% A 37 GLU H 1.0 1.8 5.0 625 567 A 37 GLU H A 38 CYS HA 1.0 1.8 5.5 626 568 A 32 LEU H A 37 GLU HBy 1.0 1.8 5.5 627 569 A 36 ALA HA A 37 GLU HBy 1.0 1.8 5.5 628 570 A 32 LEU H A 37 GLU HBx 1.0 1.8 5.5 629 571 A 32 LEU HA A 37 GLU HBx 1.0 1.8 4.0 630 572 A 32 LEU HBy A 37 GLU HBx 1.0 1.8 4.0 631 573 A 30 VAL H A 37 GLU HGx 1.0 1.8 6.5 632 573 A 30 VAL H A 37 GLU HGy 1.0 1.8 6.5 633 574 A 32 LEU H A 37 GLU HGx 1.0 1.8 6.5 634 574 A 32 LEU H A 37 GLU HGy 1.0 1.8 6.5 635 575 A 32 LEU HBy A 37 GLU HGx 1.0 1.8 5.0 636 575 A 32 LEU HBy A 37 GLU HGy 1.0 1.8 5.0 637 576 A 32 LEU HBx A 37 GLU HGx 1.0 1.8 5.0 638 576 A 37 GLU HGy A 32 LEU HBx 1.0 1.8 5.0 639 577 A 32 LEU HG A 37 GLU HGx 1.0 1.8 5.0 640 577 A 37 GLU HGy A 32 LEU HG 1.0 1.8 5.0 641 578 A 32 LEU HDy% A 37 GLU HGx 1.0 1.8 6.0 642 578 A 32 LEU HDx% A 37 GLU HGx 1.0 1.8 6.0 643 578 A 37 GLU HGy A 32 LEU HDx% 1.0 1.8 6.0 644 578 A 32 LEU HDy% A 37 GLU HGy 1.0 1.8 6.0 645 579 A 38 CYS H A 37 GLU HGx 1.0 1.8 5.0 646 579 A 38 CYS H A 37 GLU HGy 1.0 1.8 5.0 647 580 A 16 LEU HDy% A 38 CYS H 1.0 1.8 6.5 648 581 A 27 ILE HG2% A 38 CYS H 1.0 1.8 6.5 649 582 A 29 CYS HBx A 38 CYS H 1.0 1.8 5.5 650 583 A 29 CYS HBy A 38 CYS H 1.0 1.8 5.5 651 584 A 30 VAL HGx% A 38 CYS H 1.0 1.8 6.5 652 585 A 38 CYS H A 32 LEU HDx% 1.0 1.8 7.5 653 585 A 32 LEU HDy% A 38 CYS H 1.0 1.8 7.5 654 586 A 36 ALA HA A 38 CYS H 1.0 1.8 5.5 655 587 A 36 ALA HB% A 38 CYS H 1.0 1.8 6.5 656 588 A 38 CYS H A 37 GLU HA 1.0 1.8 3.0 657 589 A 38 CYS H A 37 GLU HBy 1.0 1.8 4.5 658 590 A 38 CYS H A 37 GLU HBx 1.0 1.8 4.5 659 591 A 38 CYS H A 37 GLU HGx 1.0 1.8 5.0 660 591 A 38 CYS H A 37 GLU HGy 1.0 1.8 5.0 661 592 A 27 ILE HG2% A 38 CYS HA 1.0 1.8 6.5 662 593 A 28 SER H A 38 CYS HA 1.0 1.8 5.5 663 594 A 29 CYS H A 38 CYS HA 1.0 1.8 6.5 664 595 A 29 CYS HA A 38 CYS HA 1.0 1.8 3.0 665 596 A 29 CYS HBx A 38 CYS HA 1.0 1.8 6.5 666 597 A 29 CYS HBy A 38 CYS HA 1.0 1.8 5.5 667 598 A 30 VAL H A 38 CYS HA 1.0 1.8 5.0 668 599 A 38 CYS HA A 30 VAL HGy% 1.0 1.8 7.5 669 599 A 38 CYS HA A 30 VAL HGx% 1.0 1.8 7.5 670 600 A 36 ALA HB% A 38 CYS HA 1.0 1.8 6.5 671 601 A 38 CYS HA A 37 GLU HGx 1.0 1.8 6.5 672 601 A 38 CYS HA A 37 GLU HGy 1.0 1.8 6.5 673 602 A 38 CYS HA A 39 LYS H 1.0 1.8 3.0 674 603 A 38 CYS HA A 39 LYS HBx 1.0 1.8 5.5 675 604 A 38 CYS HA A 39 LYS HGy 1.0 1.8 5.5 676 605 A 38 CYS HA A 39 LYS HGx 1.0 1.8 5.5 677 606 A 38 CYS HA A 39 LYS HDx 1.0 1.8 5.5 678 606 A 38 CYS HA A 39 LYS HDy 1.0 1.8 5.5 679 607 A 38 CYS HBx A 39 LYS HA 1.0 1.8 5.5 680 608 A 21 ILE HG2% A 38 CYS HBy 1.0 1.8 5.0 681 609 A 27 ILE HG2% A 38 CYS HBy 1.0 1.8 5.0 682 610 A 29 CYS HA A 38 CYS HBy 1.0 1.8 4.0 683 611 A 38 CYS HBy A 39 LYS H 1.0 1.8 4.0 684 612 A 27 ILE HG2% A 39 LYS H 1.0 1.8 5.0 685 613 A 28 SER H A 39 LYS H 1.0 1.8 4.0 686 614 A 39 LYS H A 28 SER HBy 1.0 1.8 5.5 687 615 A 29 CYS HA A 39 LYS H 1.0 1.8 4.0 688 616 A 39 LYS H A 38 CYS H 1.0 1.8 5.5 689 617 A 38 CYS HA A 39 LYS H 1.0 1.8 3.0 690 618 A 38 CYS HBx A 39 LYS H 1.0 1.8 4.0 691 619 A 38 CYS HBy A 39 LYS H 1.0 1.8 4.0 692 620 A 39 LYS HBy A 40 GLN H 1.0 1.8 5.5 693 621 A 39 LYS HBx A 40 GLN H 1.0 1.8 5.5 694 622 A 27 ILE HD1% A 40 GLN H 1.0 1.8 6.5 695 623 A 27 ILE HG2% A 40 GLN H 1.0 1.8 6.5 696 624 A 39 LYS H A 40 GLN H 1.0 1.8 5.5 697 625 A 39 LYS HA A 40 GLN H 1.0 1.8 4.0 698 626 A 39 LYS HBy A 40 GLN H 1.0 1.8 4.0 699 627 A 39 LYS HBx A 40 GLN H 1.0 1.8 4.0 700 628 A 40 GLN H A 39 LYS HDx 1.0 1.8 6.5 701 628 A 39 LYS HDy A 40 GLN H 1.0 1.8 6.5 702 629 A 39 LYS HGy A 40 GLN H 1.0 1.8 5.5 703 630 A 39 LYS HGx A 40 GLN H 1.0 1.8 5.5 704 631 A 40 GLN H A 41 GLU HA 1.0 1.8 5.5 705 632 A 41 GLU H A 40 GLN H 1.0 1.8 5.5 706 633 A 40 GLN HA A 27 ILE HA 1.0 1.8 5.5 707 634 A 27 ILE HG2% A 40 GLN HA 1.0 1.8 6.5 708 635 A 41 GLU H A 40 GLN HA 1.0 1.8 4.0 709 636 A 27 ILE HG2% A 40 GLN HBy 1.0 1.8 6.5 710 637 A 27 ILE HD1% A 40 GLN HBy 1.0 1.8 6.5 711 638 A 27 ILE HD1% A 40 GLN HBx 1.0 1.8 5.0 712 639 A 41 GLU H A 40 GLN HBx 1.0 1.8 4.0 713 640 A 27 ILE HD1% A 40 GLN HGy 1.0 1.8 6.5 714 641 A 40 GLN HGx A 26 CYS HBx 1.0 1.8 5.5 715 642 A 27 ILE HG2% A 40 GLN HGx 1.0 1.8 6.5 716 643 A 27 ILE HD1% A 40 GLN HGx 1.0 1.8 5.0 717 644 A 40 GLN HGx A 41 GLU HA 1.0 1.8 4.0 718 645 A 41 GLU H A 26 CYS HA 1.0 1.8 4.0 719 646 A 41 GLU H A 26 CYS HBx 1.0 1.8 4.0 720 647 A 26 CYS HBy A 41 GLU H 1.0 1.8 5.5 721 648 A 41 GLU H A 27 ILE HA 1.0 1.8 4.0 722 649 A 27 ILE HG1x A 41 GLU H 1.0 1.8 5.5 723 650 A 41 GLU H A 40 GLN H 1.0 1.8 5.5 724 651 A 41 GLU H A 40 GLN HA 1.0 1.8 3.0 725 652 A 41 GLU H A 40 GLN HBy 1.0 1.8 5.5 726 653 A 41 GLU H A 40 GLN HBx 1.0 1.8 5.5 727 654 A 41 GLU H A 42 LYS H 1.0 1.8 5.5 728 655 A 40 GLN HA A 41 GLU HA 1.0 1.8 5.5 729 656 A 40 GLN HGx A 41 GLU HA 1.0 1.8 5.5 730 657 A 41 GLU HA A 42 LYS H 1.0 1.8 3.0 731 658 A 41 GLU HA A 42 LYS HBy 1.0 1.8 5.5 732 659 A 41 GLU HA A 42 LYS HBx 1.0 1.8 5.5 733 660 A 26 CYS HA A 41 GLU HBy 1.0 1.8 4.0 734 661 A 26 CYS HBx A 41 GLU HBy 1.0 1.8 4.0 735 662 A 42 LYS H A 41 GLU HBy 1.0 1.8 4.5 736 663 A 26 CYS HBx A 41 GLU HBx 1.0 1.8 4.0 737 664 A 40 GLN HA A 41 GLU HBx 1.0 1.8 5.5 738 665 A 41 GLU HBx A 61 CYS H 1.0 1.8 5.5 739 666 A 26 CYS HBx A 41 GLU HGy 1.0 1.8 4.0 740 667 A 42 LYS H A 41 GLU HGy 1.0 1.8 4.0 741 668 A 42 LYS H A 41 GLU HGx 1.0 1.8 5.5 742 669 A 26 CYS HBx A 42 LYS H 1.0 1.8 5.5 743 670 A 41 GLU H A 42 LYS H 1.0 1.8 5.5 744 671 A 41 GLU HA A 42 LYS H 1.0 1.8 3.0 745 672 A 42 LYS H A 41 GLU HBy 1.0 1.8 4.0 746 673 A 42 LYS H A 41 GLU HBx 1.0 1.8 4.0 747 674 A 42 LYS H A 41 GLU HGy 1.0 1.8 4.0 748 675 A 42 LYS H A 41 GLU HGx 1.0 1.8 4.0 749 676 A 41 GLU H A 42 LYS H 1.0 1.8 4.0 750 677 A 42 LYS H A 43 CYS HA 1.0 1.8 5.5 751 678 A 42 LYS H A 43 CYS HA 1.0 1.8 5.5 752 679 A 42 LYS HA A 43 CYS H 1.0 1.8 5.5 753 680 A 41 GLU HA A 42 LYS HBy 1.0 1.8 5.5 754 681 A 42 LYS HBy A 43 CYS H 1.0 1.8 4.0 755 682 A 41 GLU HA A 42 LYS HBx 1.0 1.8 5.5 756 683 A 44 ALA H A 42 LYS HGx 1.0 1.8 6.5 757 683 A 42 LYS HGy A 44 ALA H 1.0 1.8 6.5 758 684 A 41 GLU HGy A 43 CYS H 1.0 1.8 5.5 759 685 A 41 GLU HGx A 43 CYS H 1.0 1.8 5.5 760 686 A 42 LYS H A 43 CYS H 1.0 1.8 5.5 761 687 A 42 LYS HA A 43 CYS H 1.0 1.8 3.0 762 688 A 42 LYS HBy A 43 CYS H 1.0 1.8 4.0 763 689 A 42 LYS HBx A 43 CYS H 1.0 1.8 4.0 764 690 A 43 CYS H A 42 LYS HGx 1.0 1.8 5.0 765 690 A 43 CYS H A 42 LYS HGy 1.0 1.8 5.0 766 691 A 42 LYS HA A 43 CYS HBx 1.0 1.8 5.5 767 692 A 44 ALA H A 43 CYS HBx 1.0 1.8 4.0 768 693 A 43 CYS HBx A 44 ALA HA 1.0 1.8 5.5 769 694 A 43 CYS HBx A 44 ALA HB% 1.0 1.8 6.5 770 695 A 43 CYS HBx A 62 GLU H 1.0 1.8 5.5 771 696 A 44 ALA H A 43 CYS HBy 1.0 1.8 5.5 772 697 A 43 CYS HA A 44 ALA H 1.0 1.8 3.0 773 698 A 44 ALA H A 43 CYS HBx 1.0 1.8 4.0 774 699 A 44 ALA H A 43 CYS HBy 1.0 1.8 4.0 775 700 A 44 ALA H A 45 PRO HDy 1.0 1.8 5.5 776 701 A 44 ALA H A 45 PRO HDx 1.0 1.8 5.5 777 702 A 44 ALA HA A 45 PRO HDy 1.0 1.8 6.5 778 703 A 44 ALA HB% A 45 PRO HA 1.0 1.8 6.5 779 704 A 45 PRO HA A 46 LEU H 1.0 1.8 4.0 780 705 A 45 PRO HA A 46 LEU HBx 1.0 1.8 5.5 781 706 A 45 PRO HA A 46 LEU HG 1.0 1.8 5.5 782 707 A 45 PRO HA A 46 LEU HDx% 1.0 1.8 7.5 783 707 A 45 PRO HA A 46 LEU HDy% 1.0 1.8 7.5 784 708 A 46 LEU H A 45 PRO HBy 1.0 1.8 4.0 785 709 A 44 ALA HA A 45 PRO HDy 1.0 1.8 3.0 786 710 A 44 ALA HB% A 45 PRO HDy 1.0 1.8 5.0 787 711 A 44 ALA HA A 45 PRO HDx 1.0 1.8 3.0 788 712 A 44 ALA HB% A 45 PRO HDx 1.0 1.8 5.0 789 713 A 45 PRO HA A 46 LEU H 1.0 1.8 3.0 790 714 A 46 LEU H A 45 PRO HBx 1.0 1.8 4.0 791 715 A 46 LEU H A 45 PRO HBy 1.0 1.8 4.0 792 716 A 46 LEU H A 45 PRO HGx 1.0 1.8 5.5 793 717 A 46 LEU H A 45 PRO HDy 1.0 1.8 6.5 794 717 A 46 LEU H A 45 PRO HDx 1.0 1.8 6.5 795 718 A 46 LEU H A 47 ALA HA 1.0 1.8 5.5 796 719 A 46 LEU HA A 47 ALA H 1.0 1.8 4.0 797 720 A 46 LEU HA A 48 GLU HBx 1.0 1.8 6.5 798 721 A 46 LEU HA A 63 LYS HGx 1.0 1.8 6.5 799 721 A 46 LEU HA A 63 LYS HGy 1.0 1.8 6.5 800 722 A 46 LEU HBy A 50 CYS HBx 1.0 1.8 5.5 801 723 A 46 LEU HBx A 47 ALA H 1.0 1.8 4.0 802 724 A 46 LEU HBx A 50 CYS HBx 1.0 1.8 4.0 803 725 A 46 LEU HBx A 50 CYS HBy 1.0 1.8 4.0 804 726 A 46 LEU HBx A 64 CYS HBy 1.0 1.8 4.0 805 727 A 45 PRO HA A 46 LEU HG 1.0 1.8 4.0 806 728 A 46 LEU HG A 50 CYS HBy 1.0 1.8 4.0 807 729 A 46 LEU HA A 47 ALA H 1.0 1.8 3.0 808 730 A 47 ALA H A 46 LEU HBy 1.0 1.8 4.0 809 731 A 46 LEU HBx A 47 ALA H 1.0 1.8 4.0 810 732 A 46 LEU HG A 47 ALA H 1.0 1.8 4.0 811 733 A 47 ALA H A 46 LEU HDx% 1.0 1.8 7.5 812 733 A 46 LEU HDy% A 47 ALA H 1.0 1.8 7.5 813 734 A 47 ALA H A 50 CYS HBx 1.0 1.8 4.0 814 735 A 47 ALA H A 50 CYS HBy 1.0 1.8 5.5 815 736 A 47 ALA H A 64 CYS HBy 1.0 1.8 5.5 816 737 A 47 ALA HA A 48 GLU H 1.0 1.8 4.0 817 738 A 48 GLU H A 47 ALA HB% 1.0 1.8 5.0 818 739 A 47 ALA HB% A 49 ASP H 1.0 1.8 4.0 819 740 A 50 CYS HBy A 47 ALA HB% 1.0 1.8 4.0 820 741 A 47 ALA H A 48 GLU H 1.0 1.8 5.5 821 742 A 47 ALA HA A 48 GLU H 1.0 1.8 3.0 822 743 A 48 GLU H A 47 ALA HB% 1.0 1.8 5.0 823 744 A 47 ALA HB% A 48 GLU HA 1.0 1.8 6.5 824 745 A 49 ASP H A 48 GLU HA 1.0 1.8 4.0 825 746 A 49 ASP H A 48 GLU HBy 1.0 1.8 4.0 826 747 A 48 GLU HBx A 49 ASP H 1.0 1.8 4.0 827 748 A 47 ALA HA A 49 ASP H 1.0 1.8 4.0 828 749 A 47 ALA HB% A 49 ASP H 1.0 1.8 4.0 829 750 A 48 GLU H A 49 ASP H 1.0 1.8 4.0 830 751 A 49 ASP H A 48 GLU HA 1.0 1.8 3.0 831 752 A 49 ASP H A 48 GLU HGx 1.0 1.8 5.0 832 752 A 49 ASP H A 48 GLU HGy 1.0 1.8 5.0 833 753 A 49 ASP H A 48 GLU HBy 1.0 1.8 4.0 834 754 A 48 GLU HBx A 49 ASP H 1.0 1.8 4.0 835 755 A 49 ASP H A 50 CYS HA 1.0 1.8 4.0 836 756 A 50 CYS HBx A 49 ASP H 1.0 1.8 5.5 837 757 A 50 CYS HBy A 49 ASP H 1.0 1.8 5.5 838 758 A 50 CYS H A 46 LEU HDx% 1.0 1.8 7.5 839 758 A 46 LEU HDy% A 50 CYS H 1.0 1.8 7.5 840 759 A 47 ALA HB% A 50 CYS H 1.0 1.8 5.0 841 760 A 48 GLU HA A 50 CYS H 1.0 1.8 5.5 842 761 A 49 ASP H A 50 CYS H 1.0 1.8 4.0 843 762 A 50 CYS H A 49 ASP HA 1.0 1.8 4.0 844 763 A 50 CYS H A 49 ASP HBy 1.0 1.8 5.5 845 764 A 50 CYS H A 49 ASP HBx 1.0 1.8 5.5 846 765 A 50 CYS H A 51 ALA H 1.0 1.8 5.5 847 766 A 50 CYS H A 64 CYS HBx 1.0 1.8 5.5 848 767 A 50 CYS HA A 51 ALA H 1.0 1.8 4.0 849 768 A 50 CYS HBx A 46 LEU HDx% 1.0 1.8 6.0 850 768 A 46 LEU HDy% A 50 CYS HBx 1.0 1.8 6.0 851 769 A 47 ALA H A 50 CYS HBx 1.0 1.8 5.5 852 770 A 50 CYS HBx A 47 ALA HB% 1.0 1.8 5.0 853 771 A 50 CYS HBx A 51 ALA H 1.0 1.8 5.5 854 772 A 50 CYS HBx A 52 LEU H 1.0 1.8 5.5 855 773 A 50 CYS HBy A 53 VAL HGx% 1.0 1.8 5.0 856 774 A 50 CYS HBy A 47 ALA HB% 1.0 1.8 4.0 857 775 A 50 CYS HA A 51 ALA H 1.0 1.8 3.0 858 776 A 50 CYS HBx A 51 ALA H 1.0 1.8 5.5 859 777 A 50 CYS HBy A 51 ALA H 1.0 1.8 5.5 860 778 A 51 ALA H A 52 LEU HA 1.0 1.8 5.5 861 779 A 51 ALA H A 66 GLY HAy 1.0 1.8 5.5 862 780 A 64 CYS HBy A 51 ALA H 1.0 1.8 5.5 863 781 A 50 CYS HA A 52 LEU H 1.0 1.8 4.0 864 782 A 50 CYS HBx A 52 LEU H 1.0 1.8 5.5 865 783 A 50 CYS HBy A 52 LEU H 1.0 1.8 5.5 866 784 A 51 ALA H A 52 LEU H 1.0 1.8 3.0 867 785 A 52 LEU H A 51 ALA HA 1.0 1.8 3.0 868 786 A 52 LEU H A 53 VAL HA 1.0 1.8 5.5 869 787 A 52 LEU H A 53 VAL HB 1.0 1.8 5.5 870 788 A 52 LEU H A 53 VAL HGx% 1.0 1.8 5.0 871 789 A 52 LEU H A 64 CYS HA 1.0 1.8 4.0 872 790 A 52 LEU H A 66 GLY HAy 1.0 1.8 5.5 873 791 A 52 LEU H A 66 GLY HAx 1.0 1.8 5.5 874 792 A 52 LEU HA A 66 GLY HAx 1.0 1.8 6.5 875 793 A 52 LEU HBy A 53 VAL H 1.0 1.8 5.5 876 794 A 52 LEU HBy A 62 GLU HGy 1.0 1.8 4.0 877 795 A 52 LEU HBy A 62 GLU HGx 1.0 1.8 4.0 878 796 A 52 LEU HBx A 65 LYS H 1.0 1.8 5.5 879 797 A 52 LEU HBx A 66 GLY H 1.0 1.8 5.5 880 798 A 52 LEU H A 53 VAL H 1.0 1.8 5.5 881 799 A 52 LEU HA A 53 VAL H 1.0 1.8 3.0 882 800 A 52 LEU HBy A 53 VAL H 1.0 1.8 5.5 883 801 A 64 CYS HA A 53 VAL H 1.0 1.8 5.5 884 802 A 52 LEU HA A 53 VAL HB 1.0 1.8 5.5 885 803 A 53 VAL HGx% A 63 LYS HGx 1.0 1.8 5.0 886 803 A 63 LYS HGy A 53 VAL HGx% 1.0 1.8 5.0 887 804 A 53 VAL H A 54 VAL H 1.0 1.8 5.5 888 805 A 53 VAL HA A 54 VAL H 1.0 1.8 3.0 889 806 A 54 VAL H A 55 LYS HEx 1.0 1.8 6.5 890 806 A 54 VAL H A 55 LYS HEy 1.0 1.8 6.5 891 807 A 54 VAL H A 63 LYS H 1.0 1.8 4.0 892 808 A 54 VAL H A 63 LYS HBy 1.0 1.8 5.5 893 809 A 54 VAL H A 65 LYS HBx 1.0 1.8 5.5 894 810 A 54 VAL HB A 55 LYS H 1.0 1.8 5.5 895 811 A 54 VAL H A 55 LYS H 1.0 1.8 5.5 896 812 A 55 LYS H A 54 VAL HA 1.0 1.8 4.0 897 813 A 54 VAL HB A 55 LYS H 1.0 1.8 4.0 898 814 A 55 LYS H A 54 VAL HGx% 1.0 1.8 6.0 899 814 A 55 LYS H A 54 VAL HGy% 1.0 1.8 6.0 900 815 A 62 GLU HGy A 55 LYS H 1.0 1.8 5.5 901 816 A 62 GLU HGx A 55 LYS H 1.0 1.8 5.5 902 817 A 55 LYS HA A 56 GLN H 1.0 1.8 5.5 903 818 A 56 GLN H A 55 LYS HBy 1.0 1.8 5.5 904 819 A 55 LYS HBx A 62 GLU HA 1.0 1.8 4.0 905 820 A 56 GLN H A 54 VAL HGx% 1.0 1.8 7.5 906 820 A 54 VAL HGy% A 56 GLN H 1.0 1.8 7.5 907 821 A 55 LYS HA A 56 GLN H 1.0 1.8 3.0 908 822 A 56 GLN H A 55 LYS HBy 1.0 1.8 5.5 909 823 A 56 GLN H A 55 LYS HBx 1.0 1.8 5.5 910 824 A 56 GLN H A 55 LYS HGx 1.0 1.8 5.0 911 824 A 56 GLN H A 55 LYS HGy 1.0 1.8 5.0 912 825 A 56 GLN H A 55 LYS HDx 1.0 1.8 5.0 913 825 A 56 GLN H A 55 LYS HDy 1.0 1.8 5.0 914 826 A 56 GLN H A 59 ALA HB% 1.0 1.8 6.5 915 827 A 59 ALA HB% A 56 GLN HGx 1.0 1.8 6.0 916 827 A 59 ALA HB% A 56 GLN HGy 1.0 1.8 6.0 917 828 A 57 THR H A 56 GLN HA 1.0 1.8 3.0 918 829 A 57 THR H A 56 GLN HBx 1.0 1.8 6.5 919 829 A 57 THR H A 56 GLN HBy 1.0 1.8 6.5 920 830 A 57 THR H A 56 GLN HGx 1.0 1.8 6.5 921 830 A 56 GLN HGy A 57 THR H 1.0 1.8 6.5 922 831 A 57 THR HA A 59 ALA H 1.0 1.8 5.5 923 832 A 57 THR HA A 58 GLY H 1.0 1.8 4.0 924 833 A 58 GLY H A 57 THR HG2% 1.0 1.8 6.5 925 833 A 58 GLY H A 57 THR HG1 1.0 1.8 6.5 926 834 A 58 GLY HAy A 57 THR HG2% 1.0 1.8 6.5 927 834 A 57 THR HG1 A 58 GLY HAy 1.0 1.8 6.5 928 835 A 56 GLN HA A 59 ALA H 1.0 1.8 5.5 929 836 A 59 ALA H A 56 GLN HBx 1.0 1.8 5.0 930 836 A 56 GLN HBy A 59 ALA H 1.0 1.8 5.0 931 837 A 59 ALA H A 56 GLN HGx 1.0 1.8 6.5 932 837 A 56 GLN HGy A 59 ALA H 1.0 1.8 6.5 933 838 A 57 THR HA A 59 ALA H 1.0 1.8 5.5 934 839 A 59 ALA H A 57 THR HG2% 1.0 1.8 7.5 935 839 A 59 ALA H A 57 THR HG1 1.0 1.8 7.5 936 840 A 59 ALA H A 58 GLY H 1.0 1.8 5.5 937 841 A 59 ALA H A 58 GLY HAy 1.0 1.8 4.0 938 842 A 59 ALA H A 58 GLY HAx 1.0 1.8 4.0 939 843 A 59 ALA HB% A 56 GLN HGx 1.0 1.8 4.0 940 843 A 59 ALA HB% A 56 GLN HGy 1.0 1.8 4.0 941 844 A 59 ALA HB% A 60 CYS H 1.0 1.8 5.0 942 845 A 25 PRO HBx A 60 CYS H 1.0 1.8 5.5 943 846 A 25 PRO HBy A 60 CYS H 1.0 1.8 5.5 944 847 A 59 ALA H A 60 CYS H 1.0 1.8 5.5 945 848 A 60 CYS H A 59 ALA HA 1.0 1.8 4.0 946 849 A 59 ALA HB% A 60 CYS H 1.0 1.8 5.0 947 850 A 60 CYS H A 61 CYS HBx 1.0 1.8 5.5 948 851 A 60 CYS H A 61 CYS HBy 1.0 1.8 5.5 949 852 A 60 CYS HA A 25 PRO HBx 1.0 1.8 5.5 950 853 A 25 PRO HBy A 60 CYS HA 1.0 1.8 5.5 951 854 A 60 CYS HA A 25 PRO HGy 1.0 1.8 5.5 952 855 A 60 CYS HA A 25 PRO HGx 1.0 1.8 5.5 953 856 A 60 CYS HA A 61 CYS H 1.0 1.8 3.0 954 857 A 26 CYS H A 60 CYS HBx 1.0 1.8 5.5 955 858 A 60 CYS HBx A 26 CYS HA 1.0 1.8 4.0 956 859 A 60 CYS HBx A 61 CYS H 1.0 1.8 4.0 957 860 A 25 PRO HBy A 60 CYS HBy 1.0 1.8 4.0 958 861 A 60 CYS HBy A 26 CYS H 1.0 1.8 5.5 959 862 A 60 CYS HBy A 26 CYS HA 1.0 1.8 3.0 960 863 A 61 CYS H A 59 ALA HB% 1.0 1.8 5.0 961 864 A 61 CYS H A 60 CYS H 1.0 1.8 4.0 962 865 A 60 CYS HA A 61 CYS H 1.0 1.8 4.0 963 866 A 60 CYS HBx A 61 CYS H 1.0 1.8 3.0 964 867 A 60 CYS HBy A 61 CYS H 1.0 1.8 4.0 965 868 A 62 GLU H A 61 CYS HBx 1.0 1.8 4.0 966 869 A 61 CYS HBx A 62 GLU HBx 1.0 1.8 6.5 967 869 A 61 CYS HBx A 62 GLU HBy 1.0 1.8 6.5 968 870 A 62 GLU H A 61 CYS HBy 1.0 1.8 4.5 969 871 A 61 CYS H A 62 GLU H 1.0 1.8 5.5 970 872 A 62 GLU H A 61 CYS HA 1.0 1.8 3.0 971 873 A 62 GLU H A 61 CYS HBx 1.0 1.8 4.0 972 874 A 62 GLU H A 61 CYS HBy 1.0 1.8 4.0 973 875 A 55 LYS HBx A 62 GLU HA 1.0 1.8 5.5 974 876 A 63 LYS H A 62 GLU HA 1.0 1.8 4.0 975 877 A 61 CYS HA A 62 GLU HBx 1.0 1.8 4.0 976 877 A 62 GLU HBy A 61 CYS HA 1.0 1.8 4.0 977 878 A 62 GLU HGy A 55 LYS HBx 1.0 1.8 4.0 978 879 A 62 GLU HGx A 55 LYS HBx 1.0 1.8 4.0 979 880 A 62 GLU HGx A 63 LYS H 1.0 1.8 5.5 980 881 A 63 LYS H A 54 VAL HGx% 1.0 1.8 6.0 981 881 A 63 LYS H A 54 VAL HGy% 1.0 1.8 6.0 982 882 A 62 GLU H A 63 LYS H 1.0 1.8 4.0 983 883 A 63 LYS H A 62 GLU HA 1.0 1.8 3.0 984 884 A 63 LYS H A 62 GLU HBx 1.0 1.8 4.0 985 884 A 63 LYS H A 62 GLU HBy 1.0 1.8 4.0 986 885 A 62 GLU HGx A 63 LYS H 1.0 1.8 4.0 987 886 A 64 CYS HA A 63 LYS H 1.0 1.8 5.5 988 887 A 63 LYS HBy A 64 CYS H 1.0 1.8 4.0 989 888 A 64 CYS HBx A 63 LYS HBy 1.0 1.8 5.5 990 889 A 64 CYS H A 63 LYS HBx 1.0 1.8 4.0 991 890 A 64 CYS H A 54 VAL HGx% 1.0 1.8 6.0 992 890 A 54 VAL HGy% A 64 CYS H 1.0 1.8 6.0 993 891 A 63 LYS H A 64 CYS H 1.0 1.8 5.5 994 892 A 64 CYS H A 63 LYS HA 1.0 1.8 3.0 995 893 A 63 LYS HBy A 64 CYS H 1.0 1.8 3.0 996 894 A 64 CYS H A 63 LYS HBx 1.0 1.8 4.0 997 895 A 64 CYS H A 63 LYS HGx 1.0 1.8 6.5 998 895 A 63 LYS HGy A 64 CYS H 1.0 1.8 6.5 999 896 A 64 CYS HBx A 46 LEU HDx% 1.0 1.8 5.0 1000 896 A 46 LEU HDy% A 64 CYS HBx 1.0 1.8 5.0 1001 897 A 47 ALA H A 64 CYS HBx 1.0 1.8 5.5 1002 898 A 47 ALA HB% A 64 CYS HBx 1.0 1.8 6.5 1003 899 A 64 CYS HBx A 65 LYS H 1.0 1.8 4.0 1004 900 A 64 CYS HBx A 66 GLY H 1.0 1.8 5.5 1005 901 A 64 CYS HBy A 46 LEU HDx% 1.0 1.8 5.0 1006 901 A 46 LEU HDy% A 64 CYS HBy 1.0 1.8 5.0 1007 902 A 53 VAL HA A 65 LYS H 1.0 1.8 5.5 1008 903 A 65 LYS H A 64 CYS H 1.0 1.8 5.5 1009 904 A 64 CYS HA A 65 LYS H 1.0 1.8 3.0 1010 905 A 64 CYS HBx A 65 LYS H 1.0 1.8 4.0 1011 906 A 64 CYS HBy A 65 LYS H 1.0 1.8 4.0 1012 907 A 65 LYS HA A 52 LEU HDy% 1.0 1.8 5.5 1013 908 A 66 GLY H A 65 LYS HA 1.0 1.8 4.0 1014 909 A 66 GLY H A 65 LYS HBy 1.0 1.8 4.0 1015 910 A 64 CYS HA A 65 LYS HBx 1.0 1.8 5.5 1016 911 A 66 GLY H A 65 LYS HBx 1.0 1.8 5.0 1017 912 A 52 LEU HBx A 66 GLY H 1.0 1.8 5.5 1018 913 A 66 GLY H A 53 VAL HGy% 1.0 1.8 6.5 1019 914 A 64 CYS HA A 66 GLY H 1.0 1.8 5.5 1020 915 A 64 CYS HBx A 66 GLY H 1.0 1.8 5.5 1021 916 A 64 CYS HBy A 66 GLY H 1.0 1.8 5.5 1022 917 A 65 LYS H A 66 GLY H 1.0 1.8 4.0 1023 918 A 66 GLY H A 65 LYS HA 1.0 1.8 3.0 1024 919 A 66 GLY H A 65 LYS HBy 1.0 1.8 4.0 1025 920 A 66 GLY H A 65 LYS HBx 1.0 1.8 4.0 1026 921 A 66 GLY H A 65 LYS HGx 1.0 1.8 5.0 1027 921 A 66 GLY H A 65 LYS HGy 1.0 1.8 5.0 1028 922 A 66 GLY H A 65 LYS HDx 1.0 1.8 6.5 1029 922 A 66 GLY H A 65 LYS HDy 1.0 1.8 6.5 stop_ save_