data_nef_c15944_2k8f 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 1 ALA start . . 2 A 2 THR middle . . 3 A 3 GLN middle . . 4 A 4 SER middle . . 5 A 5 PRO middle . false 6 A 6 GLY middle . false 7 A 7 ASP middle . . 8 A 8 SER middle . . 9 A 9 ARG middle . . 10 A 10 ARG middle . . 11 A 11 LEU middle . . 12 A 12 SER middle . . 13 A 13 ILE middle . . 14 A 14 GLN middle . . 15 A 15 ARG middle . . 16 A 16 ALA middle . . 17 A 17 ILE middle . . 18 A 18 GLN middle . . 19 A 19 SER middle . . 20 A 20 LEU middle . . 21 A 21 VAL middle . . 22 A 22 HIS middle . . 23 A 23 ALA middle . . 24 A 24 ALA middle . . 25 A 25 GLN middle . . 26 A 26 CYS middle . . 27 A 27 ARG middle . . 28 A 28 ASN middle . . 29 A 29 ALA middle . . 30 A 30 ASN middle . . 31 A 31 CYS middle . . 32 A 32 SER middle . . 33 A 33 LEU middle . . 34 A 34 PRO middle . false 35 A 35 SER middle . . 36 A 36 CYS middle . . 37 A 37 GLN middle . . 38 A 38 LYS middle . . 39 A 39 MET middle . . 40 A 40 LYS middle . . 41 A 41 ARG middle . . 42 A 42 VAL middle . . 43 A 43 VAL middle . . 44 A 44 GLN middle . . 45 A 45 HIS middle . . 46 A 46 THR middle . . 47 A 47 LYS middle . . 48 A 48 GLY middle . false 49 A 49 CYS middle . . 50 A 50 LYS middle . . 51 A 51 ARG middle . . 52 A 52 LYS middle . . 53 A 53 THR middle . . 54 A 54 ASN middle . . 55 A 55 GLY middle . false 56 A 56 GLY middle . false 57 A 57 CYS middle . . 58 A 58 PRO middle . false 59 A 59 ILE middle . . 60 A 60 CYS middle . . 61 A 61 LYS middle . . 62 A 62 GLN middle . . 63 A 63 LEU middle . . 64 A 64 ILE middle . . 65 A 65 ALA middle . . 66 A 66 LEU middle . . 67 A 67 ALA middle . . 68 A 68 ALA middle . . 69 A 69 TYR middle . . 70 A 70 HIS middle . . 71 A 71 ALA middle . . 72 A 72 LYS middle . . 73 A 73 HIS middle . . 74 A 74 CYS middle . . 75 A 75 GLN middle . . 76 A 76 GLU middle . . 77 A 77 ASN middle . . 78 A 78 LYS middle . . 79 A 79 CYS middle . . 80 A 80 PRO middle . false 81 A 81 VAL middle . . 82 A 82 PRO middle . false 83 A 83 PHE middle . . 84 A 84 CYS middle . . 85 A 85 LEU middle . . 86 A 86 ASN middle . . 87 A 87 ILE middle . . 88 A 88 LYS middle . . 89 A 89 GLN middle . . 90 A 90 LYS end . . 91 B 1 MET start . . 92 B 2 GLU middle . . 93 B 3 GLU middle . . 94 B 4 PRO middle . false 95 B 5 GLN middle . . 96 B 6 SER middle . . 97 B 7 ASP middle . . 98 B 8 PRO middle . false 99 B 9 SER middle . . 100 B 10 VAL middle . . 101 B 11 GLU middle . . 102 B 12 PRO middle . false 103 B 13 PRO middle . false 104 B 14 LEU middle . . 105 B 15 SER middle . . 106 B 16 GLN middle . . 107 B 17 GLU middle . . 108 B 18 THR middle . . 109 B 19 PHE middle . . 110 B 20 SER middle . . 111 B 21 ASP middle . . 112 B 22 LEU middle . . 113 B 23 TRP middle . . 114 B 24 LYS middle . . 115 B 25 LEU middle . . 116 B 26 LEU middle . . 117 B 27 PRO middle . false 118 B 28 GLU middle . . 119 B 29 ASN middle . . 120 B 30 ASN middle . . 121 B 31 VAL middle . . 122 B 32 LEU middle . . 123 B 33 SER middle . . 124 B 34 PRO middle . false 125 B 35 LEU middle . . 126 B 36 PRO middle . false 127 B 37 SER middle . . 128 B 38 GLN middle . . 129 B 39 ALA 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 2 THR C C 13 174.2800 . A 2 THR CA C 13 61.820 . A 2 THR CB C 13 69.660 . A 3 GLN H H 1 8.5020 . A 3 GLN HA H 1 4.4850 . A 3 GLN HBx H 1 2.100 . A 3 GLN HBy H 1 2.100 . A 3 GLN HGx H 1 2.4200 . A 3 GLN C C 13 175.6800 . A 3 GLN CA C 13 55.490 . A 3 GLN CB C 13 28.570 . A 3 GLN CG C 13 33.5600 . A 3 GLN N N 15 123.3460 . A 4 SER H H 1 8.5860 . A 4 SER HA H 1 4.860 . A 4 SER HBx H 1 3.9500 . A 4 SER HBy H 1 3.9500 . A 4 SER C C 13 173.2400 . A 4 SER CA C 13 56.280 . A 4 SER CB C 13 63.080 . A 4 SER N N 15 119.430 . A 5 PRO HA H 1 4.4900 . A 5 PRO HBy H 1 2.390 . A 5 PRO HBx H 1 2.020 . A 5 PRO HDy H 1 3.900 . A 5 PRO HDx H 1 3.830 . A 5 PRO HGy H 1 2.160 . A 5 PRO HGx H 1 2.110 . A 5 PRO C C 13 178.020 . A 5 PRO CA C 13 63.740 . A 5 PRO CB C 13 30.120 . A 5 PRO CD C 13 50.510 . A 5 PRO CG C 13 26.950 . A 6 GLY H H 1 8.420 . A 6 GLY HAy H 1 3.9800 . A 6 GLY C C 13 174.600 . A 6 GLY CA C 13 45.580 . A 6 GLY N N 15 108.250 . A 7 ASP H H 1 8.080 . A 7 ASP HA H 1 4.660 . A 7 ASP HBx H 1 2.800 . A 7 ASP C C 13 177.440 . A 7 ASP CA C 13 54.9600 . A 7 ASP CB C 13 40.740 . A 7 ASP N N 15 121.2100 . A 8 SER H H 1 8.3630 . A 8 SER HA H 1 4.330 . A 8 SER HBx H 1 4.020 . A 8 SER C C 13 177.520 . A 8 SER CA C 13 59.990 . A 8 SER CB C 13 62.540 . A 8 SER N N 15 117.020 . A 9 ARG H H 1 8.270 . A 9 ARG HA H 1 4.820 . A 9 ARG HBx H 1 1.940 . A 9 ARG HBy H 1 1.940 . A 9 ARG HGx H 1 1.740 . A 9 ARG HGy H 1 1.740 . A 9 ARG C C 13 177.800 . A 9 ARG CA C 13 58.170 . A 9 ARG CB C 13 29.490 . A 9 ARG CD C 13 42.7900 . A 9 ARG CG C 13 26.320 . A 9 ARG N N 15 123.050 . A 10 ARG H H 1 8.030 . A 10 ARG HA H 1 4.100 . A 10 ARG HBx H 1 1.930 . A 10 ARG HBy H 1 1.930 . A 10 ARG HDx H 1 3.270 . A 10 ARG HDy H 1 3.270 . A 10 ARG HGx H 1 1.650 . A 10 ARG HGy H 1 1.650 . A 10 ARG C C 13 177.900 . A 10 ARG CA C 13 57.100 . A 10 ARG CB C 13 29.4900 . A 10 ARG CD C 13 42.9500 . A 10 ARG CG C 13 26.750 . A 10 ARG N N 15 119.730 . A 11 LEU H H 1 8.100 . A 11 LEU HA H 1 4.220 . A 11 LEU HBy H 1 1.800 . A 11 LEU HBx H 1 1.680 . A 11 LEU HDx% H 1 0.9500 . A 11 LEU HG H 1 1.740 . A 11 LEU C C 13 178.600 . A 11 LEU CA C 13 57.100 . A 11 LEU CB C 13 41.270 . A 11 LEU CDx C 13 23.950 . A 11 LEU CG C 13 26.750 . A 11 LEU N N 15 120.770 . A 12 SER H H 1 8.0520 . A 12 SER HA H 1 4.250 . A 12 SER HBx H 1 4.060 . A 12 SER HBy H 1 4.060 . A 12 SER C C 13 178.7900 . A 12 SER CA C 13 60.960 . A 12 SER CB C 13 62.580 . A 12 SER N N 15 115.7600 . A 13 ILE H H 1 8.000 . A 13 ILE HA H 1 3.7300 . A 13 ILE HB H 1 2.200 . A 13 ILE HD1% H 1 1.030 . A 13 ILE HG1y H 1 1.960 . A 13 ILE HG1x H 1 1.300 . A 13 ILE HG2% H 1 1.120 . A 13 ILE C C 13 179.7400 . A 13 ILE CA C 13 64.920 . A 13 ILE CB C 13 37.200 . A 13 ILE CD1 C 13 13.680 . A 13 ILE CG1 C 13 29.2400 . A 13 ILE CG2 C 13 17.470 . A 13 ILE N N 15 123.2900 . A 14 GLN H H 1 8.110 . A 14 GLN HA H 1 4.0300 . A 14 GLN HBx H 1 2.200 . A 14 GLN HGx H 1 2.5300 . A 14 GLN HGy H 1 2.5300 . A 14 GLN C C 13 178.8500 . A 14 GLN CA C 13 59.170 . A 14 GLN CB C 13 27.810 . A 14 GLN CG C 13 33.360 . A 14 GLN N N 15 119.020 . A 15 ARG H H 1 8.360 . A 15 ARG HA H 1 3.980 . A 15 ARG HBx H 1 1.940 . A 15 ARG HBy H 1 1.940 . A 15 ARG HDx H 1 3.300 . A 15 ARG HDy H 1 3.300 . A 15 ARG HGx H 1 1.650 . A 15 ARG HGy H 1 1.650 . A 15 ARG C C 13 177.020 . A 15 ARG CA C 13 59.0300 . A 15 ARG CB C 13 29.460 . A 15 ARG CD C 13 42.5300 . A 15 ARG CG C 13 27.460 . A 15 ARG N N 15 118.820 . A 16 ALA H H 1 8.000 . A 16 ALA HA H 1 4.230 . A 16 ALA HB% H 1 1.5400 . A 16 ALA C C 13 179.7500 . A 16 ALA CA C 13 55.190 . A 16 ALA CB C 13 18.020 . A 16 ALA N N 15 123.80 . A 17 ILE H H 1 8.490 . A 17 ILE HA H 1 3.760 . A 17 ILE HB H 1 2.210 . A 17 ILE HD1% H 1 1.030 . A 17 ILE HG1y H 1 1.963 . A 17 ILE HG1x H 1 1.320 . A 17 ILE HG2% H 1 1.130 . A 17 ILE C C 13 178.300 . A 17 ILE CA C 13 64.710 . A 17 ILE CB C 13 36.560 . A 17 ILE CD1 C 13 13.650 . A 17 ILE CG1 C 13 29.140 . A 17 ILE CG2 C 13 17.450 . A 17 ILE N N 15 118.260 . A 18 GLN H H 1 8.230 . A 18 GLN HA H 1 4.110 . A 18 GLN HBx H 1 2.240 . A 18 GLN HGy H 1 2.640 . A 18 GLN HGx H 1 2.540 . A 18 GLN C C 13 178.9500 . A 18 GLN CA C 13 59.030 . A 18 GLN CB C 13 27.540 . A 18 GLN CG C 13 33.4500 . A 18 GLN N N 15 118.800 . A 19 SER H H 1 8.230 . A 19 SER HA H 1 4.430 . A 19 SER HBy H 1 4.130 . A 19 SER HBx H 1 3.950 . A 19 SER C C 13 176.120 . A 19 SER CA C 13 61.600 . A 19 SER CB C 13 62.580 . A 19 SER N N 15 116.040 . A 20 LEU H H 1 8.250 . A 20 LEU HA H 1 4.090 . A 20 LEU HBy H 1 2.1200 . A 20 LEU HBx H 1 1.7700 . A 20 LEU HDx% H 1 0.9600 . A 20 LEU HDy% H 1 0.900 . A 20 LEU HG H 1 1.5400 . A 20 LEU C C 13 177.180 . A 20 LEU CA C 13 58.390 . A 20 LEU CB C 13 41.810 . A 20 LEU CDy C 13 25.3200 . A 20 LEU CDx C 13 25.090 . A 20 LEU CG C 13 26.7500 . A 20 LEU N N 15 125.460 . A 21 VAL H H 1 8.5200 . A 21 VAL HA H 1 3.340 . A 21 VAL HB H 1 2.1600 . A 21 VAL HGx% H 1 0.960 . A 21 VAL C C 13 178.430 . A 21 VAL CA C 13 66.510 . A 21 VAL CB C 13 31.2700 . A 21 VAL CGx C 13 20.550 . A 21 VAL CGy C 13 20.550 . A 21 VAL N N 15 118.590 . A 22 HIS H H 1 7.950 . A 22 HIS HA H 1 4.260 . A 22 HIS HBx H 1 3.3300 . A 22 HIS HBy H 1 3.3300 . A 22 HIS C C 13 178.020 . A 22 HIS CA C 13 59.770 . A 22 HIS CB C 13 27.230 . A 22 HIS N N 15 115.760 . A 23 ALA H H 1 8.580 . A 23 ALA HA H 1 4.190 . A 23 ALA HB% H 1 1.6200 . A 23 ALA C C 13 179.21 . A 23 ALA CA C 13 54.420 . A 23 ALA CB C 13 19.010 . A 23 ALA N N 15 121.190 . A 24 ALA H H 1 8.240 . A 24 ALA HA H 1 4.110 . A 24 ALA HB% H 1 1.4150 . A 24 ALA C C 13 177.610 . A 24 ALA CA C 13 53.540 . A 24 ALA CB C 13 18.060 . A 24 ALA N N 15 116.530 . A 25 GLN H H 1 7.230 . A 25 GLN HA H 1 4.540 . A 25 GLN HBy H 1 2.200 . A 25 GLN HBx H 1 2.050 . A 25 GLN HGy H 1 2.560 . A 25 GLN HGx H 1 2.340 . A 25 GLN C C 13 174.530 . A 25 GLN CA C 13 54.400 . A 25 GLN CB C 13 30.090 . A 25 GLN CG C 13 32.950 . A 25 GLN N N 15 112.050 . A 26 CYS H H 1 7.320 . A 26 CYS HA H 1 3.920 . A 26 CYS HBx H 1 2.590 . A 26 CYS HBy H 1 2.590 . A 26 CYS C C 13 176.230 . A 26 CYS CA C 13 60.480 . A 26 CYS CB C 13 28.470 . A 26 CYS N N 15 124.310 . A 27 ARG H H 1 8.840 . A 27 ARG HA H 1 4.650 . A 27 ARG HBy H 1 2.180 . A 27 ARG HBx H 1 1.660 . A 27 ARG HDx H 1 3.230 . A 27 ARG HDy H 1 3.230 . A 27 ARG HGx H 1 1.6700 . A 27 ARG HGy H 1 1.6700 . A 27 ARG C C 13 175.270 . A 27 ARG CA C 13 54.320 . A 27 ARG CB C 13 29.490 . A 27 ARG CD C 13 42.650 . A 27 ARG CG C 13 25.940 . A 27 ARG N N 15 129.620 . A 28 ASN H H 1 7.930 . A 28 ASN HA H 1 4.890 . A 28 ASN HBy H 1 3.000 . A 28 ASN HBx H 1 2.900 . A 28 ASN C C 13 175.240 . A 28 ASN CA C 13 51.540 . A 28 ASN CB C 13 38.460 . A 28 ASN N N 15 120.580 . A 29 ALA H H 1 9.100 . A 29 ALA HA H 1 4.120 . A 29 ALA HB% H 1 1.470 . A 29 ALA C C 13 178.010 . A 29 ALA CA C 13 54.040 . A 29 ALA CB C 13 18.020 . A 29 ALA N N 15 130.290 . A 30 ASN H H 1 8.080 . A 30 ASN HA H 1 4.900 . A 30 ASN HBy H 1 3.010 . A 30 ASN HBx H 1 2.650 . A 30 ASN C C 13 174.150 . A 30 ASN CA C 13 51.490 . A 30 ASN CB C 13 38.20 . A 30 ASN N N 15 114.290 . A 31 CYS H H 1 7.170 . A 31 CYS HA H 1 4.0790 . A 31 CYS HBx H 1 3.040 . A 31 CYS HBy H 1 3.040 . A 31 CYS C C 13 176.800 . A 31 CYS CA C 13 61.430 . A 31 CYS CB C 13 29.4280 . A 31 CYS N N 15 123.080 . A 32 SER H H 1 8.740 . A 32 SER HA H 1 4.150 . A 32 SER HBx H 1 3.920 . A 32 SER HBy H 1 3.920 . A 32 SER C C 13 174.850 . A 32 SER CA C 13 57.570 . A 32 SER CB C 13 63.5400 . A 32 SER N N 15 124.210 . A 33 LEU H H 1 8.520 . A 33 LEU HA H 1 4.570 . A 33 LEU HBy H 1 1.6510 . A 33 LEU HBx H 1 1.4900 . A 33 LEU HDx% H 1 0.6400 . A 33 LEU HDy% H 1 0.610 . A 33 LEU HG H 1 1.6300 . A 33 LEU C C 13 176.850 . A 33 LEU CA C 13 54.080 . A 33 LEU CB C 13 40.420 . A 33 LEU CDy C 13 23.4200 . A 33 LEU CDx C 13 22.950 . A 33 LEU CG C 13 26.9800 . A 33 LEU N N 15 128.730 . A 34 PRO HA H 1 4.3600 . A 34 PRO HBy H 1 2.440 . A 34 PRO HBx H 1 2.040 . A 34 PRO HDx H 1 3.842 . A 34 PRO HDy H 1 3.842 . A 34 PRO HGy H 1 2.247 . A 34 PRO HGx H 1 2.105 . A 34 PRO C C 13 178.380 . A 34 PRO CA C 13 64.970 . A 34 PRO CB C 13 31.230 . A 34 PRO CD C 13 50.500 . A 34 PRO CG C 13 26.9800 . A 35 SER H H 1 8.300 . A 35 SER HA H 1 4.3200 . A 35 SER HBx H 1 4.110 . A 35 SER HBy H 1 4.110 . A 35 SER C C 13 178.350 . A 35 SER CA C 13 59.9530 . A 35 SER CB C 13 62.470 . A 35 SER N N 15 111.680 . A 36 CYS H H 1 7.500 . A 36 CYS HA H 1 4.2420 . A 36 CYS HBy H 1 3.280 . A 36 CYS HBx H 1 2.792 . A 36 CYS C C 13 176.630 . A 36 CYS CA C 13 63.710 . A 36 CYS CB C 13 29.170 . A 36 CYS N N 15 125.580 . A 37 GLN H H 1 8.170 . A 37 GLN HA H 1 4.010 . A 37 GLN HBx H 1 2.200 . A 37 GLN HGy H 1 2.750 . A 37 GLN HGx H 1 2.520 . A 37 GLN C C 13 178.900 . A 37 GLN CA C 13 59.580 . A 37 GLN CB C 13 27.560 . A 37 GLN CG C 13 33.650 . A 37 GLN N N 15 116.020 . A 38 LYS H H 1 7.840 . A 38 LYS HA H 1 4.0790 . A 38 LYS HBx H 1 1.910 . A 38 LYS HBy H 1 1.910 . A 38 LYS HDx H 1 1.610 . A 38 LYS HEx H 1 2.9400 . A 38 LYS HGx H 1 1.4900 . A 38 LYS C C 13 179.300 . A 38 LYS CA C 13 59.280 . A 38 LYS CB C 13 32.120 . A 38 LYS CD C 13 26.5500 . A 38 LYS CE C 13 41.450 . A 38 LYS CG C 13 25.080 . A 38 LYS N N 15 117.00 . A 39 MET H H 1 8.270 . A 39 MET HA H 1 4.580 . A 39 MET HBy H 1 2.400 . A 39 MET HBx H 1 1.960 . A 39 MET HGy H 1 2.810 . A 39 MET HGx H 1 2.630 . A 39 MET C C 13 179.710 . A 39 MET CA C 13 56.330 . A 39 MET CB C 13 31.180 . A 39 MET CG C 13 33.1500 . A 39 MET N N 15 118.020 . A 40 LYS H H 1 9.530 . A 40 LYS HA H 1 3.860 . A 40 LYS HBy H 1 2.170 . A 40 LYS HBx H 1 1.900 . A 40 LYS HDx H 1 1.730 . A 40 LYS HEx H 1 3.310 . A 40 LYS HGx H 1 1.440 . A 40 LYS C C 13 179.620 . A 40 LYS CA C 13 61.360 . A 40 LYS CB C 13 32.120 . A 40 LYS CD C 13 29.600 . A 40 LYS CE C 13 42.180 . A 40 LYS CG C 13 26.950 . A 40 LYS N N 15 122.280 . A 41 ARG H H 1 7.560 . A 41 ARG HA H 1 4.200 . A 41 ARG HBy H 1 2.200 . A 41 ARG HBx H 1 2.010 . A 41 ARG HDx H 1 3.310 . A 41 ARG HDy H 1 3.310 . A 41 ARG HGx H 1 1.7900 . A 41 ARG HGy H 1 1.7900 . A 41 ARG C C 13 179.6500 . A 41 ARG CA C 13 59.350 . A 41 ARG CB C 13 29.300 . A 41 ARG CD C 13 43.1500 . A 41 ARG CG C 13 28.800 . A 41 ARG N N 15 117.590 . A 42 VAL H H 1 7.570 . A 42 VAL HA H 1 3.670 . A 42 VAL HB H 1 2.600 . A 42 VAL HGx% H 1 1.180 . A 42 VAL HGy% H 1 1.00 . A 42 VAL C C 13 177.4800 . A 42 VAL CA C 13 66.4200 . A 42 VAL CB C 13 30.700 . A 42 VAL CGy C 13 22.6600 . A 42 VAL CGx C 13 20.8100 . A 42 VAL N N 15 121.450 . A 43 VAL H H 1 8.450 . A 43 VAL HA H 1 3.540 . A 43 VAL HB H 1 2.2700 . A 43 VAL HGx% H 1 1.00 . A 43 VAL C C 13 178.950 . A 43 VAL CA C 13 66.940 . A 43 VAL CB C 13 31.090 . A 43 VAL CGx C 13 21.050 . A 43 VAL N N 15 120.380 . A 44 GLN H H 1 8.400 . A 44 GLN HA H 1 4.020 . A 44 GLN HBx H 1 2.220 . A 44 GLN HGx H 1 2.520 . A 44 GLN C C 13 177.2400 . A 44 GLN CA C 13 58.550 . A 44 GLN CB C 13 27.550 . A 44 GLN CG C 13 33.300 . A 44 GLN N N 15 119.280 . A 45 HIS H H 1 8.0700 . A 45 HIS HA H 1 4.280 . A 45 HIS HBx H 1 3.3500 . A 45 HIS C C 13 177.800 . A 45 HIS CA C 13 59.440 . A 45 HIS CB C 13 26.760 . A 45 HIS N N 15 119.00 . A 46 THR H H 1 7.800 . A 46 THR HA H 1 3.870 . A 46 THR HB H 1 4.2450 . A 46 THR HG2% H 1 1.671 . A 46 THR C C 13 175.8500 . A 46 THR CA C 13 65.410 . A 46 THR CB C 13 68.850 . A 46 THR CG2 C 13 21.280 . A 46 THR N N 15 110.300 . A 47 LYS H H 1 7.310 . A 47 LYS HA H 1 4.100 . A 47 LYS HBx H 1 1.880 . A 47 LYS HDx H 1 1.630 . A 47 LYS HDy H 1 1.630 . A 47 LYS HEx H 1 2.930 . A 47 LYS HEy H 1 2.930 . A 47 LYS HGx H 1 1.4900 . A 47 LYS C C 13 177.6400 . A 47 LYS CA C 13 58.310 . A 47 LYS CB C 13 31.420 . A 47 LYS CD C 13 28.880 . A 47 LYS CE C 13 41.550 . A 47 LYS CG C 13 24.8100 . A 47 LYS N N 15 120.240 . A 48 GLY H H 1 7.1590 . A 48 GLY HAy H 1 4.410 . A 48 GLY HAx H 1 3.680 . A 48 GLY C C 13 173.8500 . A 48 GLY CA C 13 44.4330 . A 48 GLY N N 15 103.360 . A 49 CYS H H 1 6.910 . A 49 CYS HA H 1 4.020 . A 49 CYS HBx H 1 2.7500 . A 49 CYS HBy H 1 2.7500 . A 49 CYS C C 13 176.710 . A 49 CYS CA C 13 60.620 . A 49 CYS CB C 13 29.260 . A 49 CYS N N 15 123.280 . A 50 LYS H H 1 8.960 . A 50 LYS HA H 1 3.980 . A 50 LYS HBx H 1 1.770 . A 50 LYS HBy H 1 1.770 . A 50 LYS HDx H 1 1.6600 . A 50 LYS HDy H 1 1.6600 . A 50 LYS HEx H 1 3.010 . A 50 LYS HEy H 1 3.010 . A 50 LYS HGx H 1 1.5400 . A 50 LYS HGy H 1 1.5400 . A 50 LYS C C 13 177.5800 . A 50 LYS CA C 13 56.280 . A 50 LYS CB C 13 32.150 . A 50 LYS CD C 13 28.140 . A 50 LYS CE C 13 41.840 . A 50 LYS CG C 13 28.6900 . A 50 LYS N N 15 128.200 . A 51 ARG H H 1 8.530 . A 51 ARG HA H 1 4.460 . A 51 ARG HBx H 1 1.840 . A 51 ARG HDx H 1 3.341 . A 51 ARG HDy H 1 3.341 . A 51 ARG HGx H 1 1.780 . A 51 ARG HGy H 1 1.780 . A 51 ARG C C 13 176.700 . A 51 ARG CA C 13 57.2030 . A 51 ARG CB C 13 30.9690 . A 51 ARG CD C 13 43.150 . A 51 ARG CG C 13 27.450 . A 51 ARG N N 15 122.350 . A 52 LYS H H 1 8.420 . A 52 LYS HA H 1 4.470 . A 52 LYS HBx H 1 2.130 . A 52 LYS HBy H 1 2.130 . A 52 LYS HDx H 1 1.810 . A 52 LYS HDy H 1 1.810 . A 52 LYS HEx H 1 3.220 . A 52 LYS HEy H 1 3.220 . A 52 LYS HGx H 1 1.430 . A 52 LYS HGy H 1 1.680 . A 52 LYS C C 13 177.300 . A 52 LYS CA C 13 57.600 . A 52 LYS CB C 13 31.6270 . A 52 LYS CD C 13 29.330 . A 52 LYS CE C 13 41.95 . A 52 LYS CG C 13 24.550 . A 52 LYS N N 15 118.820 . A 53 THR H H 1 7.760 . A 53 THR HA H 1 4.230 . A 53 THR HB H 1 4.4600 . A 53 THR HG2% H 1 1.280 . A 53 THR C C 13 175.700 . A 53 THR CA C 13 63.390 . A 53 THR CB C 13 68.220 . A 53 THR CG2 C 13 20.11 . A 53 THR N N 15 112.860 . A 54 ASN H H 1 8.260 . A 54 ASN HA H 1 4.1100 . A 54 ASN HBx H 1 2.960 . A 54 ASN C C 13 175.970 . A 54 ASN CA C 13 53.300 . A 54 ASN CB C 13 37.810 . A 54 ASN N N 15 119.690 . A 55 GLY H H 1 7.960 . A 55 GLY HAx H 1 4.010 . A 55 GLY HAy H 1 4.010 . A 55 GLY C C 13 175.270 . A 55 GLY CA C 13 45.610 . A 55 GLY N N 15 107.340 . A 56 GLY H H 1 7.820 . A 56 GLY HAx H 1 3.970 . A 56 GLY HAy H 1 3.970 . A 56 GLY C C 13 173.320 . A 56 GLY CA C 13 45.350 . A 56 GLY N N 15 107.080 . A 57 CYS H H 1 8.010 . A 57 CYS HA H 1 4.870 . A 57 CYS HBy H 1 3.000 . A 57 CYS HBx H 1 2.700 . A 57 CYS C C 13 175.610 . A 57 CYS CA C 13 55.340 . A 57 CYS CB C 13 30.160 . A 57 CYS N N 15 122.570 . A 58 PRO HA H 1 4.3200 . A 58 PRO HBy H 1 2.437 . A 58 PRO HBx H 1 1.970 . A 58 PRO HDy H 1 4.104 . A 58 PRO HDx H 1 4.100 . A 58 PRO HGy H 1 2.190 . A 58 PRO HGx H 1 2.100 . A 58 PRO CA C 13 64.550 . A 58 PRO CB C 13 32.050 . A 58 PRO CD C 13 50.5000 . A 58 PRO CG C 13 26.950 . A 59 ILE H H 1 7.9170 . A 59 ILE HA H 1 3.550 . A 59 ILE HB H 1 1.600 . A 59 ILE HD1% H 1 0.3910 . A 59 ILE HG1y H 1 1.3900 . A 59 ILE HG1x H 1 0.635 . A 59 ILE HG2% H 1 0.7150 . A 59 ILE C C 13 178.040 . A 59 ILE CA C 13 64.540 . A 59 ILE CB C 13 38.160 . A 59 ILE CD1 C 13 11.560 . A 59 ILE CG1 C 13 27.950 . A 59 ILE CG2 C 13 18.6700 . A 59 ILE N N 15 120.680 . A 60 CYS H H 1 8.920 . A 60 CYS HA H 1 4.1050 . A 60 CYS HBy H 1 3.0470 . A 60 CYS HBx H 1 2.8240 . A 60 CYS C C 13 177.540 . A 60 CYS CA C 13 66.000 . A 60 CYS CB C 13 28.750 . A 60 CYS N N 15 123.890 . A 61 LYS H H 1 8.100 . A 61 LYS HA H 1 3.9200 . A 61 LYS HBy H 1 1.9100 . A 61 LYS HBx H 1 1.740 . A 61 LYS HDx H 1 1.660 . A 61 LYS HEx H 1 2.850 . A 61 LYS HGy H 1 1.5400 . A 61 LYS HGx H 1 1.420 . A 61 LYS C C 13 179.030 . A 61 LYS CA C 13 59.610 . A 61 LYS CB C 13 32.040 . A 61 LYS CD C 13 28.6500 . A 61 LYS CE C 13 41.250 . A 61 LYS CG C 13 25.080 . A 61 LYS N N 15 117.130 . A 62 GLN H H 1 7.010 . A 62 GLN HA H 1 4.150 . A 62 GLN HBx H 1 2.170 . A 62 GLN HBy H 1 2.170 . A 62 GLN HGx H 1 2.530 . A 62 GLN HGy H 1 2.530 . A 62 GLN C C 13 178.340 . A 62 GLN CA C 13 58.520 . A 62 GLN CB C 13 27.5870 . A 62 GLN CG C 13 33.250 . A 62 GLN N N 15 117.00 . A 63 LEU H H 1 7.980 . A 63 LEU HA H 1 4.160 . A 63 LEU HBx H 1 1.9500 . A 63 LEU HDx% H 1 1.054 . A 63 LEU HDy% H 1 0.7210 . A 63 LEU HG H 1 1.6900 . A 63 LEU C C 13 179.060 . A 63 LEU CA C 13 57.830 . A 63 LEU CB C 13 41.270 . A 63 LEU CDy C 13 24.830 . A 63 LEU CDx C 13 22.140 . A 63 LEU CG C 13 30.3700 . A 63 LEU N N 15 119.730 . A 64 ILE H H 1 8.4810 . A 64 ILE HA H 1 3.650 . A 64 ILE HB H 1 1.540 . A 64 ILE HD1% H 1 0.510 . A 64 ILE HG1x H 1 1.160 . A 64 ILE HG1y H 1 1.160 . A 64 ILE HG2% H 1 0.8930 . A 64 ILE C C 13 179.930 . A 64 ILE CA C 13 65.220 . A 64 ILE CB C 13 36.960 . A 64 ILE CD1 C 13 12.750 . A 64 ILE CG1 C 13 29.360 . A 64 ILE CG2 C 13 16.540 . A 64 ILE N N 15 120.350 . A 65 ALA H H 1 7.300 . A 65 ALA HA H 1 4.200 . A 65 ALA HB% H 1 1.610 . A 65 ALA C C 13 180.010 . A 65 ALA CA C 13 54.940 . A 65 ALA CB C 13 18.010 . A 65 ALA N N 15 122.510 . A 66 LEU H H 1 8.120 . A 66 LEU HA H 1 4.100 . A 66 LEU HBx H 1 1.760 . A 66 LEU HBy H 1 1.760 . A 66 LEU HDx% H 1 0.9400 . A 66 LEU HDy% H 1 0.9100 . A 66 LEU HG H 1 1.600 . A 66 LEU C C 13 179.480 . A 66 LEU CA C 13 57.540 . A 66 LEU CB C 13 41.940 . A 66 LEU CDy C 13 26.7500 . A 66 LEU CDx C 13 25.0800 . A 66 LEU CG C 13 26.8000 . A 66 LEU N N 15 115.490 . A 67 ALA H H 1 8.840 . A 67 ALA HA H 1 4.00 . A 67 ALA HB% H 1 1.760 . A 67 ALA C C 13 179.000 . A 67 ALA CA C 13 55.490 . A 67 ALA CB C 13 18.460 . A 67 ALA N N 15 121.500 . A 68 ALA H H 1 8.500 . A 68 ALA HA H 1 4.160 . A 68 ALA HB% H 1 1.530 . A 68 ALA C C 13 179.070 . A 68 ALA CA C 13 55.290 . A 68 ALA CB C 13 17.524 . A 68 ALA N N 15 120.100 . A 69 TYR H H 1 7.850 . A 69 TYR HA H 1 4.3100 . A 69 TYR HBx H 1 2.4600 . A 69 TYR HBy H 1 2.4600 . A 69 TYR CA C 13 56.1410 . A 69 TYR CB C 13 37.9430 . A 69 TYR N N 15 118.930 . A 70 HIS H H 1 7.9600 . A 70 HIS HA H 1 4.510 . A 70 HIS HBx H 1 2.8400 . A 70 HIS HBy H 1 2.840 . A 70 HIS CA C 13 54.640 . A 70 HIS CB C 13 27.560 . A 70 HIS N N 15 125.790 . A 71 ALA H H 1 9.190 . A 71 ALA HA H 1 3.960 . A 71 ALA HB% H 1 1.660 . A 71 ALA C C 13 179.070 . A 71 ALA CA C 13 54.510 . A 71 ALA CB C 13 19.240 . A 71 ALA N N 15 121.760 . A 72 LYS H H 1 6.950 . A 72 LYS HA H 1 3.920 . A 72 LYS HBy H 1 1.500 . A 72 LYS HBx H 1 1.420 . A 72 LYS HDx H 1 1.6100 . A 72 LYS HDy H 1 1.6100 . A 72 LYS HEx H 1 2.964 . A 72 LYS HEy H 1 2.964 . A 72 LYS HGx H 1 1.3100 . A 72 LYS HGy H 1 1.3100 . A 72 LYS C C 13 176.750 . A 72 LYS CA C 13 57.690 . A 72 LYS CB C 13 31.720 . A 72 LYS CD C 13 28.1700 . A 72 LYS CE C 13 42.563 . A 72 LYS CG C 13 23.940 . A 72 LYS N N 15 114.500 . A 73 HIS H H 1 7.140 . A 73 HIS HA H 1 4.830 . A 73 HIS HBy H 1 3.471 . A 73 HIS HBx H 1 2.938 . A 73 HIS C C 13 173.590 . A 73 HIS CA C 13 54.070 . A 73 HIS CB C 13 29.640 . A 73 HIS N N 15 113.180 . A 74 CYS H H 1 7.020 . A 74 CYS HA H 1 4.1400 . A 74 CYS HBx H 1 2.510 . A 74 CYS HBy H 1 2.510 . A 74 CYS C C 13 176.120 . A 74 CYS CA C 13 59.8290 . A 74 CYS CB C 13 29.4730 . A 74 CYS N N 15 123.590 . A 75 GLN H H 1 9.070 . A 75 GLN HA H 1 4.705 . A 75 GLN HBx H 1 1.9100 . A 75 GLN HGx H 1 2.360 . A 75 GLN HGy H 1 2.360 . A 75 GLN C C 13 175.620 . A 75 GLN CA C 13 54.290 . A 75 GLN CB C 13 28.760 . A 75 GLN CG C 13 32.950 . A 75 GLN N N 15 128.650 . A 76 GLU H H 1 8.260 . A 76 GLU HA H 1 4.410 . A 76 GLU HBx H 1 2.000 . A 76 GLU HBy H 1 2.000 . A 76 GLU HGx H 1 2.420 . A 76 GLU HGy H 1 2.420 . A 76 GLU C C 13 176.700 . A 76 GLU CA C 13 55.510 . A 76 GLU CB C 13 29.860 . A 76 GLU CG C 13 35.150 . A 76 GLU N N 15 123.000 . A 77 ASN H H 1 8.830 . A 77 ASN HA H 1 4.530 . A 77 ASN HBy H 1 3.005 . A 77 ASN HBx H 1 2.850 . A 77 ASN C C 13 175.700 . A 77 ASN CA C 13 55.030 . A 77 ASN CB C 13 38.030 . A 77 ASN N N 15 125.100 . A 78 LYS H H 1 8.660 . A 78 LYS HA H 1 4.440 . A 78 LYS HBy H 1 1.950 . A 78 LYS HBx H 1 1.670 . A 78 LYS HDx H 1 1.710 . A 78 LYS HDy H 1 1.710 . A 78 LYS HEx H 1 3.030 . A 78 LYS HEy H 1 3.030 . A 78 LYS HGx H 1 1.410 . A 78 LYS HGy H 1 1.410 . A 78 LYS C C 13 174.9300 . A 78 LYS CA C 13 54.120 . A 78 LYS CB C 13 30.120 . A 78 LYS CD C 13 28.6500 . A 78 LYS CE C 13 41.980 . A 78 LYS CG C 13 24.8500 . A 78 LYS N N 15 120.580 . A 79 CYS H H 1 7.320 . A 79 CYS HA H 1 4.160 . A 79 CYS HBy H 1 3.240 . A 79 CYS HBx H 1 3.148 . A 79 CYS C C 13 176.230 . A 79 CYS CA C 13 60.480 . A 79 CYS CB C 13 28.440 . A 79 CYS N N 15 124.350 . A 80 PRO HA H 1 4.730 . A 80 PRO HBy H 1 2.170 . A 80 PRO HBx H 1 2.100 . A 80 PRO HDy H 1 4.180 . A 80 PRO HDx H 1 3.910 . A 80 PRO HGy H 1 2.080 . A 80 PRO HGx H 1 1.730 . A 80 PRO CA C 13 62.580 . A 80 PRO CB C 13 31.540 . A 80 PRO CD C 13 50.750 . A 80 PRO CG C 13 25.800 . A 81 VAL H H 1 9.030 . A 81 VAL HA H 1 3.570 . A 81 VAL HB H 1 2.2670 . A 81 VAL HGx% H 1 0.7350 . A 81 VAL HGy% H 1 0.500 . A 81 VAL CA C 13 62.220 . A 81 VAL CB C 13 30.990 . A 81 VAL CGx C 13 18.950 . A 81 VAL CGy C 13 23.420 . A 81 VAL N N 15 127.570 . A 82 PRO HA H 1 4.860 . A 82 PRO HBy H 1 2.400 . A 82 PRO HBx H 1 2.240 . A 82 PRO HDy H 1 3.670 . A 82 PRO HDx H 1 3.600 . A 82 PRO HGy H 1 2.000 . A 82 PRO HGx H 1 1.910 . A 82 PRO CA C 13 62.860 . A 82 PRO CB C 13 31.550 . A 82 PRO CD C 13 49.550 . A 82 PRO CG C 13 24.1290 . A 83 PHE H H 1 6.940 . A 83 PHE HA H 1 4.460 . A 83 PHE HBy H 1 3.350 . A 83 PHE HBx H 1 3.270 . A 83 PHE C C 13 177.240 . A 83 PHE CA C 13 59.880 . A 83 PHE CB C 13 37.550 . A 83 PHE N N 15 123.5300 . A 84 CYS H H 1 7.020 . A 84 CYS HA H 1 4.100 . A 84 CYS HBy H 1 3.050 . A 84 CYS HBx H 1 2.820 . A 84 CYS CA C 13 66.560 . A 84 CYS CB C 13 29.770 . A 84 CYS N N 15 111.010 . A 85 LEU H H 1 8.190 . A 85 LEU HA H 1 4.130 . A 85 LEU HBx H 1 1.510 . A 85 LEU HDx% H 1 0.910 . A 85 LEU HDy% H 1 0.805 . A 85 LEU HG H 1 1.940 . A 85 LEU C C 13 178.700 . A 85 LEU CA C 13 57.450 . A 85 LEU CB C 13 41.720 . A 85 LEU CDy C 13 24.8500 . A 85 LEU CDx C 13 23.900 . A 85 LEU CG C 13 26.0500 . A 85 LEU N N 15 120.080 . A 86 ASN H H 1 7.740 . A 86 ASN HA H 1 4.530 . A 86 ASN HBy H 1 2.9400 . A 86 ASN HBx H 1 2.8500 . A 86 ASN C C 13 177.040 . A 86 ASN CA C 13 55.510 . A 86 ASN CB C 13 38.650 . A 86 ASN N N 15 115.410 . A 87 ILE H H 1 8.190 . A 87 ILE HA H 1 3.960 . A 87 ILE HB H 1 2.0530 . A 87 ILE HD1% H 1 0.870 . A 87 ILE HG1x H 1 1.750 . A 87 ILE HG1y H 1 1.750 . A 87 ILE HG2% H 1 0.960 . A 87 ILE C C 13 177.980 . A 87 ILE CA C 13 63.050 . A 87 ILE CB C 13 36.9500 . A 87 ILE CD1 C 13 12.7300 . A 87 ILE CG1 C 13 26.2500 . A 87 ILE CG2 C 13 17.260 . A 87 ILE N N 15 120.100 . A 88 LYS H H 1 8.300 . A 88 LYS HA H 1 4.160 . A 88 LYS HBx H 1 1.950 . A 88 LYS HBy H 1 1.950 . A 88 LYS HDx H 1 1.850 . A 88 LYS HDy H 1 1.850 . A 88 LYS HGx H 1 1.720 . A 88 LYS HGy H 1 1.720 . A 88 LYS C C 13 179.730 . A 88 LYS CA C 13 59.030 . A 88 LYS CB C 13 27.530 . A 88 LYS CG C 13 26.780 . A 88 LYS N N 15 118.760 . A 89 GLN H H 1 8.730 . A 89 GLN HA H 1 4.440 . A 89 GLN HBx H 1 1.900 . A 89 GLN HGx H 1 2.050 . A 89 GLN CA C 13 56.350 . A 89 GLN CB C 13 27.750 . A 89 GLN CG C 13 33.530 . A 89 GLN N N 15 122.660 . A 90 LYS H H 1 7.920 . A 90 LYS HA H 1 4.190 . A 90 LYS HBx H 1 1.900 . A 90 LYS HBy H 1 1.900 . A 90 LYS HDx H 1 1.737 . A 90 LYS HDy H 1 1.737 . A 90 LYS HEx H 1 3.053 . A 90 LYS HEy H 1 3.053 . A 90 LYS HGx H 1 1.500 . A 90 LYS HGy H 1 1.500 . A 90 LYS CA C 13 57.520 . A 90 LYS CB C 13 32.870 . A 90 LYS CD C 13 28.880 . A 90 LYS CE C 13 41.720 . A 90 LYS CG C 13 24.620 . A 90 LYS N N 15 127.300 . B 2 GLU C C 13 176.270 . B 2 GLU CA C 13 56.070 . B 2 GLU CB C 13 29.100 . B 3 GLU HA H 1 4.6500 . B 3 GLU HBx H 1 2.170 . B 3 GLU HBy H 1 2.170 . B 3 GLU HGx H 1 2.340 . B 3 GLU HGy H 1 2.340 . B 3 GLU C C 13 176.270 . B 3 GLU CA C 13 53.970 . B 3 GLU CB C 13 29.200 . B 3 GLU CG C 13 35.600 . B 4 PRO HA H 1 4.5100 . B 4 PRO HBy H 1 2.360 . B 4 PRO HBx H 1 2.000 . B 4 PRO HDy H 1 3.890 . B 4 PRO HDx H 1 3.700 . B 4 PRO HGx H 1 2.040 . B 4 PRO HGy H 1 2.040 . B 4 PRO C C 13 181.100 . B 4 PRO CA C 13 62.900 . B 4 PRO CB C 13 31.402 . B 4 PRO CD C 13 49.850 . B 4 PRO CG C 13 26.650 . B 5 GLN H H 1 8.530 . B 5 GLN HA H 1 4.430 . B 5 GLN HBx H 1 2.0300 . B 5 GLN HBy H 1 2.0300 . B 5 GLN HGx H 1 2.4200 . B 5 GLN C C 13 176.100 . B 5 GLN CA C 13 53.450 . B 5 GLN CB C 13 28.9900 . B 5 GLN CG C 13 33.4600 . B 5 GLN N N 15 120.510 . B 6 SER H H 1 8.330 . B 6 SER HA H 1 4.500 . B 6 SER HBx H 1 3.9300 . B 6 SER C C 13 173.9200 . B 6 SER CA C 13 57.860 . B 6 SER CB C 13 63.230 . B 6 SER N N 15 117.080 . B 7 ASP H H 1 8.3800 . B 7 ASP HA H 1 4.960 . B 7 ASP HBy H 1 2.850 . B 7 ASP HBx H 1 2.630 . B 7 ASP C C 13 174.7800 . B 7 ASP CA C 13 51.960 . B 7 ASP CB C 13 40.8500 . B 7 ASP N N 15 123.030 . B 8 PRO HA H 1 4.450 . B 8 PRO HBy H 1 2.280 . B 8 PRO HBx H 1 1.970 . B 8 PRO HDy H 1 3.7900 . B 8 PRO HDx H 1 3.6500 . B 8 PRO HGx H 1 2.080 . B 8 PRO HGy H 1 2.080 . B 8 PRO C C 13 177.080 . B 8 PRO CA C 13 63.520 . B 8 PRO CB C 13 31.612 . B 8 PRO CD C 13 49.770 . B 8 PRO CG C 13 27.1500 . B 9 SER H H 1 8.520 . B 9 SER HA H 1 4.450 . B 9 SER HBx H 1 3.950 . B 9 SER C C 13 174.420 . B 9 SER CA C 13 58.590 . B 9 SER CB C 13 63.330 . B 9 SER N N 15 116.010 . B 10 VAL H H 1 7.7710 . B 10 VAL HA H 1 4.200 . B 10 VAL HB H 1 2.0100 . B 10 VAL HGx% H 1 0.9400 . B 10 VAL HGy% H 1 0.8500 . B 10 VAL C C 13 174.430 . B 10 VAL CA C 13 61.330 . B 10 VAL CB C 13 32.3400 . B 10 VAL CGx C 13 20.9700 . B 10 VAL CGy C 13 20.9700 . B 10 VAL N N 15 121.350 . B 11 GLU H H 1 8.000 . B 11 GLU HA H 1 4.660 . B 11 GLU HBx H 1 2.180 . B 11 GLU HBy H 1 2.180 . B 11 GLU HGx H 1 2.350 . B 11 GLU HGy H 1 2.350 . B 11 GLU C C 13 173.740 . B 11 GLU CA C 13 53.130 . B 11 GLU CB C 13 29.8260 . B 11 GLU CG C 13 35.1500 . B 11 GLU N N 15 125.070 . B 12 PRO HA H 1 4.5200 . B 12 PRO HBx H 1 2.350 . B 12 PRO HBy H 1 2.350 . B 12 PRO HDx H 1 3.880 . B 12 PRO HDy H 1 3.880 . B 12 PRO HGx H 1 2.070 . B 12 PRO HGy H 1 2.070 . B 12 PRO CA C 13 63.570 . B 12 PRO CB C 13 31.350 . B 12 PRO CD C 13 49.750 . B 12 PRO CG C 13 27.1600 . B 13 PRO HA H 1 4.5100 . B 13 PRO HBy H 1 2.360 . B 13 PRO HBx H 1 1.990 . B 13 PRO HDy H 1 3.880 . B 13 PRO HDx H 1 3.760 . B 13 PRO HGx H 1 2.090 . B 13 PRO HGy H 1 2.090 . B 13 PRO C C 13 175.980 . B 13 PRO CB C 13 31.720 . B 13 PRO CD C 13 49.750 . B 13 PRO CG C 13 26.650 . B 14 LEU H H 1 7.900 . B 14 LEU HA H 1 4.480 . B 14 LEU HBx H 1 1.650 . B 14 LEU HDx% H 1 0.940 . B 14 LEU HG H 1 1.6500 . B 14 LEU C C 13 177.260 . B 14 LEU CA C 13 52.290 . B 14 LEU CB C 13 41.270 . B 14 LEU CDx C 13 23.230 . B 14 LEU CG C 13 26.3700 . B 14 LEU N N 15 120.860 . B 15 SER H H 1 8.620 . B 15 SER HA H 1 4.5100 . B 15 SER HBx H 1 4.10 . B 15 SER HBy H 1 4.10 . B 15 SER C C 13 175.040 . B 15 SER CA C 13 57.330 . B 15 SER CB C 13 63.960 . B 15 SER N N 15 117.360 . B 16 GLN H H 1 8.700 . B 16 GLN HA H 1 4.400 . B 16 GLN HBx H 1 2.200 . B 16 GLN HGy H 1 2.470 . B 16 GLN HGx H 1 2.460 . B 16 GLN C C 13 176.280 . B 16 GLN CA C 13 56.1700 . B 16 GLN CB C 13 29.310 . B 16 GLN CG C 13 33.3630 . B 16 GLN N N 15 122.480 . B 18 THR H H 1 7.860 . B 18 THR HA H 1 4.080 . B 18 THR HB H 1 4.210 . B 18 THR HG2% H 1 1.260 . B 18 THR C C 13 175.900 . B 18 THR CA C 13 66.280 . B 18 THR CB C 13 67.5500 . B 18 THR CG2 C 13 22.4800 . B 18 THR N N 15 116.790 . B 19 PHE H H 1 8.640 . B 19 PHE HA H 1 4.340 . B 19 PHE HBx H 1 3.150 . B 19 PHE HBy H 1 3.150 . B 19 PHE C C 13 176.340 . B 19 PHE CA C 13 59.680 . B 19 PHE CB C 13 38.070 . B 19 PHE N N 15 120.710 . B 20 SER H H 1 8.260 . B 20 SER C C 13 176.100 . B 20 SER CA C 13 61.280 . B 20 SER CB C 13 61.9800 . B 20 SER N N 15 114.00 . B 21 ASP H H 1 7.660 . B 21 ASP HA H 1 4.520 . B 21 ASP HBy H 1 2.790 . B 21 ASP HBx H 1 2.600 . B 21 ASP C C 13 177.890 . B 21 ASP CA C 13 56.070 . B 21 ASP CB C 13 40.020 . B 21 ASP N N 15 120.570 . B 22 LEU H H 1 7.990 . B 22 LEU HA H 1 3.940 . B 22 LEU HBy H 1 1.790 . B 22 LEU HBx H 1 1.490 . B 22 LEU HDx% H 1 0.800 . B 22 LEU HG H 1 1.530 . B 22 LEU C C 13 178.390 . B 22 LEU CA C 13 57.440 . B 22 LEU CB C 13 41.2700 . B 22 LEU CDx C 13 25.460 . B 22 LEU CG C 13 27.2500 . B 22 LEU N N 15 120.860 . B 23 TRP H H 1 8.920 . B 23 TRP HA H 1 4.200 . B 23 TRP HBy H 1 3.220 . B 23 TRP HBx H 1 2.990 . B 23 TRP C C 13 178.090 . B 23 TRP CA C 13 59.310 . B 23 TRP CB C 13 28.550 . B 23 TRP N N 15 119.580 . B 24 LYS H H 1 7.380 . B 24 LYS HA H 1 4.090 . B 24 LYS HBy H 1 1.870 . B 24 LYS HBx H 1 1.440 . B 24 LYS HDx H 1 1.710 . B 24 LYS HDy H 1 1.710 . B 24 LYS HEx H 1 3.020 . B 24 LYS HEy H 1 3.020 . B 24 LYS HGx H 1 1.480 . B 24 LYS HGy H 1 1.480 . B 24 LYS C C 13 177.360 . B 24 LYS CA C 13 57.750 . B 24 LYS CB C 13 31.980 . B 24 LYS CD C 13 28.680 . B 24 LYS CE C 13 41.450 . B 24 LYS CG C 13 24.570 . B 24 LYS N N 15 116.010 . B 25 LEU H H 1 7.700 . B 25 LEU HA H 1 4.330 . B 25 LEU HBy H 1 1.880 . B 25 LEU HBx H 1 1.690 . B 25 LEU HDx% H 1 0.800 . B 25 LEU HDy% H 1 0.870 . B 25 LEU HG H 1 1.830 . B 25 LEU C C 13 177.290 . B 25 LEU CA C 13 54.920 . B 25 LEU CB C 13 42.220 . B 25 LEU CDx C 13 24.800 . B 25 LEU CDy C 13 24.800 . B 25 LEU CG C 13 25.900 . B 25 LEU N N 15 118.160 . B 26 LEU H H 1 7.350 . B 26 LEU HA H 1 4.540 . B 26 LEU HBy H 1 1.650 . B 26 LEU HBx H 1 1.470 . B 26 LEU HDx% H 1 0.800 . B 26 LEU HDy% H 1 0.880 . B 26 LEU HG H 1 1.790 . B 26 LEU C C 13 175.090 . B 26 LEU CA C 13 53.130 . B 26 LEU CB C 13 40.650 . B 26 LEU CDy C 13 25.020 . B 26 LEU CDx C 13 23.120 . B 26 LEU CG C 13 26.1500 . B 26 LEU N N 15 120.260 . B 27 PRO HA H 1 4.550 . B 27 PRO HBy H 1 2.350 . B 27 PRO HBx H 1 2.020 . B 27 PRO HDx H 1 3.930 . B 27 PRO HDy H 1 3.930 . B 27 PRO HGx H 1 2.090 . B 27 PRO HGy H 1 2.090 . B 27 PRO C C 13 177.410 . B 27 PRO CA C 13 62.420 . B 27 PRO CB C 13 31.080 . B 27 PRO CD C 13 50.250 . B 27 PRO CG C 13 26.600 . B 28 GLU H H 1 8.670 . B 28 GLU HA H 1 4.210 . B 28 GLU HBx H 1 1.990 . B 28 GLU HBy H 1 1.990 . B 28 GLU HGx H 1 2.330 . B 28 GLU HGy H 1 2.330 . B 28 GLU C C 13 176.540 . B 28 GLU CA C 13 57.020 . B 28 GLU CB C 13 28.980 . B 28 GLU CG C 13 35.1500 . B 28 GLU N N 15 119.490 . B 29 ASN H H 1 8.220 . B 29 ASN HA H 1 4.720 . B 29 ASN HBy H 1 2.790 . B 29 ASN HBx H 1 2.710 . B 29 ASN C C 13 174.980 . B 29 ASN CA C 13 53.130 . B 29 ASN CB C 13 38.350 . B 29 ASN N N 15 118.090 . B 30 ASN H H 1 8.260 . B 30 ASN HA H 1 4.740 . B 30 ASN HBy H 1 2.870 . B 30 ASN HBx H 1 2.790 . B 30 ASN C C 13 175.120 . B 30 ASN CA C 13 53.230 . B 30 ASN CB C 13 38.550 . B 30 ASN N N 15 118.720 . B 31 VAL H H 1 8.010 . B 31 VAL HA H 1 4.150 . B 31 VAL HB H 1 2.180 . B 31 VAL HGx% H 1 0.960 . B 31 VAL C C 13 175.990 . B 31 VAL CA C 13 62.270 . B 31 VAL CB C 13 31.820 . B 31 VAL CGx C 13 21.010 . B 31 VAL N N 15 118.920 . B 32 LEU H H 1 8.190 . B 32 LEU HA H 1 4.420 . B 32 LEU HBx H 1 1.710 . B 32 LEU HDx% H 1 0.940 . B 32 LEU HDy% H 1 0.890 . B 32 LEU HG H 1 1.650 . B 32 LEU C C 13 176.960 . B 32 LEU CA C 13 54.4900 . B 32 LEU CB C 13 41.800 . B 32 LEU CDy C 13 24.570 . B 32 LEU CDx C 13 24.5500 . B 32 LEU CG C 13 26.600 . B 32 LEU N N 15 123.760 . B 33 SER H H 1 7.920 . B 33 SER HA H 1 4.790 . B 33 SER HBy H 1 3.910 . B 33 SER HBx H 1 3.860 . B 33 SER C C 13 172.710 . B 33 SER CA C 13 55.970 . B 33 SER CB C 13 63.020 . B 33 SER N N 15 117.150 . B 34 PRO HA H 1 4.510 . B 34 PRO HBy H 1 2.360 . B 34 PRO HBx H 1 2.010 . B 34 PRO HDx H 1 3.770 . B 34 PRO HDy H 1 3.770 . B 34 PRO HGx H 1 2.080 . B 34 PRO HGy H 1 2.080 . B 34 PRO C C 13 176.750 . B 34 PRO CA C 13 62.690 . B 34 PRO CB C 13 31.420 . B 34 PRO CD C 13 50.250 . B 34 PRO CG C 13 26.750 . B 35 LEU H H 1 8.200 . B 35 LEU HA H 1 4.620 . B 35 LEU HBx H 1 1.740 . B 35 LEU HDx% H 1 0.980 . B 35 LEU HG H 1 1.630 . B 35 LEU C C 13 175.560 . B 35 LEU CA C 13 52.710 . B 35 LEU CB C 13 41.280 . B 35 LEU CDx C 13 24.550 . B 35 LEU CG C 13 26.820 . B 35 LEU N N 15 123.00 . B 36 PRO HA H 1 4.850 . B 36 PRO HBy H 1 2.420 . B 36 PRO HBx H 1 2.190 . B 36 PRO HDy H 1 3.640 . B 36 PRO HDx H 1 3.580 . B 36 PRO HGy H 1 2.050 . B 36 PRO HGx H 1 1.890 . B 36 PRO C C 13 176.970 . B 36 PRO CA C 13 62.690 . B 36 PRO CB C 13 31.420 . B 36 PRO CD C 13 49.550 . B 36 PRO CG C 13 26.050 . B 37 SER H H 1 8.280 . B 37 SER HA H 1 4.520 . B 37 SER HBx H 1 3.920 . B 37 SER C C 13 174.580 . B 37 SER CA C 13 55.870 . B 37 SER CB C 13 63.360 . B 37 SER N N 15 115.170 . B 38 GLN H H 1 8.310 . B 38 GLN HA H 1 4.410 . B 38 GLN HBx H 1 2.200 . B 38 GLN HGx H 1 2.330 . B 38 GLN HGy H 1 2.330 . B 38 GLN C C 13 174.650 . B 38 GLN CA C 13 55.550 . B 38 GLN CB C 13 29.190 . B 38 GLN CG C 13 33.360 . B 38 GLN N N 15 122.270 . B 39 ALA H H 1 7.970 . B 39 ALA HA H 1 4.180 . B 39 ALA HB% H 1 1.380 . B 39 ALA CA C 13 53.490 . B 39 ALA CB C 13 19.550 . B 39 ALA N N 15 130.950 . 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 GLN HA A 3 GLN HGx 1.0 2.3 6.5 2 1 A 3 GLN HA A 3 GLN HGy 1.0 2.3 6.5 3 2 A 3 GLN HBx A 4 SER HBx 1.0 2.3 5.0 4 2 A 3 GLN HBy A 4 SER HBx 1.0 2.3 5.0 5 2 A 4 SER HBy A 3 GLN HBx 1.0 2.3 5.0 6 2 A 3 GLN HBy A 4 SER HBy 1.0 2.3 5.0 7 3 A 3 GLN HA A 4 SER HA 1.0 2.3 6.5 8 4 A 3 GLN HA A 7 ASP HA 1.0 2.8 5.0 9 5 A 3 GLN HGy A 7 ASP HBx 1.0 2.3 6.5 10 5 A 7 ASP HBy A 3 GLN HGx 1.0 2.3 6.5 11 5 A 3 GLN HGy A 7 ASP HBy 1.0 2.3 6.5 12 5 A 3 GLN HGx A 7 ASP HBx 1.0 2.3 6.5 13 6 A 11 LEU HDx% A 3 GLN HGx 1.0 2.3 6.0 14 6 A 3 GLN HGy A 11 LEU HDx% 1.0 2.3 6.0 15 7 A 4 SER HA A 5 PRO HDx 1.0 1.8 2.9 16 8 A 5 PRO HDx A 5 PRO HBx 1.0 1.8 5.0 17 9 A 5 PRO HA A 5 PRO HGx 1.0 1.8 3.4 18 9 A 5 PRO HA A 5 PRO HGy 1.0 1.8 3.4 19 10 A 5 PRO HA A 5 PRO HDy 1.0 2.3 7.0 20 10 A 5 PRO HA A 5 PRO HDx 1.0 2.3 7.0 21 11 A 6 GLY HAy A 5 PRO HDy 1.0 2.3 4.0 22 11 A 5 PRO HDy A 6 GLY HAx 1.0 2.3 4.0 23 12 A 6 GLY HAy A 5 PRO HBy 1.0 1.8 5.0 24 12 A 5 PRO HBy A 6 GLY HAx 1.0 1.8 5.0 25 13 A 5 PRO HA A 6 GLY HAx 1.0 1.8 5.5 26 13 A 5 PRO HA A 6 GLY HAy 1.0 1.8 5.5 27 14 A 7 ASP HA A 5 PRO HA 1.0 2.5 6.5 28 15 A 8 SER HBy A 5 PRO HBx 1.0 2.3 6.5 29 15 A 5 PRO HBx A 8 SER HBx 1.0 2.3 6.5 30 16 A 8 SER HBy A 5 PRO HGx 1.0 2.8 3.9 31 16 A 5 PRO HGx A 8 SER HBx 1.0 2.8 3.9 32 17 A 5 PRO HA A 8 SER HA 1.0 2.8 4.1 33 18 A 7 ASP HA A 6 GLY HAx 1.0 1.8 5.0 34 18 A 7 ASP HA A 6 GLY HAy 1.0 1.8 5.0 35 19 A 6 GLY HAx A 7 ASP HBx 1.0 2.3 6.5 36 19 A 6 GLY HAy A 7 ASP HBx 1.0 2.3 6.5 37 19 A 7 ASP HBy A 6 GLY HAx 1.0 2.3 6.5 38 19 A 7 ASP HBy A 6 GLY HAy 1.0 2.3 6.5 39 20 A 6 GLY HAy A 9 ARG HGx 1.0 2.3 7.0 40 20 A 6 GLY HAx A 9 ARG HGx 1.0 2.3 7.0 41 20 A 9 ARG HGy A 6 GLY HAx 1.0 2.3 7.0 42 20 A 6 GLY HAy A 9 ARG HGy 1.0 2.3 7.0 43 21 A 6 GLY HAx A 10 ARG HDy 1.0 2.3 7.0 44 21 A 6 GLY HAy A 10 ARG HDy 1.0 2.3 7.0 45 21 A 10 ARG HDx A 6 GLY HAx 1.0 2.3 7.0 46 21 A 6 GLY HAy A 10 ARG HDx 1.0 2.3 7.0 47 22 A 7 ASP HBy A 8 SER HBx 1.0 2.3 7.5 48 22 A 7 ASP HBx A 8 SER HBx 1.0 2.3 7.5 49 22 A 8 SER HBy A 7 ASP HBx 1.0 2.3 7.5 50 22 A 7 ASP HBy A 8 SER HBy 1.0 2.3 7.5 51 23 A 7 ASP HA A 8 SER HA 1.0 2.3 6.5 52 24 A 7 ASP HBx A 10 ARG HDy 1.0 2.3 7.0 53 24 A 7 ASP HBy A 10 ARG HDy 1.0 2.3 7.0 54 24 A 10 ARG HDx A 7 ASP HBx 1.0 2.3 7.0 55 24 A 7 ASP HBy A 10 ARG HDx 1.0 2.3 7.0 56 25 A 11 LEU HDx% A 7 ASP HBx 1.0 2.3 7.0 57 25 A 7 ASP HBy A 11 LEU HDx% 1.0 2.3 7.0 58 26 A 11 LEU HG A 7 ASP HBx 1.0 2.3 6.5 59 26 A 7 ASP HBy A 11 LEU HG 1.0 2.3 6.5 60 27 A 8 SER HBy A 10 ARG HDy 1.0 2.3 7.5 61 27 A 8 SER HBx A 10 ARG HDy 1.0 2.3 7.5 62 27 A 10 ARG HDx A 8 SER HBx 1.0 2.3 7.5 63 27 A 8 SER HBy A 10 ARG HDx 1.0 2.3 7.5 64 28 A 8 SER HA A 11 LEU HBy 1.0 1.8 3.1 65 29 A 8 SER HA A 11 LEU HBx 1.0 2.3 3.6 66 30 A 8 SER HA A 11 LEU HG 1.0 1.8 5.0 67 31 A 9 ARG HA A 9 ARG HGx 1.0 1.8 3.4 68 31 A 9 ARG HGy A 9 ARG HA 1.0 1.8 3.4 69 32 A 9 ARG HBy A 13 ILE HG1y 1.0 2.3 6.5 70 33 A 10 ARG HA A 10 ARG HDy 1.0 1.8 5.5 71 33 A 10 ARG HDx A 10 ARG HA 1.0 1.8 5.5 72 34 A 10 ARG HA A 10 ARG HGx 1.0 1.8 3.4 73 34 A 10 ARG HA A 10 ARG HGy 1.0 1.8 3.4 74 35 A 13 ILE HG2% A 10 ARG HDy 1.0 2.3 7.5 75 35 A 10 ARG HDx A 13 ILE HG2% 1.0 2.3 7.5 76 36 A 11 LEU HDx% A 11 LEU HA 1.0 2.8 4.4 77 37 A 11 LEU HDx% A 11 LEU HBy 1.0 2.3 3.9 78 38 A 11 LEU HDx% A 11 LEU HBx 1.0 2.8 4.4 79 39 A 11 LEU HDx% A 12 SER HBy 1.0 2.3 6.5 80 39 A 11 LEU HDx% A 12 SER HBx 1.0 2.3 6.5 81 40 A 11 LEU HBx A 15 ARG HBx 1.0 2.3 5.5 82 41 A 13 ILE HA A 12 SER HBy 1.0 2.3 7.0 83 41 A 12 SER HBx A 13 ILE HA 1.0 2.3 7.0 84 42 A 13 ILE HB A 12 SER HBy 1.0 1.8 5.5 85 42 A 12 SER HBx A 13 ILE HB 1.0 1.8 5.5 86 43 A 13 ILE HG2% A 12 SER HBy 1.0 2.8 5.5 87 43 A 13 ILE HG2% A 12 SER HBx 1.0 2.8 5.5 88 44 A 12 SER HA A 15 ARG HDx 1.0 3.3 5.5 89 44 A 12 SER HA A 15 ARG HDy 1.0 3.3 5.5 90 45 A 13 ILE HG2% A 13 ILE HA 1.0 2.3 3.9 91 46 A 13 ILE HA A 13 ILE HD1% 1.0 2.3 6.0 92 47 A 13 ILE HB A 13 ILE HD1% 1.0 2.8 4.4 93 48 A 13 ILE HG2% A 14 GLN HBx 1.0 2.3 7.5 94 48 A 13 ILE HG2% A 14 GLN HBy 1.0 2.3 7.5 95 49 A 13 ILE HB A 14 GLN HA 1.0 2.8 5.0 96 50 A 14 GLN HA A 13 ILE HG1x 1.0 2.3 3.6 97 51 A 13 ILE HD1% A 14 GLN HA 1.0 2.3 6.5 98 52 A 13 ILE HA A 16 ALA HB% 1.0 2.3 3.9 99 53 A 13 ILE HB A 16 ALA HB% 1.0 2.8 4.4 100 54 A 16 ALA HB% A 13 ILE HG1x 1.0 2.8 5.0 101 55 A 16 ALA HB% A 13 ILE HG1y 1.0 3.3 5.5 102 56 A 13 ILE HD1% A 16 ALA HB% 1.0 2.3 7.5 103 57 A 13 ILE HG2% A 17 ILE HD1% 1.0 3.8 5.9 104 58 A 17 ILE HD1% A 13 ILE HG1y 1.0 3.3 5.4 105 59 A 13 ILE HD1% A 17 ILE HD1% 1.0 2.8 4.9 106 60 A 14 GLN HA A 14 GLN HGx 1.0 1.8 3.4 107 60 A 14 GLN HA A 14 GLN HGy 1.0 1.8 3.4 108 61 A 16 ALA HB% A 14 GLN HBx 1.0 2.3 6.5 109 61 A 14 GLN HBy A 16 ALA HB% 1.0 2.3 6.5 110 62 A 15 ARG HA A 15 ARG HDx 1.0 2.3 4.5 111 62 A 15 ARG HDy A 15 ARG HA 1.0 2.3 4.5 112 63 A 15 ARG HA A 15 ARG HGy 1.0 1.8 3.4 113 63 A 15 ARG HA A 15 ARG HGx 1.0 1.8 3.4 114 64 A 16 ALA HB% A 15 ARG HA 1.0 1.8 5.5 115 65 A 16 ALA HB% A 17 ILE HA 1.0 1.8 5.5 116 66 A 16 ALA HB% A 17 ILE HB 1.0 2.8 4.4 117 67 A 16 ALA HB% A 17 ILE HG1x 1.0 2.8 4.4 118 68 A 16 ALA HB% A 17 ILE HG1y 1.0 1.8 3.4 119 69 A 16 ALA HB% A 17 ILE HD1% 1.0 3.3 5.4 120 70 A 16 ALA HA A 18 GLN HBx 1.0 2.8 5.0 121 70 A 16 ALA HA A 18 GLN HBy 1.0 2.8 5.0 122 71 A 16 ALA HA A 19 SER HA 1.0 2.3 6.5 123 72 A 16 ALA HA A 39 MET HGy 1.0 2.8 5.0 124 73 A 17 ILE HA A 17 ILE HG2% 1.0 2.8 5.0 125 74 A 17 ILE HD1% A 17 ILE HA 1.0 2.8 5.0 126 75 A 17 ILE HD1% A 17 ILE HB 1.0 2.8 4.4 127 76 A 17 ILE HG2% A 18 GLN HA 1.0 2.3 7.0 128 77 A 17 ILE HG2% A 18 GLN HGx 1.0 2.3 7.5 129 77 A 17 ILE HG2% A 18 GLN HGy 1.0 2.3 7.5 130 78 A 17 ILE HD1% A 18 GLN HA 1.0 2.3 5.9 131 79 A 17 ILE HD1% A 20 LEU HA 1.0 2.3 6.5 132 80 A 17 ILE HD1% A 20 LEU HDy% 1.0 2.8 4.9 133 81 A 17 ILE HD1% A 20 LEU HDx% 1.0 2.8 4.9 134 82 A 17 ILE HD1% A 21 VAL HA 1.0 2.8 5.0 135 83 A 17 ILE HD1% A 21 VAL HGx% 1.0 2.8 4.9 136 84 A 17 ILE HB A 66 LEU HG 1.0 2.3 6.5 137 85 A 17 ILE HD1% A 70 HIS HA 1.0 2.3 7.0 138 86 A 18 GLN HA A 18 GLN HGx 1.0 1.8 5.0 139 87 A 18 GLN HA A 18 GLN HGx 1.0 2.3 4.5 140 87 A 18 GLN HA A 18 GLN HGy 1.0 2.3 4.5 141 88 A 18 GLN HA A 21 VAL HGx% 1.0 2.8 4.4 142 89 A 20 LEU HDx% A 19 SER HBx 1.0 2.3 6.5 143 90 A 20 LEU HBx A 19 SER HBx 1.0 1.8 5.0 144 91 A 19 SER HBy A 22 HIS HBy 1.0 1.8 5.0 145 92 A 19 SER HA A 22 HIS HA 1.0 3.3 5.0 146 93 A 19 SER HA A 22 HIS HBy 1.0 1.8 3.4 147 93 A 19 SER HA A 22 HIS HBx 1.0 1.8 3.4 148 94 A 19 SER HBx A 39 MET HBx 1.0 2.3 6.5 149 95 A 39 MET HBy A 19 SER HBx 1.0 1.8 5.0 150 96 A 39 MET HGy A 19 SER HBx 1.0 1.8 3.1 151 97 A 39 MET HGy A 19 SER HBy 1.0 1.8 5.0 152 98 A 20 LEU HA A 20 LEU HDx% 1.0 2.8 4.4 153 99 A 20 LEU HA A 20 LEU HDy% 1.0 2.8 4.4 154 100 A 20 LEU HA A 20 LEU HG 1.0 2.3 3.5 155 101 A 20 LEU HDy% A 20 LEU HBx 1.0 2.3 3.9 156 102 A 20 LEU HDx% A 20 LEU HBx 1.0 2.8 4.4 157 103 A 20 LEU HA A 23 ALA HB% 1.0 1.8 3.4 158 104 A 20 LEU HDy% A 23 ALA HB% 1.0 3.8 6.5 159 105 A 20 LEU HDx% A 24 ALA HA 1.0 2.8 5.0 160 106 A 20 LEU HDx% A 43 VAL HGx% 1.0 2.3 6.5 161 107 A 20 LEU HDx% A 63 LEU HG 1.0 2.8 5.0 162 108 A 66 LEU HG A 20 LEU HBx 1.0 2.8 5.0 163 109 A 20 LEU HDx% A 81 VAL HGy% 1.0 2.3 7.5 164 110 A 21 VAL HA A 21 VAL HGx% 1.0 2.8 4.4 165 111 A 81 VAL HGy% A 21 VAL HB 1.0 2.3 6.0 166 112 A 23 ALA HB% A 22 HIS HBy 1.0 2.8 4.9 167 112 A 22 HIS HBx A 23 ALA HB% 1.0 2.8 4.9 168 113 A 24 ALA HB% A 22 HIS HBy 1.0 2.3 6.5 169 113 A 22 HIS HBx A 24 ALA HB% 1.0 2.3 6.5 170 114 A 22 HIS HA A 26 CYS HBx 1.0 2.3 7.0 171 114 A 22 HIS HA A 26 CYS HBy 1.0 2.3 7.0 172 115 A 23 ALA HB% A 24 ALA HB% 1.0 2.8 4.9 173 116 A 23 ALA HB% A 40 LYS HA 1.0 2.8 4.4 174 117 A 24 ALA HB% A 25 GLN HGx 1.0 2.3 7.0 175 118 A 24 ALA HB% A 25 GLN HBy 1.0 2.3 3.9 176 119 A 24 ALA HB% A 25 GLN HBx 1.0 1.8 5.5 177 120 A 25 GLN HGx A 25 GLN HA 1.0 1.8 5.0 178 121 A 25 GLN HBx A 26 CYS HA 1.0 2.8 5.0 179 122 A 25 GLN HBy A 26 CYS HA 1.0 2.3 6.5 180 123 A 25 GLN HBx A 26 CYS HBx 1.0 1.8 5.5 181 123 A 26 CYS HBy A 25 GLN HBx 1.0 1.8 5.5 182 124 A 25 GLN HA A 27 ARG HBx 1.0 2.8 5.0 183 125 A 25 GLN HA A 80 PRO HDx 1.0 3.3 5.0 184 126 A 25 GLN HGy A 80 PRO HBx 1.0 2.0 5.0 185 127 A 25 GLN HA A 80 PRO HGx 1.0 2.3 6.5 186 128 A 26 CYS HA A 27 ARG HBy 1.0 2.3 5.5 187 129 A 26 CYS HBy A 27 ARG HBx 1.0 2.5 6.5 188 129 A 27 ARG HBx A 26 CYS HBx 1.0 2.5 6.5 189 130 A 26 CYS HBy A 40 LYS HEx 1.0 2.3 7.0 190 130 A 26 CYS HBx A 40 LYS HEx 1.0 2.3 7.0 191 130 A 40 LYS HEy A 26 CYS HBx 1.0 2.3 7.0 192 130 A 26 CYS HBy A 40 LYS HEy 1.0 2.3 7.0 193 131 A 27 ARG HA A 27 ARG HDx 1.0 1.8 3.4 194 131 A 27 ARG HA A 27 ARG HDy 1.0 1.8 3.4 195 132 A 27 ARG HDy A 27 ARG HBx 1.0 2.3 4.5 196 132 A 27 ARG HBx A 27 ARG HDx 1.0 2.3 4.5 197 133 A 27 ARG HDy A 27 ARG HBy 1.0 2.3 4.5 198 133 A 27 ARG HBy A 27 ARG HDx 1.0 2.3 4.5 199 134 A 29 ALA HB% A 27 ARG HGx 1.0 1.8 3.9 200 134 A 27 ARG HGy A 29 ALA HB% 1.0 1.8 3.9 201 135 A 27 ARG HA A 40 LYS HDx 1.0 2.3 4.0 202 135 A 27 ARG HA A 40 LYS HDy 1.0 2.3 4.0 203 136 A 29 ALA HB% A 28 ASN HA 1.0 2.3 4.5 204 137 A 29 ALA HB% A 28 ASN HBx 1.0 2.3 7.0 205 138 A 28 ASN HBx A 31 CYS HA 1.0 1.8 5.0 206 139 A 28 ASN HBx A 31 CYS HBx 1.0 1.8 2.9 207 139 A 28 ASN HBx A 31 CYS HBy 1.0 1.8 2.9 208 140 A 30 ASN HBy A 31 CYS HBx 1.0 2.3 6.5 209 140 A 31 CYS HBy A 30 ASN HBy 1.0 2.3 6.5 210 141 A 31 CYS HA A 32 SER HBx 1.0 2.8 4.4 211 141 A 31 CYS HA A 32 SER HBy 1.0 2.8 4.4 212 142 A 31 CYS HA A 36 CYS HBx 1.0 1.8 5.0 213 143 A 36 CYS HBx A 31 CYS HBx 1.0 1.8 5.0 214 143 A 31 CYS HBy A 36 CYS HBx 1.0 1.8 5.0 215 144 A 36 CYS HBy A 31 CYS HBx 1.0 1.8 2.9 216 144 A 31 CYS HBy A 36 CYS HBy 1.0 1.8 2.9 217 145 A 37 GLN HGx A 31 CYS HBx 1.0 2.3 6.5 218 145 A 31 CYS HBy A 37 GLN HGx 1.0 2.3 6.5 219 146 A 37 GLN HGy A 31 CYS HBx 1.0 2.3 6.5 220 146 A 31 CYS HBy A 37 GLN HGy 1.0 2.3 6.5 221 147 A 31 CYS HBy A 40 LYS HEx 1.0 1.8 5.0 222 147 A 31 CYS HBx A 40 LYS HEx 1.0 1.8 5.0 223 147 A 40 LYS HEy A 31 CYS HBx 1.0 1.8 5.0 224 147 A 40 LYS HEy A 31 CYS HBy 1.0 1.8 5.0 225 148 A 32 SER HA A 33 LEU HA 1.0 1.8 5.0 226 149 A 33 LEU HA A 32 SER HBx 1.0 2.8 4.4 227 149 A 32 SER HBy A 33 LEU HA 1.0 2.8 4.4 228 150 A 32 SER HA A 34 PRO HDx 1.0 2.3 6.5 229 150 A 32 SER HA A 34 PRO HDy 1.0 2.3 6.5 230 151 A 34 PRO HA A 32 SER HBx 1.0 2.3 6.5 231 151 A 32 SER HBy A 34 PRO HA 1.0 2.3 6.5 232 152 A 33 LEU HA A 33 LEU HDy% 1.0 2.8 4.4 233 153 A 33 LEU HA A 33 LEU HG 1.0 2.3 6.5 234 154 A 33 LEU HDx% A 33 LEU HBy 1.0 2.3 4.4 235 155 A 33 LEU HDy% A 33 LEU HBy 1.0 2.8 4.4 236 156 A 34 PRO HDy A 33 LEU HBy 1.0 2.3 7.0 237 156 A 33 LEU HBy A 34 PRO HDx 1.0 2.3 7.0 238 157 A 33 LEU HA A 34 PRO HDx 1.0 1.8 3.4 239 157 A 33 LEU HA A 34 PRO HDy 1.0 1.8 3.4 240 158 A 33 LEU HDy% A 34 PRO HDx 1.0 1.8 6.0 241 158 A 34 PRO HDy A 33 LEU HDy% 1.0 1.8 6.0 242 159 A 33 LEU HA A 34 PRO HGx 1.0 2.3 6.5 243 160 A 36 CYS HA A 33 LEU HBx 1.0 2.3 6.5 244 161 A 34 PRO HBy A 35 SER HBy 1.0 1.8 5.5 245 161 A 34 PRO HBy A 35 SER HBx 1.0 1.8 5.5 246 162 A 34 PRO HGy A 37 GLN HBx 1.0 2.5 6.5 247 162 A 34 PRO HGy A 37 GLN HBy 1.0 2.5 6.5 248 163 A 36 CYS HBy A 35 SER HBy 1.0 2.3 6.5 249 164 A 36 CYS HBx A 35 SER HBy 1.0 2.3 6.5 250 165 A 36 CYS HBx A 35 SER HA 1.0 2.3 6.5 251 166 A 36 CYS HBy A 35 SER HBy 1.0 2.3 4.5 252 166 A 36 CYS HBy A 35 SER HBx 1.0 2.3 4.5 253 167 A 36 CYS HBx A 35 SER HBy 1.0 2.3 7.0 254 167 A 36 CYS HBx A 35 SER HBx 1.0 2.3 7.0 255 168 A 38 LYS HBy A 35 SER HBy 1.0 2.3 7.0 256 168 A 35 SER HBx A 38 LYS HBy 1.0 2.3 7.0 257 169 A 35 SER HA A 38 LYS HBy 1.0 1.8 2.9 258 170 A 36 CYS HBy A 39 MET HBy 1.0 2.8 5.0 259 171 A 36 CYS HBx A 40 LYS HEx 1.0 2.3 6.5 260 171 A 40 LYS HEy A 36 CYS HBx 1.0 2.3 6.5 261 172 A 36 CYS HBy A 40 LYS HEx 1.0 2.8 4.1 262 172 A 40 LYS HEy A 36 CYS HBy 1.0 2.8 4.1 263 173 A 37 GLN HBy A 38 LYS HA 1.0 2.8 4.1 264 174 A 38 LYS HA A 37 GLN HBx 1.0 2.8 4.1 265 175 A 37 GLN HGy A 40 LYS HDx 1.0 2.3 4.0 266 175 A 40 LYS HDy A 37 GLN HGy 1.0 2.3 4.0 267 176 A 37 GLN HA A 40 LYS HBx 1.0 1.8 5.0 268 177 A 38 LYS HA A 38 LYS HDx 1.0 1.8 3.4 269 177 A 38 LYS HA A 38 LYS HDy 1.0 1.8 3.4 270 178 A 38 LYS HA A 38 LYS HGy 1.0 1.8 3.4 271 178 A 38 LYS HA A 38 LYS HGx 1.0 1.8 3.4 272 179 A 39 MET HGy A 38 LYS HEx 1.0 1.8 5.0 273 179 A 39 MET HGy A 38 LYS HEy 1.0 1.8 5.0 274 180 A 39 MET HA A 38 LYS HDx 1.0 1.8 3.0 275 180 A 38 LYS HDy A 39 MET HA 1.0 1.8 3.0 276 181 A 40 LYS HA A 38 LYS HDx 1.0 3.3 6.5 277 181 A 40 LYS HA A 38 LYS HDy 1.0 3.3 6.5 278 182 A 38 LYS HA A 41 ARG HDx 1.0 1.8 3.4 279 182 A 38 LYS HA A 41 ARG HDy 1.0 1.8 3.4 280 183 A 38 LYS HA A 41 ARG HBx 1.0 1.8 3.0 281 184 A 38 LYS HA A 42 VAL HGy% 1.0 2.8 4.4 282 185 A 39 MET HGy A 39 MET HA 1.0 2.3 3.6 283 186 A 39 MET HA A 42 VAL HGx% 1.0 2.8 4.4 284 187 A 42 VAL HB A 39 MET HBx 1.0 2.8 3.9 285 188 A 39 MET HA A 42 VAL HB 1.0 2.3 4.0 286 189 A 42 VAL HB A 39 MET HGx 1.0 2.8 5.0 287 190 A 63 LEU HDx% A 39 MET HBx 1.0 2.3 6.0 288 191 A 40 LYS HA A 40 LYS HGx 1.0 2.3 4.0 289 191 A 40 LYS HA A 40 LYS HGy 1.0 2.3 4.0 290 192 A 40 LYS HA A 40 LYS HDx 1.0 1.8 5.5 291 192 A 40 LYS HA A 40 LYS HDy 1.0 1.8 5.5 292 193 A 40 LYS HBx A 40 LYS HDx 1.0 1.8 2.9 293 193 A 40 LYS HDy A 40 LYS HBx 1.0 1.8 2.9 294 194 A 40 LYS HA A 41 ARG HBy 1.0 2.3 5.5 295 195 A 42 VAL HGy% A 40 LYS HGx 1.0 2.5 6.5 296 195 A 42 VAL HGy% A 40 LYS HGy 1.0 2.5 6.5 297 196 A 43 VAL HGx% A 40 LYS HA 1.0 2.8 5.0 298 197 A 40 LYS HA A 43 VAL HB 1.0 2.3 4.1 299 198 A 40 LYS HDx A 44 GLN HGx 1.0 2.3 3.6 300 198 A 40 LYS HDy A 44 GLN HGx 1.0 2.3 3.6 301 198 A 44 GLN HGy A 40 LYS HDx 1.0 2.3 3.6 302 198 A 40 LYS HDy A 44 GLN HGy 1.0 2.3 3.6 303 199 A 40 LYS HBx A 44 GLN HBx 1.0 2.3 3.5 304 199 A 40 LYS HBx A 44 GLN HBy 1.0 2.3 3.5 305 200 A 40 LYS HA A 44 GLN HBx 1.0 2.8 4.1 306 200 A 40 LYS HA A 44 GLN HBy 1.0 2.8 4.1 307 201 A 41 ARG HBx A 41 ARG HDx 1.0 1.8 3.4 308 201 A 41 ARG HDy A 41 ARG HBx 1.0 1.8 3.4 309 202 A 41 ARG HBy A 41 ARG HDx 1.0 1.8 3.4 310 202 A 41 ARG HDy A 41 ARG HBy 1.0 1.8 3.4 311 203 A 41 ARG HA A 41 ARG HGx 1.0 1.8 3.4 312 203 A 41 ARG HGy A 41 ARG HA 1.0 1.8 3.4 313 204 A 42 VAL HGy% A 41 ARG HBy 1.0 2.8 4.4 314 205 A 43 VAL HB A 41 ARG HA 1.0 2.3 6.5 315 206 A 41 ARG HA A 44 GLN HBx 1.0 1.8 3.0 316 206 A 44 GLN HBy A 41 ARG HA 1.0 1.8 3.0 317 207 A 41 ARG HBx A 44 GLN HBx 1.0 2.5 5.5 318 207 A 41 ARG HBx A 44 GLN HBy 1.0 2.5 5.5 319 208 A 41 ARG HGx A 44 GLN HBx 1.0 2.3 7.0 320 208 A 41 ARG HGy A 44 GLN HBx 1.0 2.3 7.0 321 208 A 44 GLN HBy A 41 ARG HGx 1.0 2.3 7.0 322 208 A 44 GLN HBy A 41 ARG HGy 1.0 2.3 7.0 323 209 A 41 ARG HBx A 59 ILE HD1% 1.0 2.3 6.5 324 210 A 42 VAL HGx% A 45 HIS HBx 1.0 2.3 7.0 325 210 A 42 VAL HGx% A 45 HIS HBy 1.0 2.3 7.0 326 211 A 59 ILE HD1% A 42 VAL HA 1.0 2.3 6.0 327 212 A 42 VAL HGx% A 59 ILE HD1% 1.0 2.3 6.5 328 213 A 42 VAL HGx% A 62 GLN HBx 1.0 2.3 7.5 329 213 A 42 VAL HGx% A 62 GLN HBy 1.0 2.3 7.5 330 214 A 42 VAL HGx% A 63 LEU HBy 1.0 2.8 5.0 331 214 A 42 VAL HGx% A 63 LEU HBx 1.0 2.8 5.0 332 215 A 42 VAL HB A 63 LEU HDx% 1.0 2.3 6.0 333 216 A 42 VAL HGx% A 63 LEU HDx% 1.0 2.8 4.9 334 217 A 42 VAL HGx% A 66 LEU HDy% 1.0 2.3 7.0 335 218 A 43 VAL HGx% A 43 VAL HA 1.0 2.3 3.9 336 219 A 43 VAL HGx% A 44 GLN HGx 1.0 2.8 5.0 337 219 A 43 VAL HGx% A 44 GLN HGy 1.0 2.8 5.0 338 220 A 43 VAL HA A 46 THR HG2% 1.0 2.3 6.0 339 221 A 43 VAL HGx% A 47 LYS HEx 1.0 2.8 4.9 340 221 A 43 VAL HGx% A 47 LYS HEy 1.0 2.8 4.9 341 222 A 43 VAL HGx% A 47 LYS HBx 1.0 2.3 6.0 342 222 A 43 VAL HGx% A 47 LYS HBy 1.0 2.3 6.0 343 223 A 43 VAL HB A 47 LYS HEx 1.0 2.3 7.0 344 223 A 43 VAL HB A 47 LYS HEy 1.0 2.3 7.0 345 224 A 43 VAL HGx% A 47 LYS HDx 1.0 2.3 4.9 346 224 A 43 VAL HGx% A 47 LYS HDy 1.0 2.3 4.9 347 225 A 43 VAL HGx% A 63 LEU HDy% 1.0 2.8 4.9 348 226 A 43 VAL HGx% A 82 PRO HBy 1.0 2.0 5.0 349 227 A 43 VAL HGx% A 82 PRO HBx 1.0 2.3 6.0 350 228 A 44 GLN HA A 44 GLN HGx 1.0 1.8 3.4 351 228 A 44 GLN HGy A 44 GLN HA 1.0 1.8 3.4 352 229 A 44 GLN HA A 47 LYS HEx 1.0 2.8 4.4 353 229 A 47 LYS HEy A 44 GLN HA 1.0 2.8 4.4 354 230 A 46 THR HG2% A 46 THR HA 1.0 2.3 3.9 355 231 A 46 THR HG2% A 47 LYS HGx 1.0 2.8 4.9 356 231 A 46 THR HG2% A 47 LYS HGy 1.0 2.8 4.9 357 232 A 46 THR HG2% A 52 LYS HGy 1.0 2.8 4.4 358 233 A 46 THR HG2% A 52 LYS HDx 1.0 2.8 4.9 359 233 A 46 THR HG2% A 52 LYS HDy 1.0 2.8 4.9 360 234 A 59 ILE HD1% A 46 THR HA 1.0 2.3 6.5 361 235 A 46 THR HG2% A 60 CYS HA 1.0 2.8 5.0 362 236 A 46 THR HG2% A 63 LEU HBy 1.0 2.8 4.9 363 236 A 63 LEU HBx A 46 THR HG2% 1.0 2.8 4.9 364 237 A 46 THR HG2% A 63 LEU HDy% 1.0 2.8 4.9 365 238 A 47 LYS HA A 47 LYS HEx 1.0 1.8 5.5 366 238 A 47 LYS HEy A 47 LYS HA 1.0 1.8 5.5 367 239 A 47 LYS HA A 47 LYS HGx 1.0 2.3 3.4 368 239 A 47 LYS HGy A 47 LYS HA 1.0 2.3 3.4 369 240 A 47 LYS HBx A 47 LYS HEx 1.0 1.8 3.4 370 240 A 47 LYS HBy A 47 LYS HEx 1.0 1.8 3.4 371 240 A 47 LYS HEy A 47 LYS HBx 1.0 1.8 3.4 372 240 A 47 LYS HEy A 47 LYS HBy 1.0 1.8 3.4 373 241 A 47 LYS HA A 47 LYS HDx 1.0 2.8 4.4 374 241 A 47 LYS HDy A 47 LYS HA 1.0 2.8 4.4 375 242 A 47 LYS HA A 50 LYS HDx 1.0 1.8 5.5 376 242 A 47 LYS HA A 50 LYS HDy 1.0 1.8 5.5 377 243 A 47 LYS HA A 52 LYS HGx 1.0 2.8 5.0 378 244 A 47 LYS HGy A 52 LYS HEy 1.0 2.3 6.5 379 244 A 47 LYS HGx A 52 LYS HEy 1.0 2.3 6.5 380 244 A 52 LYS HEx A 47 LYS HGx 1.0 2.3 6.5 381 244 A 47 LYS HGy A 52 LYS HEx 1.0 2.3 6.5 382 245 A 82 PRO HBx A 47 LYS HEx 1.0 2.3 7.0 383 245 A 47 LYS HEy A 82 PRO HBx 1.0 2.3 7.0 384 246 A 82 PRO HBy A 47 LYS HEx 1.0 2.3 7.0 385 246 A 47 LYS HEy A 82 PRO HBy 1.0 2.3 7.0 386 247 A 57 CYS HBy A 49 CYS HBx 1.0 2.3 6.5 387 247 A 49 CYS HBy A 57 CYS HBy 1.0 2.3 6.5 388 248 A 60 CYS HBy A 49 CYS HBx 1.0 3.3 5.5 389 248 A 49 CYS HBy A 60 CYS HBy 1.0 3.3 5.5 390 249 A 50 LYS HBx A 50 LYS HDx 1.0 1.8 3.9 391 249 A 50 LYS HDy A 50 LYS HBx 1.0 1.8 3.9 392 249 A 50 LYS HDy A 50 LYS HBy 1.0 1.8 3.9 393 249 A 50 LYS HBy A 50 LYS HDx 1.0 1.8 3.9 394 250 A 51 ARG HA A 50 LYS HBx 1.0 2.8 5.5 395 250 A 50 LYS HBy A 51 ARG HA 1.0 2.8 5.5 396 251 A 51 ARG HA A 51 ARG HDx 1.0 1.8 5.5 397 251 A 51 ARG HA A 51 ARG HDy 1.0 1.8 5.5 398 252 A 51 ARG HBy A 51 ARG HDx 1.0 1.8 5.5 399 252 A 51 ARG HDy A 51 ARG HBx 1.0 1.8 5.5 400 252 A 51 ARG HDy A 51 ARG HBy 1.0 1.8 5.5 401 252 A 51 ARG HBx A 51 ARG HDx 1.0 1.8 5.5 402 253 A 51 ARG HA A 51 ARG HGx 1.0 1.8 5.5 403 253 A 51 ARG HA A 51 ARG HGy 1.0 1.8 5.5 404 254 A 52 LYS HA A 51 ARG HBx 1.0 2.8 5.0 405 254 A 51 ARG HBy A 52 LYS HA 1.0 2.8 5.0 406 255 A 51 ARG HDy A 54 ASN HBx 1.0 2.3 6.0 407 255 A 51 ARG HDx A 54 ASN HBx 1.0 2.3 6.0 408 255 A 54 ASN HBy A 51 ARG HDx 1.0 2.3 6.0 409 255 A 51 ARG HDy A 54 ASN HBy 1.0 2.3 6.0 410 256 A 51 ARG HGy A 54 ASN HBx 1.0 2.3 7.0 411 256 A 51 ARG HGx A 54 ASN HBx 1.0 2.3 7.0 412 256 A 54 ASN HBy A 51 ARG HGx 1.0 2.3 7.0 413 256 A 51 ARG HGy A 54 ASN HBy 1.0 2.3 7.0 414 257 A 51 ARG HA A 55 GLY HAx 1.0 2.3 7.0 415 257 A 51 ARG HA A 55 GLY HAy 1.0 2.3 7.0 416 258 A 51 ARG HGy A 55 GLY HAx 1.0 2.3 7.5 417 258 A 55 GLY HAy A 51 ARG HGx 1.0 2.3 7.5 418 258 A 51 ARG HGy A 55 GLY HAy 1.0 2.3 7.5 419 258 A 51 ARG HGx A 55 GLY HAx 1.0 2.3 7.5 420 259 A 51 ARG HDy A 55 GLY HAx 1.0 1.8 6.0 421 259 A 51 ARG HDx A 55 GLY HAx 1.0 1.8 6.0 422 259 A 55 GLY HAy A 51 ARG HDx 1.0 1.8 6.0 423 259 A 51 ARG HDy A 55 GLY HAy 1.0 1.8 6.0 424 260 A 57 CYS HBy A 51 ARG HGx 1.0 2.3 7.0 425 260 A 57 CYS HBy A 51 ARG HGy 1.0 2.3 7.0 426 261 A 52 LYS HGy A 52 LYS HA 1.0 2.3 6.5 427 262 A 52 LYS HA A 52 LYS HEy 1.0 1.8 5.0 428 263 A 52 LYS HA A 52 LYS HDx 1.0 2.8 4.4 429 263 A 52 LYS HDy A 52 LYS HA 1.0 2.8 4.4 430 264 A 52 LYS HGx A 52 LYS HA 1.0 2.3 6.5 431 265 A 52 LYS HGy A 52 LYS HEy 1.0 2.3 3.9 432 265 A 52 LYS HGy A 52 LYS HEx 1.0 2.3 3.9 433 266 A 52 LYS HGx A 52 LYS HEy 1.0 1.8 3.4 434 266 A 52 LYS HGx A 52 LYS HEx 1.0 1.8 3.4 435 267 A 52 LYS HBx A 52 LYS HEy 1.0 2.3 7.5 436 267 A 52 LYS HEx A 52 LYS HBx 1.0 2.3 7.5 437 267 A 52 LYS HEx A 52 LYS HBy 1.0 2.3 7.5 438 267 A 52 LYS HBy A 52 LYS HEy 1.0 2.3 7.5 439 268 A 53 THR HA A 52 LYS HBx 1.0 2.3 7.0 440 268 A 52 LYS HBy A 53 THR HA 1.0 2.3 7.0 441 269 A 52 LYS HGx A 53 THR HA 1.0 2.3 6.5 442 270 A 52 LYS HA A 53 THR HA 1.0 2.3 6.5 443 271 A 52 LYS HBy A 54 ASN HBx 1.0 2.3 7.0 444 271 A 54 ASN HBy A 52 LYS HBx 1.0 2.3 7.0 445 271 A 54 ASN HBy A 52 LYS HBy 1.0 2.3 7.0 446 271 A 52 LYS HBx A 54 ASN HBx 1.0 2.3 7.0 447 272 A 52 LYS HA A 57 CYS HBx 1.0 1.8 5.0 448 273 A 52 LYS HA A 60 CYS HBx 1.0 2.3 6.5 449 274 A 60 CYS HBx A 52 LYS HEy 1.0 2.5 5.5 450 274 A 52 LYS HEx A 60 CYS HBx 1.0 2.5 5.5 451 275 A 53 THR HA A 53 THR HG2% 1.0 2.8 4.4 452 276 A 55 GLY HAx A 56 GLY HAx 1.0 2.8 4.9 453 276 A 55 GLY HAy A 56 GLY HAx 1.0 2.8 4.9 454 276 A 56 GLY HAy A 55 GLY HAx 1.0 2.8 4.9 455 276 A 55 GLY HAy A 56 GLY HAy 1.0 2.8 4.9 456 277 A 57 CYS HBx A 56 GLY HAx 1.0 2.3 7.0 457 277 A 57 CYS HBx A 56 GLY HAy 1.0 2.3 7.0 458 278 A 56 GLY HAy A 61 LYS HEx 1.0 2.3 7.0 459 278 A 56 GLY HAx A 61 LYS HEx 1.0 2.3 7.0 460 278 A 61 LYS HEy A 56 GLY HAx 1.0 2.3 7.0 461 278 A 56 GLY HAy A 61 LYS HEy 1.0 2.3 7.0 462 279 A 56 GLY HAx A 61 LYS HGx 1.0 2.3 7.0 463 279 A 56 GLY HAy A 61 LYS HGx 1.0 2.3 7.0 464 280 A 57 CYS HA A 58 PRO HGy 1.0 2.3 6.5 465 281 A 57 CYS HBx A 58 PRO HGy 1.0 2.3 6.5 466 282 A 60 CYS HBy A 57 CYS HBx 1.0 1.8 3.0 467 283 A 58 PRO HBx A 61 LYS HEx 1.0 2.3 6.5 468 283 A 61 LYS HEy A 58 PRO HBx 1.0 2.3 6.5 469 284 A 59 ILE HD1% A 59 ILE HA 1.0 1.8 5.5 470 285 A 59 ILE HD1% A 59 ILE HB 1.0 2.3 4.4 471 286 A 59 ILE HD1% B 22 LEU HDx% 1.0 2.3 6.5 472 287 A 61 LYS HA A 61 LYS HDx 1.0 2.8 3.9 473 287 A 61 LYS HA A 61 LYS HDy 1.0 2.8 3.9 474 288 A 61 LYS HEy A 61 LYS HBx 1.0 1.8 5.0 475 288 A 61 LYS HBx A 61 LYS HEx 1.0 1.8 5.0 476 289 A 61 LYS HDy A 61 LYS HBy 1.0 2.3 6.5 477 289 A 61 LYS HBy A 61 LYS HDx 1.0 2.3 6.5 478 290 A 62 GLN HA A 61 LYS HBy 1.0 2.3 5.5 479 291 A 62 GLN HA A 61 LYS HDx 1.0 1.8 5.0 480 291 A 61 LYS HDy A 62 GLN HA 1.0 1.8 5.0 481 292 A 61 LYS HA A 64 ILE HD1% 1.0 2.3 7.0 482 293 A 64 ILE HD1% A 61 LYS HBy 1.0 1.8 5.5 483 294 A 64 ILE HB A 61 LYS HBy 1.0 2.3 6.5 484 295 A 61 LYS HA A 65 ALA HB% 1.0 1.8 5.5 485 296 A 62 GLN HA A 62 GLN HGx 1.0 1.8 3.4 486 296 A 62 GLN HA A 62 GLN HGy 1.0 1.8 3.4 487 297 A 62 GLN HA A 63 LEU HBy 1.0 2.3 6.5 488 297 A 63 LEU HBx A 62 GLN HA 1.0 2.3 6.5 489 298 A 63 LEU HDx% A 63 LEU HA 1.0 2.3 3.9 490 299 A 63 LEU HG A 63 LEU HA 1.0 1.8 2.9 491 300 A 63 LEU HDx% A 63 LEU HBy 1.0 2.3 4.5 492 300 A 63 LEU HDx% A 63 LEU HBx 1.0 2.3 4.5 493 301 A 64 ILE HD1% A 63 LEU HBy 1.0 2.3 7.5 494 301 A 63 LEU HBx A 64 ILE HD1% 1.0 2.3 7.5 495 302 A 63 LEU HDx% A 64 ILE HA 1.0 2.8 5.0 496 303 A 64 ILE HA A 64 ILE HG2% 1.0 2.8 4.4 497 304 A 64 ILE HD1% A 64 ILE HA 1.0 2.3 7.0 498 305 A 64 ILE HD1% A 64 ILE HB 1.0 2.3 6.0 499 306 A 65 ALA HB% A 64 ILE HA 1.0 1.8 5.5 500 307 A 65 ALA HB% A 64 ILE HG2% 1.0 3.3 5.4 501 308 A 64 ILE HA A 67 ALA HB% 1.0 2.3 3.9 502 309 A 64 ILE HG2% A 67 ALA HB% 1.0 2.8 4.9 503 310 A 64 ILE HG2% A 67 ALA HA 1.0 2.3 6.5 504 311 A 64 ILE HA A 87 ILE HD1% 1.0 2.8 5.0 505 312 A 64 ILE HG2% A 87 ILE HD1% 1.0 2.8 4.9 506 313 A 67 ALA HB% A 65 ALA HA 1.0 2.8 4.4 507 314 A 65 ALA HB% A 67 ALA HB% 1.0 2.3 6.5 508 315 A 65 ALA HB% A 68 ALA HB% 1.0 2.8 4.9 509 316 A 68 ALA HB% A 66 LEU HDx% 1.0 2.3 6.5 510 317 A 67 ALA HB% A 68 ALA HB% 1.0 2.8 5.5 511 318 A 67 ALA HB% A 71 ALA HB% 1.0 3.3 5.4 512 319 A 67 ALA HA A 81 VAL HGx% 1.0 2.3 6.0 513 320 A 67 ALA HB% A 87 ILE HD1% 1.0 2.8 4.9 514 321 A 68 ALA HA A 69 TYR HA 1.0 2.0 5.0 515 322 A 71 ALA HB% A 68 ALA HA 1.0 2.8 4.4 516 323 A 68 ALA HB% A 71 ALA HB% 1.0 2.8 4.9 517 324 A 87 ILE HD1% A 68 ALA HA 1.0 2.8 4.4 518 325 A 87 ILE HD1% A 68 ALA HB% 1.0 2.8 4.9 519 326 A 68 ALA HB% A 87 ILE HG1y 1.0 2.3 6.5 520 326 A 68 ALA HB% A 87 ILE HG1x 1.0 2.3 6.5 521 327 A 70 HIS HA A 69 TYR HA 1.0 2.8 5.0 522 328 A 71 ALA HB% A 69 TYR HBx 1.0 2.3 6.5 523 328 A 71 ALA HB% A 69 TYR HBy 1.0 2.3 6.5 524 329 A 71 ALA HB% A 70 HIS HBy 1.0 1.8 6.0 525 329 A 71 ALA HB% A 70 HIS HBx 1.0 1.8 6.0 526 330 A 70 HIS HA A 73 HIS HBy 1.0 1.8 5.0 527 331 A 71 ALA HB% A 72 LYS HGx 1.0 1.8 3.9 528 331 A 71 ALA HB% A 72 LYS HGy 1.0 1.8 3.9 529 332 A 71 ALA HA A 72 LYS HA 1.0 2.8 5.0 530 333 A 71 ALA HA A 74 CYS HBx 1.0 2.3 4.5 531 333 A 71 ALA HA A 74 CYS HBy 1.0 2.3 4.5 532 334 A 71 ALA HB% A 84 CYS HBy 1.0 2.3 7.0 533 335 A 71 ALA HB% A 84 CYS HBx 1.0 2.3 7.0 534 336 A 87 ILE HD1% A 71 ALA HB% 1.0 2.8 4.9 535 337 A 71 ALA HB% A 88 LYS HBx 1.0 2.8 4.9 536 337 A 71 ALA HB% A 88 LYS HBy 1.0 2.8 4.9 537 338 A 72 LYS HA A 72 LYS HDx 1.0 2.8 4.4 538 338 A 72 LYS HA A 72 LYS HDy 1.0 2.8 4.4 539 339 A 72 LYS HA A 72 LYS HGx 1.0 1.8 5.5 540 339 A 72 LYS HGy A 72 LYS HA 1.0 1.8 5.5 541 340 A 72 LYS HDy A 72 LYS HBx 1.0 2.8 4.4 542 340 A 72 LYS HBx A 72 LYS HDx 1.0 2.8 4.4 543 341 A 73 HIS HA A 75 GLN HA 1.0 2.5 5.5 544 342 A 75 GLN HA A 75 GLN HGx 1.0 2.8 4.4 545 342 A 75 GLN HA A 75 GLN HGy 1.0 2.8 4.4 546 343 A 75 GLN HA A 88 LYS HGx 1.0 2.8 4.4 547 343 A 75 GLN HA A 88 LYS HGy 1.0 2.8 4.4 548 344 A 76 GLU HA A 76 GLU HGx 1.0 1.8 3.4 549 344 A 76 GLU HA A 76 GLU HGy 1.0 1.8 3.4 550 345 A 76 GLU HA A 77 ASN HA 1.0 2.8 4.1 551 346 A 76 GLU HGy A 77 ASN HBy 1.0 2.3 7.0 552 346 A 76 GLU HGx A 77 ASN HBy 1.0 2.3 7.0 553 347 A 76 GLU HA A 77 ASN HBy 1.0 2.3 6.5 554 348 A 76 GLU HGy A 77 ASN HBx 1.0 2.3 7.0 555 348 A 77 ASN HBx A 76 GLU HGx 1.0 2.3 7.0 556 349 A 78 LYS HA A 76 GLU HGx 1.0 1.8 3.4 557 349 A 76 GLU HGy A 78 LYS HA 1.0 1.8 3.4 558 350 A 78 LYS HDy A 77 ASN HBx 1.0 2.3 7.0 559 350 A 77 ASN HBx A 78 LYS HDx 1.0 2.3 7.0 560 351 A 78 LYS HGy A 77 ASN HBy 1.0 2.3 7.0 561 351 A 77 ASN HBy A 78 LYS HGx 1.0 2.3 7.0 562 352 A 77 ASN HA A 88 LYS HBx 1.0 1.8 3.4 563 352 A 88 LYS HBy A 77 ASN HA 1.0 1.8 3.4 564 353 A 88 LYS HBy A 77 ASN HBx 1.0 2.3 7.0 565 353 A 77 ASN HBx A 88 LYS HBx 1.0 2.3 7.0 566 354 A 78 LYS HBx A 78 LYS HEx 1.0 2.3 3.9 567 354 A 78 LYS HEy A 78 LYS HBx 1.0 2.3 3.9 568 355 A 78 LYS HA A 78 LYS HDx 1.0 1.8 5.5 569 355 A 78 LYS HA A 78 LYS HDy 1.0 1.8 5.5 570 356 A 78 LYS HA A 78 LYS HGx 1.0 2.3 7.0 571 356 A 78 LYS HA A 78 LYS HGy 1.0 2.3 7.0 572 357 A 78 LYS HEy A 78 LYS HGx 1.0 2.3 5.0 573 357 A 78 LYS HEx A 78 LYS HGx 1.0 2.3 5.0 574 357 A 78 LYS HGy A 78 LYS HEx 1.0 2.3 5.0 575 357 A 78 LYS HGy A 78 LYS HEy 1.0 2.3 5.0 576 358 A 80 PRO HDx A 80 PRO HBx 1.0 1.8 5.0 577 359 A 80 PRO HDx A 80 PRO HBy 1.0 2.8 4.1 578 360 A 80 PRO HBx A 80 PRO HDy 1.0 1.8 5.0 579 361 A 80 PRO HBy A 80 PRO HDy 1.0 1.8 5.0 580 362 A 80 PRO HGx A 80 PRO HA 1.0 2.3 6.5 581 363 A 81 VAL HGx% A 80 PRO HGy 1.0 2.0 5.0 582 364 A 81 VAL HGy% A 80 PRO HBy 1.0 2.3 7.0 583 365 A 80 PRO HA A 82 PRO HA 1.0 2.3 6.5 584 366 A 81 VAL HGx% A 81 VAL HA 1.0 2.3 3.9 585 367 A 81 VAL HGy% A 81 VAL HA 1.0 2.3 6.0 586 368 A 81 VAL HGx% A 82 PRO HGx 1.0 3.3 5.2 587 369 A 81 VAL HGx% A 82 PRO HDx 1.0 2.8 4.4 588 370 A 84 CYS HBx A 83 PHE HBy 1.0 1.8 5.0 589 371 A 83 PHE HA A 86 ASN HA 1.0 2.8 5.0 590 372 A 85 LEU HDx% A 85 LEU HBy 1.0 2.3 6.0 591 372 A 85 LEU HBx A 85 LEU HDx% 1.0 2.3 6.0 592 373 A 87 ILE HA A 86 ASN HBx 1.0 2.3 6.5 593 374 A 86 ASN HA A 87 ILE HA 1.0 1.8 5.0 594 375 A 87 ILE HD1% A 86 ASN HBy 1.0 2.3 7.5 595 375 A 87 ILE HD1% A 86 ASN HBx 1.0 2.3 7.5 596 376 A 87 ILE HA A 86 ASN HBy 1.0 2.3 6.5 597 377 A 86 ASN HBx A 90 LYS HEy 1.0 2.8 4.4 598 377 A 86 ASN HBx A 90 LYS HEx 1.0 2.8 4.4 599 378 A 87 ILE HA A 87 ILE HG1y 1.0 2.3 7.0 600 378 A 87 ILE HG1x A 87 ILE HA 1.0 2.3 7.0 601 379 A 87 ILE HA A 87 ILE HG2% 1.0 2.3 4.5 602 380 A 87 ILE HD1% A 87 ILE HA 1.0 2.3 6.0 603 381 A 87 ILE HD1% A 87 ILE HB 1.0 2.3 3.9 604 382 A 87 ILE HG2% A 88 LYS HA 1.0 2.8 4.4 605 383 A 87 ILE HG2% A 88 LYS HEx 1.0 2.3 7.5 606 383 A 87 ILE HG2% A 88 LYS HEy 1.0 2.3 7.5 607 384 A 87 ILE HD1% A 88 LYS HBx 1.0 2.8 5.5 608 384 A 87 ILE HD1% A 88 LYS HBy 1.0 2.8 5.5 609 385 A 87 ILE HA A 90 LYS HEx 1.0 2.3 7.0 610 385 A 87 ILE HA A 90 LYS HEy 1.0 2.3 7.0 611 386 A 88 LYS HA A 88 LYS HGx 1.0 1.8 3.4 612 386 A 88 LYS HGy A 88 LYS HA 1.0 1.8 3.4 613 387 A 89 GLN HA A 88 LYS HBx 1.0 2.3 7.0 614 387 A 88 LYS HBy A 89 GLN HA 1.0 2.3 7.0 615 388 A 89 GLN HBx A 90 LYS HBx 1.0 1.8 3.4 616 388 A 89 GLN HBy A 90 LYS HBx 1.0 1.8 3.4 617 388 A 90 LYS HBy A 89 GLN HBx 1.0 1.8 3.4 618 388 A 89 GLN HBy A 90 LYS HBy 1.0 1.8 3.4 619 389 A 90 LYS HEx A 90 LYS HGx 1.0 1.8 3.9 620 389 A 90 LYS HEy A 90 LYS HGx 1.0 1.8 3.9 621 389 A 90 LYS HGy A 90 LYS HEx 1.0 1.8 3.9 622 389 A 90 LYS HEy A 90 LYS HGy 1.0 1.8 3.9 623 390 A 90 LYS HBx A 90 LYS HEx 1.0 1.8 6.0 624 390 A 90 LYS HBy A 90 LYS HEx 1.0 1.8 6.0 625 390 A 90 LYS HEy A 90 LYS HBx 1.0 1.8 6.0 626 390 A 90 LYS HEy A 90 LYS HBy 1.0 1.8 6.0 627 391 B 4 PRO HA B 4 PRO HGx 1.0 2.3 7.0 628 391 B 4 PRO HA B 4 PRO HGy 1.0 2.3 7.0 629 392 B 7 ASP HA B 8 PRO HDy 1.0 1.8 3.4 630 392 B 7 ASP HA B 8 PRO HDx 1.0 1.8 3.4 631 393 B 7 ASP HA B 8 PRO HDx 1.0 2.3 6.5 632 394 B 7 ASP HA B 12 PRO HDy 1.0 1.8 5.0 633 395 B 8 PRO HA B 8 PRO HGx 1.0 2.3 7.0 634 395 B 8 PRO HGy B 8 PRO HA 1.0 2.3 7.0 635 396 B 9 SER HA B 10 VAL HA 1.0 2.3 6.5 636 397 B 10 VAL HA B 9 SER HBy 1.0 2.3 6.5 637 398 B 10 VAL HA B 9 SER HBx 1.0 2.3 6.5 638 399 B 10 VAL HA B 10 VAL HGy% 1.0 2.3 7.0 639 400 B 10 VAL HA B 11 GLU HGy 1.0 2.3 6.5 640 401 B 10 VAL HB B 11 GLU HGy 1.0 2.3 4.5 641 401 B 10 VAL HB B 11 GLU HGx 1.0 2.3 4.5 642 402 B 10 VAL HA B 12 PRO HA 1.0 2.8 5.0 643 403 B 11 GLU HA B 11 GLU HGy 1.0 2.3 7.0 644 403 B 11 GLU HGx B 11 GLU HA 1.0 2.3 7.0 645 404 B 12 PRO HA B 11 GLU HA 1.0 2.8 5.0 646 405 B 12 PRO HDy B 11 GLU HA 1.0 1.8 5.0 647 406 B 11 GLU HA B 12 PRO HDx 1.0 2.3 6.5 648 407 B 12 PRO HA B 12 PRO HGx 1.0 2.3 4.5 649 407 B 12 PRO HA B 12 PRO HGy 1.0 2.3 4.5 650 408 B 12 PRO HDy B 12 PRO HBy 1.0 2.3 6.5 651 409 B 12 PRO HDy B 12 PRO HA 1.0 2.3 6.5 652 410 B 12 PRO HDy B 13 PRO HDy 1.0 2.3 6.5 653 411 B 12 PRO HDy B 13 PRO HGx 1.0 2.3 7.0 654 411 B 12 PRO HDy B 13 PRO HGy 1.0 2.3 7.0 655 412 B 13 PRO HDx B 14 LEU HDx% 1.0 2.3 7.0 656 413 B 14 LEU HDx% B 14 LEU HBx 1.0 2.3 4.5 657 414 B 18 THR HB B 22 LEU HG 1.0 2.3 6.5 658 415 B 22 LEU HG B 22 LEU HA 1.0 2.3 6.5 659 416 B 22 LEU HDx% B 22 LEU HA 1.0 1.8 5.5 660 417 B 22 LEU HDx% B 22 LEU HBx 1.0 2.3 4.5 661 418 B 22 LEU HDx% B 22 LEU HBy 1.0 1.8 5.5 662 419 B 22 LEU HBy B 25 LEU HDx% 1.0 2.3 7.0 663 420 B 24 LYS HA B 24 LYS HDx 1.0 2.3 7.0 664 420 B 24 LYS HA B 24 LYS HDy 1.0 2.3 7.0 665 421 B 24 LYS HA B 24 LYS HGy 1.0 2.3 7.0 666 421 B 24 LYS HA B 24 LYS HGx 1.0 2.3 7.0 667 422 B 24 LYS HEx B 24 LYS HGy 1.0 2.3 7.5 668 422 B 24 LYS HEy B 24 LYS HGy 1.0 2.3 7.5 669 422 B 24 LYS HGx B 24 LYS HEy 1.0 2.3 7.5 670 422 B 24 LYS HGx B 24 LYS HEx 1.0 2.3 7.5 671 423 B 24 LYS HBx B 24 LYS HDx 1.0 2.3 5.0 672 423 B 24 LYS HDy B 24 LYS HBy 1.0 2.3 5.0 673 423 B 24 LYS HDy B 24 LYS HBx 1.0 2.3 5.0 674 423 B 24 LYS HBy B 24 LYS HDx 1.0 2.3 5.0 675 424 B 25 LEU HDx% B 25 LEU HA 1.0 2.3 4.5 676 425 B 25 LEU HBx B 25 LEU HDy% 1.0 2.3 7.0 677 426 B 26 LEU HA B 26 LEU HG 1.0 2.3 6.5 678 427 B 26 LEU HA B 26 LEU HDx% 1.0 2.3 7.0 679 428 B 26 LEU HDx% B 26 LEU HBx 1.0 2.3 7.0 680 429 B 26 LEU HDx% B 26 LEU HBy 1.0 2.3 7.0 681 430 B 26 LEU HBy B 26 LEU HDy% 1.0 2.3 7.0 682 431 B 26 LEU HA B 27 PRO HDx 1.0 2.3 6.5 683 432 B 26 LEU HA B 27 PRO HDy 1.0 2.3 6.5 684 433 B 26 LEU HG B 28 GLU HGy 1.0 2.3 6.0 685 434 B 27 PRO HA B 27 PRO HGx 1.0 2.3 7.0 686 434 B 27 PRO HGy B 27 PRO HA 1.0 2.3 7.0 687 435 B 27 PRO HA B 28 GLU HA 1.0 2.3 6.5 688 436 B 27 PRO HDy B 30 ASN HA 1.0 2.3 6.5 689 437 B 28 GLU HA B 28 GLU HGy 1.0 2.3 7.0 690 437 B 28 GLU HA B 28 GLU HGx 1.0 2.3 7.0 691 438 B 28 GLU HA B 28 GLU HGy 1.0 2.3 6.5 692 439 B 31 VAL HA B 31 VAL HGx% 1.0 2.3 7.0 693 440 B 32 LEU HA B 32 LEU HG 1.0 2.3 4.0 694 441 B 32 LEU HA B 32 LEU HDx% 1.0 1.8 5.5 695 442 B 32 LEU HA B 32 LEU HDy% 1.0 2.3 4.5 696 443 B 33 SER HA B 34 PRO HDy 1.0 2.3 6.5 697 444 B 34 PRO HA B 34 PRO HGx 1.0 2.3 7.0 698 444 B 34 PRO HGy B 34 PRO HA 1.0 2.3 7.0 699 445 B 34 PRO HBx B 34 PRO HGx 1.0 1.8 3.4 700 445 B 34 PRO HGy B 34 PRO HBx 1.0 1.8 3.4 701 446 B 35 LEU HA B 35 LEU HG 1.0 2.3 6.5 702 447 B 35 LEU HA B 35 LEU HDx% 1.0 2.3 7.0 703 448 B 35 LEU HA B 36 PRO HDx 1.0 2.3 6.5 704 449 B 35 LEU HA B 36 PRO HDy 1.0 2.3 6.5 stop_ save_ save_CNS/XPLOR_distance_constraints_7 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_7 _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 THR H A 2 THR HA 1.0 1.8 3.0 2 2 A 3 GLN HA A 3 GLN H 1.0 1.8 3.0 3 3 A 3 GLN H A 3 GLN HBx 1.0 2.3 6.5 4 4 A 3 GLN HBy A 3 GLN H 1.0 2.3 4.1 5 5 A 3 GLN HBy A 4 SER H 1.0 2.3 6.5 6 6 A 3 GLN HA A 4 SER H 1.0 1.8 3.0 7 7 A 4 SER HA A 4 SER H 1.0 1.8 3.0 8 8 A 4 SER H A 5 PRO HBx 1.0 2.3 6.0 9 8 A 4 SER H A 5 PRO HBy 1.0 2.3 6.0 10 9 A 4 SER H A 6 GLY H 1.0 2.3 6.5 11 10 A 4 SER HA A 6 GLY H 1.0 2.3 4.2 12 11 A 4 SER HA A 7 ASP H 1.0 2.8 4.2 13 12 A 7 ASP HA A 4 SER H 1.0 1.8 5.0 14 13 A 4 SER HA A 8 SER H 1.0 2.8 5.0 15 14 A 6 GLY H A 5 PRO HGx 1.0 2.3 7.0 16 14 A 5 PRO HGy A 6 GLY H 1.0 2.3 7.0 17 15 A 6 GLY H A 5 PRO HDy 1.0 2.3 6.5 18 16 A 5 PRO HA A 6 GLY H 1.0 2.3 3.5 19 17 A 6 GLY H A 5 PRO HBx 1.0 2.3 6.5 20 18 A 5 PRO HA A 7 ASP H 1.0 2.3 6.5 21 19 A 7 ASP H A 5 PRO HDy 1.0 2.3 6.5 22 20 A 8 SER H A 5 PRO HGx 1.0 2.3 7.0 23 20 A 5 PRO HGy A 8 SER H 1.0 2.3 7.0 24 21 A 5 PRO HA A 8 SER H 1.0 1.8 5.0 25 22 A 6 GLY H A 6 GLY HAx 1.0 1.8 3.0 26 22 A 6 GLY HAy A 6 GLY H 1.0 1.8 3.0 27 23 A 6 GLY H A 7 ASP H 1.0 2.3 6.5 28 24 A 7 ASP H A 6 GLY HAx 1.0 2.3 4.6 29 24 A 6 GLY HAy A 7 ASP H 1.0 2.3 4.6 30 25 A 10 ARG H A 6 GLY HAx 1.0 2.3 4.1 31 25 A 6 GLY HAy A 10 ARG H 1.0 2.3 4.1 32 26 A 7 ASP HA A 7 ASP H 1.0 1.8 3.0 33 27 A 7 ASP H A 7 ASP HBx 1.0 1.8 3.0 34 27 A 7 ASP HBy A 7 ASP H 1.0 1.8 3.0 35 28 A 8 SER HA A 7 ASP H 1.0 2.3 6.5 36 29 A 7 ASP HA A 8 SER H 1.0 2.3 4.1 37 30 A 8 SER H A 7 ASP HBx 1.0 2.3 6.5 38 30 A 7 ASP HBy A 8 SER H 1.0 2.3 6.5 39 31 A 7 ASP H A 9 ARG H 1.0 2.3 6.5 40 32 A 9 ARG HA A 7 ASP H 1.0 2.3 6.5 41 33 A 7 ASP H A 9 ARG HBx 1.0 1.8 5.5 42 33 A 7 ASP H A 9 ARG HBy 1.0 1.8 5.5 43 34 A 7 ASP H A 9 ARG HGx 1.0 2.8 5.1 44 34 A 9 ARG HGy A 7 ASP H 1.0 2.8 5.1 45 35 A 7 ASP H A 10 ARG HGx 1.0 1.8 5.5 46 35 A 10 ARG HGy A 7 ASP H 1.0 1.8 5.5 47 36 A 7 ASP HA A 10 ARG H 1.0 2.8 4.1 48 37 A 10 ARG H A 7 ASP HBx 1.0 2.3 6.5 49 37 A 7 ASP HBy A 10 ARG H 1.0 2.3 6.5 50 38 A 8 SER HA A 8 SER H 1.0 1.8 3.0 51 39 A 8 SER H A 8 SER HBx 1.0 1.8 5.0 52 39 A 8 SER HBy A 8 SER H 1.0 1.8 5.0 53 40 A 9 ARG H A 8 SER HBx 1.0 2.3 4.1 54 40 A 8 SER HBy A 9 ARG H 1.0 2.3 4.1 55 41 A 9 ARG HA A 8 SER H 1.0 2.8 5.0 56 42 A 8 SER H A 9 ARG H 1.0 2.3 6.5 57 43 A 8 SER HA A 10 ARG H 1.0 2.8 4.0 58 44 A 8 SER H A 10 ARG H 1.0 2.3 6.5 59 45 A 10 ARG HA A 8 SER H 1.0 2.3 6.5 60 46 A 8 SER HA A 11 LEU H 1.0 2.3 4.1 61 47 A 11 LEU H A 8 SER HBx 1.0 2.8 5.0 62 47 A 8 SER HBy A 11 LEU H 1.0 2.8 5.0 63 48 A 8 SER HA A 12 SER H 1.0 2.3 4.1 64 49 A 9 ARG HA A 9 ARG H 1.0 1.8 3.0 65 50 A 9 ARG H A 9 ARG HBx 1.0 1.8 3.5 66 50 A 9 ARG H A 9 ARG HBy 1.0 1.8 3.5 67 51 A 9 ARG H A 9 ARG HGx 1.0 2.3 7.0 68 51 A 9 ARG HGy A 9 ARG H 1.0 2.3 7.0 69 52 A 10 ARG H A 9 ARG H 1.0 2.3 4.1 70 53 A 9 ARG H A 10 ARG HGx 1.0 2.3 7.0 71 53 A 10 ARG HGy A 9 ARG H 1.0 2.3 7.0 72 54 A 9 ARG HA A 10 ARG H 1.0 1.9 3.2 73 55 A 10 ARG H A 9 ARG HGx 1.0 2.8 4.5 74 55 A 9 ARG HGy A 10 ARG H 1.0 2.8 4.5 75 56 A 9 ARG H A 11 LEU H 1.0 2.3 6.5 76 57 A 9 ARG H A 12 SER H 1.0 2.3 4.1 77 58 A 10 ARG HA A 10 ARG H 1.0 1.8 3.0 78 59 A 10 ARG H A 10 ARG HDy 1.0 2.3 7.0 79 59 A 10 ARG HDx A 10 ARG H 1.0 2.3 7.0 80 60 A 10 ARG H A 10 ARG HBx 1.0 1.8 3.5 81 60 A 10 ARG H A 10 ARG HBy 1.0 1.8 3.5 82 61 A 10 ARG H A 10 ARG HGx 1.0 2.3 4.6 83 61 A 10 ARG HGy A 10 ARG H 1.0 2.3 4.6 84 62 A 10 ARG HA A 11 LEU H 1.0 2.8 4.0 85 63 A 10 ARG H A 12 SER H 1.0 2.3 4.1 86 64 A 10 ARG HDx A 12 SER H 1.0 2.3 6.5 87 65 A 12 SER H A 10 ARG HDy 1.0 2.3 6.7 88 66 A 10 ARG HA A 13 ILE H 1.0 2.3 4.1 89 67 A 11 LEU HA A 11 LEU H 1.0 1.8 3.0 90 68 A 11 LEU HBx A 11 LEU H 1.0 2.3 3.6 91 69 A 11 LEU HDx% A 11 LEU H 1.0 2.3 4.6 92 70 A 11 LEU HBy A 11 LEU H 1.0 2.3 3.5 93 71 A 11 LEU HG A 11 LEU H 1.0 1.8 3.0 94 72 A 11 LEU H A 11 LEU HD21 1.0 2.3 7.0 95 73 A 11 LEU H A 12 SER H 1.0 2.3 3.5 96 74 A 11 LEU HBy A 12 SER H 1.0 2.3 4.1 97 75 A 11 LEU HBx A 12 SER H 1.0 2.3 4.1 98 76 A 11 LEU HDx% A 12 SER H 1.0 2.3 7.0 99 77 A 11 LEU H A 13 ILE H 1.0 2.3 4.1 100 78 A 11 LEU H A 14 GLN HBx 1.0 1.8 5.0 101 78 A 14 GLN HBy A 11 LEU H 1.0 1.8 5.0 102 79 A 11 LEU HA A 14 GLN H 1.0 2.8 4.0 103 80 A 12 SER HA A 12 SER H 1.0 1.8 3.0 104 81 A 12 SER H A 12 SER HBy 1.0 1.8 3.0 105 82 A 12 SER HBx A 12 SER H 1.0 2.3 4.1 106 83 A 12 SER HA A 13 ILE H 1.0 2.3 4.1 107 84 A 13 ILE HB A 12 SER H 1.0 2.3 6.5 108 85 A 13 ILE HA A 12 SER H 1.0 1.8 5.0 109 86 A 12 SER H A 13 ILE H 1.0 2.8 4.0 110 87 A 12 SER H A 14 GLN HGx 1.0 2.3 7.0 111 87 A 14 GLN HGy A 12 SER H 1.0 2.3 7.0 112 88 A 12 SER H A 14 GLN HBx 1.0 2.3 7.0 113 88 A 14 GLN HBy A 12 SER H 1.0 2.3 7.0 114 89 A 12 SER H A 15 ARG H 1.0 2.3 6.5 115 90 A 13 ILE HA A 13 ILE H 1.0 1.8 3.0 116 91 A 13 ILE HB A 13 ILE H 1.0 2.3 3.5 117 92 A 13 ILE H A 13 ILE HG1x 1.0 2.0 5.5 118 92 A 13 ILE H A 13 ILE HG1y 1.0 2.0 5.5 119 93 A 13 ILE HG2% A 13 ILE H 1.0 2.3 4.6 120 94 A 13 ILE HD1% A 13 ILE H 1.0 2.8 5.1 121 95 A 13 ILE H A 14 GLN H 1.0 2.8 4.0 122 96 A 14 GLN HA A 13 ILE H 1.0 2.3 6.5 123 97 A 13 ILE H A 14 GLN HBx 1.0 2.3 7.0 124 97 A 14 GLN HBy A 13 ILE H 1.0 2.3 7.0 125 98 A 13 ILE HA A 14 GLN H 1.0 2.3 6.5 126 99 A 13 ILE HB A 14 GLN H 1.0 2.8 4.0 127 100 A 14 GLN H A 13 ILE HG1x 1.0 2.3 4.1 128 101 A 13 ILE HG2% A 14 GLN H 1.0 2.3 7.0 129 102 A 13 ILE HD1% A 14 GLN H 1.0 2.8 5.1 130 103 A 13 ILE HA A 15 ARG H 1.0 2.3 6.5 131 104 A 13 ILE HB A 15 ARG H 1.0 2.3 6.5 132 105 A 13 ILE HG2% A 16 ALA H 1.0 2.3 7.0 133 106 A 13 ILE HG2% A 69 TYR H 1.0 2.3 7.0 134 107 A 13 ILE H B 17 GLU HBx 1.0 2.3 6.5 135 107 A 13 ILE H B 17 GLU HBy 1.0 2.3 6.5 136 108 A 13 ILE H B 17 GLU HGx 1.0 2.3 6.5 137 108 A 13 ILE H B 17 GLU HGy 1.0 2.3 6.5 138 109 A 14 GLN HA A 14 GLN H 1.0 1.8 3.0 139 110 A 14 GLN H A 14 GLN HBx 1.0 1.8 3.0 140 110 A 14 GLN HBy A 14 GLN H 1.0 1.8 3.0 141 111 A 14 GLN H A 14 GLN HGx 1.0 1.8 3.5 142 111 A 14 GLN HGy A 14 GLN H 1.0 1.8 3.5 143 112 A 14 GLN H A 15 ARG H 1.0 1.8 5.0 144 113 A 15 ARG H A 14 GLN HBx 1.0 2.3 4.6 145 113 A 14 GLN HBy A 15 ARG H 1.0 2.3 4.6 146 114 A 14 GLN H A 16 ALA H 1.0 2.3 6.5 147 115 A 16 ALA H A 14 GLN HBx 1.0 2.8 5.0 148 115 A 14 GLN HBy A 16 ALA H 1.0 2.8 5.0 149 116 A 14 GLN H A 17 ILE H 1.0 2.3 4.1 150 117 A 17 ILE HD1% A 14 GLN H 1.0 2.3 6.0 151 118 A 17 ILE HB A 14 GLN H 1.0 2.8 5.0 152 119 A 14 GLN H A 17 ILE HG1x 1.0 2.3 7.0 153 119 A 14 GLN H A 17 ILE HG1y 1.0 2.3 7.0 154 120 A 14 GLN HA A 17 ILE H 1.0 2.3 4.1 155 121 A 15 ARG HA A 15 ARG H 1.0 1.8 3.0 156 122 A 15 ARG H A 15 ARG HGy 1.0 1.8 5.5 157 122 A 15 ARG HGx A 15 ARG H 1.0 1.8 5.5 158 123 A 15 ARG H A 15 ARG HBx 1.0 2.3 4.6 159 123 A 15 ARG H A 15 ARG HBy 1.0 2.3 4.6 160 124 A 15 ARG H A 16 ALA H 1.0 1.8 5.0 161 125 A 15 ARG HA A 16 ALA H 1.0 2.3 4.1 162 126 A 16 ALA H A 15 ARG HBx 1.0 1.8 3.5 163 126 A 16 ALA H A 15 ARG HBy 1.0 1.8 3.5 164 127 A 16 ALA H A 15 ARG HGy 1.0 2.3 4.6 165 127 A 15 ARG HGx A 16 ALA H 1.0 2.3 4.6 166 128 A 16 ALA H A 15 ARG HDx 1.0 2.3 7.0 167 128 A 15 ARG HDy A 16 ALA H 1.0 2.3 7.0 168 129 A 16 ALA HA A 15 ARG H 1.0 2.8 5.0 169 130 A 15 ARG H A 17 ILE H 1.0 2.3 4.1 170 131 A 15 ARG H A 18 GLN HGx 1.0 2.3 6.5 171 132 A 15 ARG H A 18 GLN H 1.0 2.3 4.1 172 133 A 15 ARG HA A 18 GLN H 1.0 2.3 6.5 173 134 A 18 GLN H A 15 ARG HDx 1.0 2.3 7.0 174 134 A 15 ARG HDy A 18 GLN H 1.0 2.3 7.0 175 135 A 18 GLN H A 15 ARG HBx 1.0 3.3 6.5 176 136 A 15 ARG HGx A 18 GLN H 1.0 2.3 6.5 177 137 A 16 ALA HA A 16 ALA H 1.0 1.8 3.0 178 138 A 16 ALA HB% A 16 ALA H 1.0 1.8 3.5 179 139 A 16 ALA H A 17 ILE H 1.0 1.8 3.0 180 140 A 17 ILE HA A 16 ALA H 1.0 2.8 5.0 181 141 A 17 ILE HB A 16 ALA H 1.0 2.3 4.1 182 142 A 16 ALA HB% A 17 ILE H 1.0 2.3 7.0 183 143 A 16 ALA HA A 17 ILE H 1.0 2.3 6.5 184 144 A 16 ALA H A 18 GLN H 1.0 2.3 4.1 185 145 A 16 ALA HB% A 18 GLN H 1.0 1.8 5.5 186 146 A 16 ALA H A 19 SER H 1.0 1.8 5.0 187 147 A 16 ALA HA A 19 SER H 1.0 2.3 4.1 188 148 A 16 ALA HA A 20 LEU H 1.0 1.8 5.0 189 149 A 17 ILE HA A 17 ILE H 1.0 1.8 3.0 190 150 A 17 ILE H A 17 ILE HG1x 1.0 1.8 3.0 191 151 A 17 ILE H A 17 ILE HG1y 1.0 2.3 4.1 192 152 A 17 ILE HG2% A 17 ILE H 1.0 2.3 7.0 193 153 A 17 ILE HB A 17 ILE H 1.0 1.8 3.0 194 154 A 17 ILE HD1% A 17 ILE H 1.0 2.8 4.5 195 155 A 17 ILE HG1y A 18 GLN H 1.0 2.3 6.5 196 156 A 17 ILE HA A 18 GLN H 1.0 2.3 4.1 197 157 A 17 ILE HG2% A 18 GLN H 1.0 2.8 5.1 198 158 A 17 ILE HD1% A 18 GLN H 1.0 2.3 6.0 199 159 A 17 ILE H A 18 GLN H 1.0 2.7 4.0 200 160 A 18 GLN H A 17 ILE HG1x 1.0 2.8 5.0 201 161 A 17 ILE H A 18 GLN HGx 1.0 2.3 6.5 202 162 A 17 ILE HA A 19 SER H 1.0 2.3 6.5 203 163 A 17 ILE HA A 20 LEU H 1.0 2.3 4.1 204 164 A 17 ILE H A 20 LEU H 1.0 2.3 4.1 205 165 A 17 ILE HG2% A 20 LEU H 1.0 2.3 7.0 206 166 A 17 ILE HG1y A 20 LEU H 1.0 2.3 6.5 207 167 A 17 ILE HG2% A 21 VAL H 1.0 2.8 5.1 208 168 A 17 ILE HG1y A 67 ALA H 1.0 2.3 7.0 209 169 A 17 ILE HD1% A 69 TYR H 1.0 2.3 7.0 210 170 A 17 ILE HG1y A 70 HIS H 1.0 2.3 6.5 211 171 A 70 HIS H A 17 ILE HG1x 1.0 2.3 6.5 212 172 A 18 GLN HA A 18 GLN H 1.0 1.8 3.0 213 173 A 18 GLN H A 18 GLN HGx 1.0 2.3 4.1 214 174 A 18 GLN HGy A 18 GLN H 1.0 2.3 4.1 215 175 A 18 GLN H A 18 GLN HBx 1.0 1.8 3.0 216 176 A 18 GLN HBy A 18 GLN H 1.0 2.3 3.6 217 177 A 19 SER HA A 18 GLN H 1.0 2.3 6.5 218 178 A 19 SER H A 18 GLN HGx 1.0 2.3 6.5 219 179 A 19 SER H A 18 GLN HBx 1.0 2.3 4.1 220 179 A 18 GLN HBy A 19 SER H 1.0 2.3 4.1 221 180 A 20 LEU H A 18 GLN HGx 1.0 2.3 7.0 222 180 A 18 GLN HGy A 20 LEU H 1.0 2.3 7.0 223 181 A 20 LEU H A 18 GLN HBx 1.0 2.3 6.5 224 181 A 18 GLN HBy A 20 LEU H 1.0 2.3 6.5 225 182 A 21 VAL H A 18 GLN HBx 1.0 2.3 6.5 226 182 A 18 GLN HBy A 21 VAL H 1.0 2.3 6.5 227 183 A 18 GLN HA A 21 VAL H 1.0 2.3 4.1 228 184 A 18 GLN HGy A 22 HIS H 1.0 2.3 6.5 229 185 A 18 GLN HA A 22 HIS H 1.0 2.3 4.1 230 186 A 22 HIS H A 18 GLN HBx 1.0 2.3 6.5 231 186 A 18 GLN HBy A 22 HIS H 1.0 2.3 6.5 232 187 A 19 SER HA A 19 SER H 1.0 1.8 3.0 233 188 A 19 SER H A 19 SER HBy 1.0 2.3 4.1 234 189 A 19 SER H A 19 SER HBx 1.0 1.8 3.0 235 190 A 20 LEU H A 19 SER HBy 1.0 2.3 4.1 236 191 A 19 SER HA A 20 LEU H 1.0 2.3 4.1 237 192 A 19 SER H A 20 LEU H 1.0 1.8 3.0 238 193 A 20 LEU HBx A 19 SER H 1.0 2.3 4.1 239 194 A 19 SER H A 20 LEU HBy 1.0 3.3 6.5 240 195 A 19 SER HA A 21 VAL H 1.0 2.3 6.5 241 196 A 21 VAL H A 19 SER HBx 1.0 2.3 7.0 242 196 A 21 VAL H A 19 SER HBy 1.0 2.3 7.0 243 197 A 19 SER H A 21 VAL H 1.0 2.3 4.1 244 198 A 22 HIS H A 19 SER HBy 1.0 2.3 6.5 245 199 A 19 SER HA A 22 HIS H 1.0 2.3 4.1 246 200 A 19 SER HA A 23 ALA H 1.0 2.3 6.5 247 201 A 19 SER HBy A 23 ALA H 1.0 2.3 6.5 248 202 A 19 SER HBy A 36 CYS H 1.0 2.8 5.0 249 203 A 19 SER H B 19 PHE HZ 1.0 2.0 6.5 250 204 A 20 LEU HA A 20 LEU H 1.0 1.8 3.0 251 205 A 20 LEU H A 20 LEU HBy 1.0 2.3 3.6 252 206 A 20 LEU HG A 20 LEU H 1.0 2.3 4.1 253 207 A 20 LEU HBx A 20 LEU H 1.0 1.8 3.0 254 208 A 20 LEU HDx% A 20 LEU H 1.0 2.8 4.5 255 209 A 20 LEU H A 21 VAL H 1.0 2.8 4.0 256 210 A 21 VAL H A 20 LEU HBy 1.0 2.3 4.1 257 211 A 20 LEU HA A 21 VAL H 1.0 2.3 4.1 258 212 A 20 LEU HG A 21 VAL H 1.0 1.8 3.1 259 213 A 20 LEU H A 22 HIS H 1.0 2.8 4.1 260 214 A 20 LEU H A 22 HIS HBy 1.0 2.3 7.0 261 214 A 22 HIS HBx A 20 LEU H 1.0 2.3 7.0 262 215 A 22 HIS H A 20 LEU HBy 1.0 2.3 6.5 263 216 A 20 LEU HG A 22 HIS H 1.0 2.8 5.0 264 217 A 20 LEU HBx A 23 ALA H 1.0 2.3 6.5 265 218 A 20 LEU HA A 23 ALA H 1.0 2.3 6.5 266 219 A 20 LEU HBy A 24 ALA H 1.0 3.3 5.5 267 220 A 20 LEU HDx% A 24 ALA H 1.0 3.3 5.0 268 221 A 20 LEU H A 38 LYS HEx 1.0 2.3 7.0 269 221 A 38 LYS HEy A 20 LEU H 1.0 2.3 7.0 270 222 A 39 MET HGx A 20 LEU H 1.0 2.3 6.5 271 223 A 20 LEU H A 39 MET HBy 1.0 2.3 6.0 272 224 A 20 LEU HDy% A 67 ALA H 1.0 2.8 5.1 273 225 A 20 LEU H B 22 LEU HD21 1.0 2.3 6.5 274 226 A 21 VAL HA A 21 VAL H 1.0 1.8 3.0 275 227 A 21 VAL HGx% A 21 VAL H 1.0 2.8 4.5 276 228 A 21 VAL HB A 21 VAL H 1.0 2.3 3.6 277 229 A 21 VAL H A 22 HIS H 1.0 2.8 4.0 278 230 A 21 VAL HGx% A 22 HIS H 1.0 2.8 4.5 279 231 A 21 VAL HB A 22 HIS H 1.0 2.3 3.7 280 232 A 21 VAL H A 23 ALA H 1.0 2.3 6.5 281 233 A 21 VAL HB A 23 ALA H 1.0 2.3 6.5 282 234 A 21 VAL HGx% A 23 ALA H 1.0 2.3 7.0 283 235 A 21 VAL HA A 24 ALA H 1.0 2.3 4.1 284 236 A 21 VAL HGx% A 25 GLN H 1.0 1.8 5.5 285 237 A 21 VAL HA A 25 GLN H 1.0 2.3 6.5 286 238 A 81 VAL HGy% A 21 VAL H 1.0 2.3 7.0 287 239 A 22 HIS HA A 22 HIS H 1.0 1.8 3.0 288 240 A 22 HIS H A 22 HIS HBy 1.0 1.8 3.5 289 240 A 22 HIS HBx A 22 HIS H 1.0 1.8 3.5 290 241 A 22 HIS H A 23 ALA H 1.0 2.3 4.1 291 242 A 23 ALA H A 22 HIS HBy 1.0 1.8 5.0 292 243 A 23 ALA HB% A 22 HIS H 1.0 1.8 5.5 293 244 A 22 HIS H A 24 ALA H 1.0 2.3 4.1 294 245 A 22 HIS HA A 24 ALA H 1.0 2.3 4.1 295 246 A 25 GLN HBy A 22 HIS H 1.0 1.8 5.0 296 247 A 22 HIS H A 25 GLN H 1.0 2.8 5.0 297 248 A 22 HIS HA A 25 GLN H 1.0 2.3 4.1 298 249 A 25 GLN H A 22 HIS HBy 1.0 2.3 6.5 299 250 A 23 ALA H A 23 ALA HA 1.0 1.8 3.0 300 251 A 23 ALA HB% A 23 ALA H 1.0 2.3 4.6 301 252 A 23 ALA H A 24 ALA H 1.0 2.8 4.0 302 253 A 23 ALA HB% A 24 ALA H 1.0 1.8 3.5 303 254 A 23 ALA H A 25 GLN H 1.0 2.3 6.5 304 255 A 23 ALA HB% A 25 GLN H 1.0 2.8 5.1 305 256 A 23 ALA H A 26 CYS H 1.0 2.3 6.5 306 257 A 23 ALA HB% A 39 MET H 1.0 2.3 4.6 307 258 A 23 ALA HB% A 40 LYS H 1.0 2.3 4.6 308 259 A 24 ALA HA A 24 ALA H 1.0 1.8 3.0 309 260 A 24 ALA HB% A 24 ALA H 1.0 1.8 3.5 310 261 A 25 GLN HA A 24 ALA H 1.0 2.3 6.5 311 262 A 25 GLN HGx A 24 ALA H 1.0 2.8 5.0 312 263 A 25 GLN HBy A 24 ALA H 1.0 2.3 4.1 313 264 A 24 ALA H A 25 GLN H 1.0 2.3 3.6 314 265 A 25 GLN HGy A 24 ALA H 1.0 2.3 4.1 315 266 A 25 GLN HBx A 24 ALA H 1.0 3.3 6.0 316 267 A 24 ALA HB% A 25 GLN H 1.0 2.8 4.5 317 268 A 24 ALA HA A 25 GLN H 1.0 2.3 4.1 318 269 A 24 ALA HA A 26 CYS H 1.0 1.8 5.0 319 270 A 24 ALA HB% A 26 CYS H 1.0 2.3 4.6 320 271 A 24 ALA H A 39 MET HBx 1.0 2.3 6.5 321 272 A 80 PRO HGy A 24 ALA H 1.0 2.3 6.5 322 273 A 81 VAL HGy% A 24 ALA H 1.0 2.3 7.0 323 274 A 81 VAL HA A 24 ALA H 1.0 2.3 6.5 324 275 A 81 VAL HGx% A 24 ALA H 1.0 2.3 7.0 325 276 A 25 GLN HA A 25 GLN H 1.0 1.8 3.0 326 277 A 25 GLN HGy A 25 GLN H 1.0 1.8 3.1 327 278 A 25 GLN HGx A 25 GLN H 1.0 2.8 4.0 328 279 A 25 GLN HBy A 25 GLN H 1.0 1.8 3.0 329 280 A 25 GLN H A 25 GLN HE2x 1.0 2.8 5.0 330 281 A 25 GLN H A 25 GLN HE2y 1.0 3.3 6.0 331 282 A 25 GLN HBx A 25 GLN H 1.0 2.3 3.6 332 283 A 25 GLN HGy A 26 CYS H 1.0 1.8 5.0 333 284 A 25 GLN HA A 26 CYS H 1.0 2.3 3.6 334 285 A 25 GLN H A 26 CYS H 1.0 1.8 3.1 335 286 A 25 GLN HBx A 26 CYS H 1.0 2.8 4.1 336 287 A 26 CYS HA A 25 GLN H 1.0 2.8 5.0 337 288 A 25 GLN HA A 27 ARG H 1.0 2.3 6.5 338 289 A 80 PRO HGy A 25 GLN H 1.0 2.3 6.5 339 290 A 81 VAL HGy% A 25 GLN H 1.0 2.3 7.0 340 291 A 81 VAL HA A 25 GLN H 1.0 2.3 6.5 341 292 A 26 CYS HA A 26 CYS H 1.0 1.8 3.0 342 293 A 26 CYS H A 26 CYS HBx 1.0 1.8 3.5 343 293 A 26 CYS HBy A 26 CYS H 1.0 1.8 3.5 344 294 A 27 ARG H A 26 CYS HBx 1.0 2.3 7.0 345 294 A 26 CYS HBy A 27 ARG H 1.0 2.3 7.0 346 295 A 26 CYS H A 27 ARG H 1.0 2.3 6.5 347 296 A 26 CYS HA A 27 ARG H 1.0 2.3 4.1 348 297 A 27 ARG HA A 26 CYS H 1.0 3.3 5.5 349 298 A 26 CYS HA A 28 ASN H 1.0 2.8 5.0 350 299 A 26 CYS H A 28 ASN H 1.0 2.8 5.0 351 300 A 28 ASN H A 26 CYS HBx 1.0 2.3 4.6 352 300 A 26 CYS HBy A 28 ASN H 1.0 2.3 4.6 353 301 A 26 CYS HA A 29 ALA H 1.0 2.3 6.5 354 302 A 27 ARG HA A 27 ARG H 1.0 1.8 3.0 355 303 A 27 ARG H A 27 ARG HBx 1.0 2.3 6.5 356 304 A 27 ARG H A 27 ARG HDx 1.0 2.3 7.0 357 304 A 27 ARG HDy A 27 ARG H 1.0 2.3 7.0 358 305 A 27 ARG H A 27 ARG HGx 1.0 2.3 4.6 359 305 A 27 ARG HGy A 27 ARG H 1.0 2.3 4.6 360 306 A 27 ARG H A 28 ASN H 1.0 1.8 3.6 361 307 A 28 ASN HA A 27 ARG H 1.0 2.8 5.0 362 308 A 27 ARG H A 28 ASN HD2x 1.0 2.3 6.5 363 309 A 27 ARG HA A 28 ASN H 1.0 2.3 4.1 364 310 A 28 ASN H A 27 ARG HBy 1.0 2.3 4.6 365 310 A 28 ASN H A 27 ARG HBx 1.0 2.3 4.6 366 311 A 28 ASN H A 27 ARG HGx 1.0 2.3 4.6 367 311 A 27 ARG HGy A 28 ASN H 1.0 2.3 4.6 368 312 A 31 CYS H A 27 ARG HDx 1.0 2.3 7.0 369 312 A 27 ARG HDy A 31 CYS H 1.0 2.3 7.0 370 313 A 28 ASN HA A 28 ASN H 1.0 1.8 3.0 371 314 A 28 ASN HBx A 28 ASN H 1.0 1.8 3.0 372 315 A 28 ASN H A 28 ASN HBy 1.0 2.3 3.6 373 316 A 28 ASN HBx A 29 ALA H 1.0 2.3 6.5 374 317 A 28 ASN HA A 29 ALA H 1.0 2.3 4.1 375 318 A 28 ASN H A 29 ALA HA 1.0 2.8 5.0 376 319 A 28 ASN H A 29 ALA H 1.0 2.3 6.5 377 320 A 28 ASN H A 30 ASN H 1.0 1.8 5.0 378 321 A 28 ASN HBy A 30 ASN H 1.0 2.3 6.5 379 322 A 31 CYS H A 28 ASN HBy 1.0 2.8 5.0 380 323 A 28 ASN H A 31 CYS H 1.0 2.8 5.0 381 324 A 28 ASN H A 40 LYS HEx 1.0 2.3 6.5 382 324 A 40 LYS HEy A 28 ASN H 1.0 2.3 6.5 383 325 A 29 ALA H A 29 ALA HA 1.0 1.8 3.0 384 326 A 29 ALA HB% A 29 ALA H 1.0 1.8 5.5 385 327 A 29 ALA H A 30 ASN H 1.0 2.3 6.5 386 328 A 29 ALA HA A 30 ASN H 1.0 2.3 3.6 387 329 A 29 ALA HB% A 30 ASN H 1.0 1.8 3.5 388 330 A 29 ALA H A 31 CYS H 1.0 2.3 6.5 389 331 A 29 ALA HB% A 31 CYS H 1.0 2.3 7.0 390 332 A 30 ASN H A 30 ASN HA 1.0 1.8 3.0 391 333 A 30 ASN HBy A 30 ASN H 1.0 2.0 3.3 392 334 A 30 ASN H A 30 ASN HBx 1.0 2.3 3.6 393 335 A 31 CYS H A 30 ASN H 1.0 1.8 3.0 394 336 A 31 CYS H A 30 ASN HA 1.0 1.9 3.2 395 337 A 30 ASN HBy A 31 CYS H 1.0 2.8 5.0 396 338 A 31 CYS HA A 30 ASN H 1.0 1.8 5.0 397 339 A 31 CYS HA A 31 CYS H 1.0 1.8 3.0 398 340 A 31 CYS H A 31 CYS HBx 1.0 1.8 3.5 399 340 A 31 CYS HBy A 31 CYS H 1.0 1.8 3.5 400 341 A 31 CYS H A 32 SER H 1.0 2.3 6.5 401 342 A 32 SER H A 31 CYS HBx 1.0 2.3 6.5 402 342 A 31 CYS HBy A 32 SER H 1.0 2.3 6.5 403 343 A 31 CYS HA A 32 SER H 1.0 2.3 4.1 404 344 A 33 LEU H A 31 CYS HBx 1.0 2.3 4.1 405 344 A 31 CYS HBy A 33 LEU H 1.0 2.3 4.1 406 345 A 31 CYS HA A 33 LEU H 1.0 2.3 4.1 407 346 A 36 CYS H A 31 CYS HBx 1.0 2.8 5.0 408 346 A 31 CYS HBy A 36 CYS H 1.0 2.8 5.0 409 347 A 37 GLN H A 31 CYS HBx 1.0 2.3 6.5 410 347 A 31 CYS HBy A 37 GLN H 1.0 2.3 6.5 411 348 A 32 SER HA A 32 SER H 1.0 1.8 3.0 412 349 A 32 SER H A 32 SER HBx 1.0 2.3 7.0 413 349 A 32 SER HBy A 32 SER H 1.0 2.3 7.0 414 350 A 32 SER H A 33 LEU H 1.0 1.8 5.0 415 351 A 32 SER HA A 33 LEU H 1.0 2.3 4.1 416 352 A 33 LEU HA A 32 SER H 1.0 2.8 5.0 417 353 A 33 LEU HDx% A 32 SER H 1.0 2.3 7.0 418 354 A 36 CYS HBx A 32 SER H 1.0 2.3 6.5 419 355 A 65 ALA H A 64 ILE H 1.0 2.3 4.1 420 356 A 33 LEU HA A 33 LEU H 1.0 1.8 3.0 421 357 A 33 LEU H A 33 LEU HBy 1.0 1.8 3.0 422 358 A 33 LEU HG A 33 LEU H 1.0 1.8 3.0 423 359 A 33 LEU HDx% A 33 LEU H 1.0 2.8 4.5 424 360 A 34 PRO HA A 33 LEU H 1.0 2.3 6.5 425 361 A 33 LEU H A 34 PRO HDx 1.0 1.8 5.5 426 361 A 34 PRO HDy A 33 LEU H 1.0 1.8 5.5 427 362 A 35 SER H A 33 LEU HBy 1.0 2.3 6.5 428 363 A 33 LEU HA A 35 SER H 1.0 1.8 5.0 429 364 A 36 CYS H A 33 LEU H 1.0 2.3 4.1 430 365 A 36 CYS HBx A 33 LEU H 1.0 2.3 5.5 431 366 A 36 CYS HA A 33 LEU H 1.0 3.3 6.0 432 367 A 36 CYS HBy A 33 LEU H 1.0 2.3 4.1 433 368 A 33 LEU HA A 36 CYS H 1.0 2.3 4.1 434 369 A 36 CYS H A 33 LEU HBy 1.0 2.3 4.1 435 370 A 36 CYS H A 33 LEU HBx 1.0 2.8 4.0 436 371 A 33 LEU HDx% A 36 CYS H 1.0 2.3 4.6 437 372 A 37 GLN HGx A 33 LEU H 1.0 2.3 6.5 438 373 A 34 PRO HA A 35 SER H 1.0 2.3 6.5 439 374 A 36 CYS H A 34 PRO HBx 1.0 2.3 6.5 440 375 A 36 CYS H A 34 PRO HDx 1.0 1.8 5.5 441 375 A 34 PRO HDy A 36 CYS H 1.0 1.8 5.5 442 376 A 34 PRO HA A 36 CYS H 1.0 2.3 4.1 443 377 A 34 PRO HBy A 36 CYS H 1.0 2.3 6.5 444 378 A 37 GLN H A 34 PRO HBx 1.0 2.3 6.5 445 379 A 37 GLN H A 34 PRO HDx 1.0 1.8 5.5 446 379 A 34 PRO HDy A 37 GLN H 1.0 1.8 5.5 447 380 A 34 PRO HBy A 37 GLN H 1.0 2.3 6.0 448 381 A 34 PRO HBx A 38 LYS H 1.0 2.3 6.5 449 382 A 35 SER HA A 35 SER H 1.0 1.8 3.0 450 383 A 35 SER H A 35 SER HBy 1.0 2.3 7.0 451 383 A 35 SER HBx A 35 SER H 1.0 2.3 7.0 452 384 A 36 CYS H A 35 SER HBy 1.0 2.3 4.6 453 384 A 35 SER HBx A 36 CYS H 1.0 2.3 4.6 454 385 A 36 CYS H A 35 SER H 1.0 1.8 3.0 455 386 A 36 CYS HBx A 35 SER H 1.0 2.3 6.5 456 387 A 35 SER H A 37 GLN HBx 1.0 2.3 6.5 457 387 A 37 GLN HBy A 35 SER H 1.0 2.3 6.5 458 388 A 36 CYS HA A 36 CYS H 1.0 1.8 3.0 459 389 A 36 CYS HBy A 36 CYS H 1.0 1.8 3.0 460 390 A 36 CYS HBx A 36 CYS H 1.0 2.3 3.6 461 391 A 36 CYS H A 37 GLN HBx 1.0 2.8 5.0 462 391 A 37 GLN HBy A 36 CYS H 1.0 2.8 5.0 463 392 A 36 CYS H A 37 GLN H 1.0 2.8 4.1 464 393 A 36 CYS HA A 37 GLN H 1.0 2.3 4.1 465 394 A 36 CYS HBx A 37 GLN H 1.0 2.8 4.0 466 395 A 36 CYS H A 38 LYS H 1.0 2.3 4.1 467 396 A 36 CYS HBx A 38 LYS H 1.0 2.3 6.5 468 397 A 36 CYS HA A 38 LYS H 1.0 1.8 5.0 469 398 A 36 CYS H A 39 MET HBy 1.0 2.3 6.5 470 399 A 39 MET HGy A 36 CYS H 1.0 2.3 6.0 471 400 A 36 CYS H A 39 MET HBx 1.0 2.3 6.5 472 401 A 36 CYS HBx A 39 MET H 1.0 2.3 6.5 473 402 A 36 CYS H A 39 MET H 1.0 1.8 5.0 474 403 A 36 CYS HA A 39 MET H 1.0 2.3 4.1 475 404 A 36 CYS HBx A 40 LYS H 1.0 2.3 6.5 476 405 A 36 CYS HA A 40 LYS H 1.0 2.3 6.5 477 406 A 36 CYS HBy A 40 LYS H 1.0 2.3 6.5 478 407 A 37 GLN HA A 37 GLN H 1.0 1.8 3.0 479 408 A 37 GLN H A 37 GLN HBx 1.0 1.8 3.0 480 408 A 37 GLN HBy A 37 GLN H 1.0 1.8 3.0 481 409 A 37 GLN HGx A 37 GLN H 1.0 1.8 3.0 482 410 A 37 GLN HGy A 37 GLN H 1.0 1.8 3.0 483 411 A 37 GLN HGy A 38 LYS H 1.0 2.3 6.5 484 412 A 37 GLN H A 38 LYS H 1.0 2.8 4.0 485 413 A 38 LYS H A 37 GLN HBx 1.0 2.3 6.5 486 414 A 37 GLN H A 38 LYS HDx 1.0 2.8 5.1 487 414 A 38 LYS HDy A 37 GLN H 1.0 2.8 5.1 488 415 A 39 MET H A 37 GLN H 1.0 2.8 4.0 489 416 A 37 GLN HA A 39 MET H 1.0 2.3 4.1 490 417 A 40 LYS H A 37 GLN H 1.0 2.3 6.5 491 418 A 37 GLN HA A 40 LYS H 1.0 2.3 4.1 492 419 A 37 GLN H A 40 LYS HBy 1.0 2.3 6.5 493 420 A 37 GLN H A 40 LYS HDx 1.0 1.8 5.5 494 420 A 40 LYS HDy A 37 GLN H 1.0 1.8 5.5 495 421 A 37 GLN H A 40 LYS HGx 1.0 1.8 5.5 496 421 A 40 LYS HGy A 37 GLN H 1.0 1.8 5.5 497 422 A 38 LYS HA A 38 LYS H 1.0 1.8 3.0 498 423 A 38 LYS H A 38 LYS HGy 1.0 2.8 5.0 499 424 A 38 LYS H A 38 LYS HDx 1.0 1.8 3.0 500 424 A 38 LYS HDy A 38 LYS H 1.0 1.8 3.0 501 425 A 38 LYS H A 38 LYS HBx 1.0 1.8 3.5 502 425 A 38 LYS H A 38 LYS HBy 1.0 1.8 3.5 503 426 A 38 LYS HGx A 38 LYS H 1.0 1.8 5.0 504 427 A 39 MET H A 38 LYS HDx 1.0 2.3 4.1 505 427 A 38 LYS HDy A 39 MET H 1.0 2.3 4.1 506 428 A 39 MET H A 38 LYS H 1.0 2.3 4.0 507 429 A 39 MET H A 38 LYS HGy 1.0 2.3 6.5 508 429 A 38 LYS HGx A 39 MET H 1.0 2.3 6.5 509 430 A 38 LYS HA A 39 MET H 1.0 2.3 4.1 510 431 A 39 MET H A 38 LYS HBx 1.0 2.3 4.6 511 431 A 39 MET H A 38 LYS HBy 1.0 2.3 4.6 512 432 A 39 MET HA A 38 LYS H 1.0 2.3 6.5 513 433 A 38 LYS H A 39 MET HBx 1.0 2.3 7.0 514 433 A 38 LYS H A 39 MET HBy 1.0 2.3 7.0 515 434 A 40 LYS H A 38 LYS H 1.0 2.3 6.5 516 435 A 40 LYS HA A 38 LYS H 1.0 2.3 6.5 517 436 A 38 LYS H A 41 ARG H 1.0 2.8 5.0 518 437 A 38 LYS HA A 41 ARG H 1.0 2.3 4.1 519 438 A 42 VAL H A 38 LYS HGy 1.0 2.3 6.5 520 438 A 38 LYS HGx A 42 VAL H 1.0 2.3 6.5 521 439 A 38 LYS HA A 42 VAL H 1.0 1.8 5.0 522 440 A 42 VAL H A 38 LYS HDx 1.0 2.3 7.0 523 440 A 38 LYS HDy A 42 VAL H 1.0 2.3 7.0 524 441 A 39 MET HA A 39 MET H 1.0 1.8 3.0 525 442 A 39 MET H A 39 MET HBy 1.0 1.8 3.0 526 443 A 39 MET H A 39 MET HBx 1.0 2.3 3.5 527 444 A 39 MET HGx A 39 MET H 1.0 2.8 4.1 528 445 A 39 MET HGy A 39 MET H 1.0 2.3 4.1 529 446 A 40 LYS H A 39 MET HBx 1.0 2.3 4.1 530 447 A 39 MET H A 40 LYS H 1.0 1.8 3.1 531 448 A 39 MET HA A 40 LYS H 1.0 1.8 5.0 532 449 A 39 MET HGx A 40 LYS H 1.0 2.3 6.5 533 450 A 39 MET HGy A 40 LYS H 1.0 2.3 6.5 534 451 A 40 LYS H A 39 MET HBy 1.0 2.3 4.1 535 452 A 40 LYS HA A 39 MET H 1.0 2.3 6.5 536 453 A 39 MET H A 40 LYS HGx 1.0 2.3 6.5 537 453 A 40 LYS HGy A 39 MET H 1.0 2.3 6.5 538 454 A 39 MET H A 41 ARG H 1.0 2.3 4.1 539 455 A 39 MET HA A 41 ARG H 1.0 1.8 5.0 540 456 A 41 ARG H A 39 MET HBx 1.0 3.3 5.5 541 457 A 39 MET H A 42 VAL H 1.0 1.8 5.0 542 458 A 42 VAL H A 39 MET HBx 1.0 1.8 5.0 543 459 A 39 MET HA A 42 VAL H 1.0 2.8 4.0 544 460 A 42 VAL HGy% A 39 MET H 1.0 1.8 5.5 545 461 A 39 MET HA A 43 VAL H 1.0 1.8 5.0 546 462 A 39 MET H A 43 VAL H 1.0 2.5 6.0 547 463 A 40 LYS HA A 40 LYS H 1.0 1.8 3.0 548 464 A 40 LYS H A 40 LYS HEx 1.0 2.3 6.5 549 464 A 40 LYS HEy A 40 LYS H 1.0 2.3 6.5 550 465 A 40 LYS H A 40 LYS HGx 1.0 2.3 4.1 551 465 A 40 LYS HGy A 40 LYS H 1.0 2.3 4.1 552 466 A 40 LYS HBx A 40 LYS H 1.0 2.3 3.6 553 467 A 40 LYS H A 40 LYS HBy 1.0 1.8 3.0 554 468 A 40 LYS H A 40 LYS HDx 1.0 2.3 4.1 555 468 A 40 LYS HDy A 40 LYS H 1.0 2.3 4.1 556 469 A 41 ARG HBy A 40 LYS H 1.0 2.3 4.1 557 470 A 40 LYS H A 41 ARG H 1.0 2.5 4.0 558 471 A 40 LYS HA A 41 ARG H 1.0 2.3 4.1 559 472 A 40 LYS HBy A 41 ARG H 1.0 1.8 3.0 560 473 A 41 ARG H A 40 LYS HGx 1.0 2.3 4.1 561 473 A 40 LYS HGy A 41 ARG H 1.0 2.3 4.1 562 474 A 42 VAL HB A 40 LYS H 1.0 2.3 6.5 563 475 A 42 VAL HGx% A 40 LYS H 1.0 2.3 7.0 564 476 A 42 VAL HGy% A 40 LYS H 1.0 2.3 7.0 565 477 A 40 LYS HA A 42 VAL H 1.0 2.3 6.5 566 478 A 40 LYS H A 42 VAL H 1.0 2.3 6.5 567 479 A 40 LYS HBy A 42 VAL H 1.0 2.3 6.5 568 480 A 40 LYS H A 43 VAL H 1.0 2.3 6.5 569 481 A 40 LYS HA A 43 VAL H 1.0 2.3 4.1 570 482 A 40 LYS HBx A 43 VAL H 1.0 1.8 5.0 571 483 A 40 LYS HA A 44 GLN H 1.0 2.3 4.1 572 484 A 41 ARG HA A 41 ARG H 1.0 1.8 3.0 573 485 A 41 ARG H A 41 ARG HGx 1.0 2.3 4.6 574 485 A 41 ARG HGy A 41 ARG H 1.0 2.3 4.6 575 486 A 41 ARG H A 41 ARG HDx 1.0 2.3 4.6 576 486 A 41 ARG HDy A 41 ARG H 1.0 2.3 4.6 577 487 A 41 ARG HBx A 41 ARG H 1.0 1.8 3.0 578 488 A 41 ARG HBy A 41 ARG H 1.0 1.8 3.0 579 489 A 42 VAL H A 41 ARG HGx 1.0 2.3 7.0 580 489 A 41 ARG HGy A 42 VAL H 1.0 2.3 7.0 581 490 A 41 ARG HBy A 42 VAL H 1.0 2.3 3.6 582 491 A 41 ARG H A 42 VAL H 1.0 2.5 4.0 583 492 A 41 ARG HA A 42 VAL H 1.0 2.3 4.1 584 493 A 41 ARG HBx A 42 VAL H 1.0 1.8 3.0 585 494 A 42 VAL HA A 41 ARG H 1.0 2.3 6.5 586 495 A 42 VAL HGy% A 41 ARG H 1.0 2.3 6.5 587 496 A 42 VAL HB A 41 ARG H 1.0 2.3 6.5 588 497 A 42 VAL HGx% A 41 ARG H 1.0 2.3 6.5 589 498 A 43 VAL H A 41 ARG HDx 1.0 2.3 7.0 590 498 A 41 ARG HDy A 43 VAL H 1.0 2.3 7.0 591 499 A 41 ARG H A 43 VAL H 1.0 2.3 4.1 592 500 A 41 ARG HA A 44 GLN H 1.0 2.3 4.1 593 501 A 41 ARG H A 44 GLN HGx 1.0 2.3 4.1 594 501 A 44 GLN HGy A 41 ARG H 1.0 2.3 4.1 595 502 A 45 HIS H A 41 ARG HGx 1.0 2.8 5.1 596 502 A 41 ARG HGy A 45 HIS H 1.0 2.8 5.1 597 503 A 41 ARG HBx A 45 HIS H 1.0 2.3 6.5 598 504 A 41 ARG H A 45 HIS H 1.0 3.3 5.5 599 505 A 42 VAL HA A 42 VAL H 1.0 1.8 3.0 600 506 A 42 VAL HB A 42 VAL H 1.0 1.8 3.0 601 507 A 42 VAL HGy% A 42 VAL H 1.0 2.3 4.0 602 508 A 42 VAL HGx% A 42 VAL H 1.0 2.8 4.5 603 509 A 43 VAL HA A 42 VAL H 1.0 2.3 6.5 604 510 A 42 VAL H A 43 VAL H 1.0 2.8 4.0 605 511 A 42 VAL HA A 43 VAL H 1.0 1.8 5.0 606 512 A 42 VAL HB A 43 VAL H 1.0 1.8 3.0 607 513 A 42 VAL HA A 44 GLN H 1.0 1.8 5.0 608 514 A 42 VAL H A 44 GLN H 1.0 2.3 4.1 609 515 A 42 VAL H A 45 HIS H 1.0 2.3 4.1 610 516 A 42 VAL H A 45 HIS HBx 1.0 2.3 6.5 611 516 A 45 HIS HBy A 42 VAL H 1.0 2.3 6.5 612 517 A 42 VAL HA A 45 HIS H 1.0 2.8 4.0 613 518 A 42 VAL HGx% A 45 HIS H 1.0 2.3 7.0 614 519 A 42 VAL HB A 46 THR H 1.0 2.3 6.5 615 520 A 42 VAL HA A 46 THR H 1.0 2.3 6.5 616 521 A 42 VAL H A 46 THR H 1.0 2.3 5.5 617 522 A 59 ILE HD1% A 42 VAL H 1.0 2.3 7.0 618 523 A 42 VAL H A 59 ILE HG2% 1.0 2.3 7.0 619 524 A 42 VAL H B 23 TRP HBx 1.0 2.3 6.5 620 525 A 42 VAL H B 23 TRP HBy 1.0 2.3 6.5 621 526 A 43 VAL HA A 43 VAL H 1.0 1.8 3.0 622 527 A 43 VAL HB A 43 VAL H 1.0 1.8 3.0 623 528 A 43 VAL HGx% A 43 VAL H 1.0 2.8 4.5 624 529 A 44 GLN HA A 43 VAL H 1.0 2.3 6.5 625 530 A 43 VAL HGx% A 44 GLN H 1.0 2.8 4.5 626 531 A 43 VAL HA A 44 GLN H 1.0 2.3 4.1 627 532 A 43 VAL H A 44 GLN H 1.0 2.7 4.0 628 533 A 43 VAL H A 45 HIS HBx 1.0 2.3 6.5 629 533 A 45 HIS HBy A 43 VAL H 1.0 2.3 6.5 630 534 A 43 VAL HA A 45 HIS H 1.0 1.8 5.0 631 535 A 43 VAL HGx% A 45 HIS H 1.0 2.8 5.1 632 536 A 43 VAL H A 46 THR H 1.0 2.3 4.1 633 537 A 43 VAL HA A 46 THR H 1.0 2.3 6.5 634 538 A 43 VAL HGx% A 46 THR H 1.0 2.3 7.0 635 539 A 43 VAL HA A 47 LYS H 1.0 2.3 6.5 636 540 A 43 VAL HGx% A 47 LYS H 1.0 2.3 7.0 637 541 A 44 GLN HA A 44 GLN H 1.0 1.8 3.0 638 542 A 44 GLN H A 44 GLN HGx 1.0 1.8 3.0 639 542 A 44 GLN HGy A 44 GLN H 1.0 1.8 3.0 640 543 A 44 GLN H A 44 GLN HBx 1.0 1.8 3.0 641 543 A 44 GLN HBy A 44 GLN H 1.0 1.8 3.0 642 544 A 44 GLN H A 45 HIS H 1.0 2.8 4.0 643 545 A 44 GLN HA A 45 HIS H 1.0 2.3 3.6 644 546 A 45 HIS H A 44 GLN HGx 1.0 2.3 4.6 645 546 A 44 GLN HGy A 45 HIS H 1.0 2.3 4.6 646 547 A 45 HIS H A 44 GLN HBx 1.0 2.8 4.5 647 547 A 44 GLN HBy A 45 HIS H 1.0 2.8 4.5 648 548 A 44 GLN H A 46 THR H 1.0 2.3 6.5 649 549 A 44 GLN HA A 46 THR H 1.0 2.3 6.5 650 550 A 44 GLN HA A 47 LYS H 1.0 1.8 5.0 651 551 A 44 GLN H A 47 LYS H 1.0 1.8 5.0 652 552 A 45 HIS H A 45 HIS HA 1.0 1.8 3.0 653 553 A 45 HIS H A 45 HIS HBx 1.0 1.8 3.0 654 553 A 45 HIS HBy A 45 HIS H 1.0 1.8 3.0 655 554 A 45 HIS H A 46 THR H 1.0 1.8 5.0 656 555 A 46 THR HA A 45 HIS H 1.0 2.8 5.0 657 556 A 46 THR H A 45 HIS HBx 1.0 2.3 6.5 658 556 A 45 HIS HBy A 46 THR H 1.0 2.3 6.5 659 557 A 45 HIS H A 47 LYS H 1.0 2.3 6.5 660 558 A 47 LYS H A 45 HIS HBx 1.0 2.3 6.5 661 558 A 45 HIS HBy A 47 LYS H 1.0 2.3 6.5 662 559 A 48 GLY H A 45 HIS HBx 1.0 2.3 6.5 663 559 A 45 HIS HBy A 48 GLY H 1.0 2.3 6.5 664 560 A 45 HIS HA A 48 GLY H 1.0 1.8 5.0 665 561 A 45 HIS H A 48 GLY H 1.0 2.3 6.5 666 562 A 45 HIS HA A 49 CYS H 1.0 1.8 5.0 667 563 A 49 CYS H A 45 HIS HBx 1.0 2.3 7.0 668 563 A 45 HIS HBy A 49 CYS H 1.0 2.3 7.0 669 564 A 45 HIS H B 30 ASN HBx 1.0 2.0 6.5 670 565 B 26 LEU HDx% A 45 HIS H 1.0 2.0 6.5 671 566 A 46 THR HA A 46 THR H 1.0 1.8 3.0 672 567 A 46 THR H A 46 THR HB 1.0 2.3 4.1 673 568 A 46 THR HG2% A 46 THR H 1.0 2.8 4.5 674 569 A 46 THR H A 47 LYS H 1.0 2.3 4.1 675 570 A 46 THR HA A 47 LYS H 1.0 2.3 4.1 676 571 A 47 LYS H A 46 THR HB 1.0 2.3 4.1 677 572 A 46 THR H A 47 LYS HBx 1.0 2.3 6.5 678 572 A 47 LYS HBy A 46 THR H 1.0 2.3 6.5 679 573 A 46 THR HA A 48 GLY H 1.0 2.8 5.0 680 574 A 46 THR H A 48 GLY H 1.0 2.3 6.5 681 575 A 46 THR HA A 49 CYS H 1.0 2.8 4.0 682 576 A 46 THR H A 49 CYS H 1.0 2.3 6.5 683 577 A 46 THR H A 49 CYS HBx 1.0 2.3 6.5 684 577 A 49 CYS HBy A 46 THR H 1.0 2.3 6.5 685 578 A 47 LYS HA A 47 LYS H 1.0 1.8 3.0 686 579 A 47 LYS H A 47 LYS HGx 1.0 2.3 4.1 687 579 A 47 LYS HGy A 47 LYS H 1.0 2.3 4.1 688 580 A 47 LYS H A 47 LYS HBx 1.0 1.8 3.0 689 580 A 47 LYS HBy A 47 LYS H 1.0 1.8 3.0 690 581 A 47 LYS H A 47 LYS HDx 1.0 2.8 4.5 691 581 A 47 LYS HDy A 47 LYS H 1.0 2.8 4.5 692 582 A 47 LYS H A 47 LYS HEx 1.0 2.3 7.0 693 582 A 47 LYS HEy A 47 LYS H 1.0 2.3 7.0 694 583 A 47 LYS H A 48 GLY H 1.0 2.5 4.0 695 584 A 47 LYS HA A 48 GLY H 1.0 2.3 4.1 696 585 A 48 GLY H A 47 LYS HBx 1.0 2.3 4.6 697 585 A 47 LYS HBy A 48 GLY H 1.0 2.3 4.6 698 586 A 48 GLY H A 47 LYS HDx 1.0 2.3 7.0 699 586 A 47 LYS HDy A 48 GLY H 1.0 2.3 7.0 700 587 A 48 GLY H A 47 LYS HGx 1.0 2.3 7.0 701 587 A 47 LYS HGy A 48 GLY H 1.0 2.3 7.0 702 588 A 47 LYS H A 48 GLY HAy 1.0 2.3 6.5 703 589 A 47 LYS H A 48 GLY HAx 1.0 2.3 6.5 704 590 A 49 CYS H A 47 LYS HEx 1.0 2.3 7.0 705 590 A 47 LYS HEy A 49 CYS H 1.0 2.3 7.0 706 591 A 49 CYS H A 47 LYS HDx 1.0 2.3 6.5 707 591 A 47 LYS HDy A 49 CYS H 1.0 2.3 6.5 708 592 A 47 LYS H A 49 CYS H 1.0 2.8 4.0 709 593 A 47 LYS H A 49 CYS HBx 1.0 2.3 6.5 710 593 A 49 CYS HBy A 47 LYS H 1.0 2.3 6.5 711 594 A 47 LYS H A 52 LYS HEy 1.0 2.3 7.0 712 594 A 52 LYS HEx A 47 LYS H 1.0 2.3 7.0 713 595 A 63 LEU HDy% A 47 LYS H 1.0 2.3 7.0 714 596 A 48 GLY H A 48 GLY HAx 1.0 1.8 3.0 715 596 A 48 GLY H A 48 GLY HAy 1.0 1.8 3.0 716 597 A 48 GLY H A 49 CYS HBx 1.0 2.3 6.5 717 597 A 49 CYS HBy A 48 GLY H 1.0 2.3 6.5 718 598 A 48 GLY H A 49 CYS H 1.0 2.8 4.0 719 599 A 48 GLY H A 49 CYS HA 1.0 2.3 6.5 720 600 A 49 CYS H A 48 GLY HAx 1.0 2.3 4.1 721 601 A 49 CYS H A 48 GLY HAy 1.0 2.3 4.1 722 602 A 49 CYS H A 49 CYS HA 1.0 1.8 3.0 723 603 A 49 CYS H A 49 CYS HBx 1.0 1.8 3.5 724 603 A 49 CYS HBy A 49 CYS H 1.0 1.8 3.5 725 604 A 50 LYS H A 49 CYS HBx 1.0 2.3 6.5 726 604 A 49 CYS HBy A 50 LYS H 1.0 2.3 6.5 727 605 A 49 CYS H A 51 ARG H 1.0 2.3 6.5 728 606 A 51 ARG H A 49 CYS HBx 1.0 2.3 6.5 729 606 A 49 CYS HBy A 51 ARG H 1.0 2.3 6.5 730 607 A 50 LYS H A 50 LYS HA 1.0 1.8 3.0 731 608 A 50 LYS H A 50 LYS HGx 1.0 2.3 7.0 732 608 A 50 LYS H A 50 LYS HGy 1.0 2.3 7.0 733 609 A 50 LYS H A 50 LYS HEx 1.0 2.3 7.0 734 609 A 50 LYS H A 50 LYS HEy 1.0 2.3 7.0 735 610 A 50 LYS H A 50 LYS HBx 1.0 2.3 7.0 736 610 A 50 LYS HBy A 50 LYS H 1.0 2.3 7.0 737 611 A 50 LYS H A 51 ARG HDx 1.0 2.3 7.0 738 611 A 51 ARG HDy A 50 LYS H 1.0 2.3 7.0 739 612 A 50 LYS H A 51 ARG H 1.0 2.3 6.5 740 613 A 51 ARG HA A 50 LYS H 1.0 2.3 6.5 741 614 A 51 ARG H A 50 LYS HA 1.0 2.3 4.1 742 615 A 51 ARG H A 50 LYS HGx 1.0 2.3 7.0 743 615 A 51 ARG H A 50 LYS HGy 1.0 2.3 7.0 744 616 A 50 LYS H A 52 LYS H 1.0 2.3 6.5 745 617 A 51 ARG HA A 51 ARG H 1.0 1.8 3.0 746 618 A 51 ARG H A 51 ARG HDx 1.0 2.3 7.0 747 618 A 51 ARG HDy A 51 ARG H 1.0 2.3 7.0 748 619 A 51 ARG H A 51 ARG HBx 1.0 1.8 3.0 749 619 A 51 ARG HBy A 51 ARG H 1.0 1.8 3.0 750 620 A 51 ARG H A 51 ARG HGx 1.0 2.3 4.6 751 620 A 51 ARG HGy A 51 ARG H 1.0 2.3 4.6 752 621 A 51 ARG H A 52 LYS H 1.0 2.3 4.1 753 622 A 51 ARG H A 52 LYS HBx 1.0 2.3 7.0 754 622 A 52 LYS HBy A 51 ARG H 1.0 2.3 7.0 755 623 A 52 LYS HA A 51 ARG H 1.0 2.8 5.0 756 624 A 51 ARG HA A 52 LYS H 1.0 1.8 5.0 757 625 A 52 LYS H A 51 ARG HBx 1.0 1.8 5.5 758 625 A 51 ARG HBy A 52 LYS H 1.0 1.8 5.5 759 626 A 51 ARG H A 53 THR H 1.0 2.3 6.5 760 627 A 51 ARG H A 54 ASN H 1.0 2.3 6.5 761 628 A 51 ARG HA A 54 ASN H 1.0 2.3 6.5 762 629 A 51 ARG HA A 55 GLY H 1.0 2.3 6.5 763 630 A 55 GLY H A 51 ARG HDx 1.0 2.3 7.0 764 630 A 51 ARG HDy A 55 GLY H 1.0 2.3 7.0 765 631 A 51 ARG HA A 56 GLY H 1.0 2.8 5.0 766 632 A 60 CYS H A 51 ARG HDx 1.0 2.3 7.0 767 632 A 51 ARG HDy A 60 CYS H 1.0 2.3 7.0 768 633 A 52 LYS HA A 52 LYS H 1.0 1.8 3.0 769 634 A 52 LYS HGy A 52 LYS H 1.0 1.8 5.0 770 635 A 52 LYS H A 52 LYS HEy 1.0 2.3 7.0 771 635 A 52 LYS HEx A 52 LYS H 1.0 2.3 7.0 772 636 A 52 LYS H A 52 LYS HBx 1.0 1.8 3.5 773 636 A 52 LYS HBy A 52 LYS H 1.0 1.8 3.5 774 637 A 52 LYS HGx A 52 LYS H 1.0 2.3 4.1 775 638 A 52 LYS H A 53 THR H 1.0 2.3 6.5 776 639 A 53 THR HA A 52 LYS H 1.0 2.8 5.0 777 640 A 52 LYS HGy A 53 THR H 1.0 2.3 6.5 778 641 A 53 THR H A 52 LYS HBx 1.0 2.3 7.0 779 641 A 52 LYS HBy A 53 THR H 1.0 2.3 7.0 780 642 A 52 LYS HA A 53 THR H 1.0 2.3 4.1 781 643 A 52 LYS HA A 54 ASN H 1.0 2.3 6.5 782 644 A 52 LYS HGy A 54 ASN H 1.0 2.3 6.5 783 645 A 52 LYS H A 54 ASN H 1.0 2.8 4.0 784 646 A 52 LYS H A 55 GLY H 1.0 2.3 6.5 785 647 A 52 LYS HA A 55 GLY H 1.0 2.8 5.0 786 648 A 52 LYS HA A 56 GLY H 1.0 2.8 4.0 787 649 A 56 GLY H A 52 LYS HBx 1.0 2.3 7.0 788 649 A 52 LYS HBy A 56 GLY H 1.0 2.3 7.0 789 650 A 57 CYS H A 52 LYS HBx 1.0 2.3 7.0 790 650 A 52 LYS HBy A 57 CYS H 1.0 2.3 7.0 791 651 A 52 LYS HA A 57 CYS H 1.0 2.3 4.1 792 652 A 52 LYS H A 57 CYS H 1.0 2.3 6.5 793 653 A 52 LYS HA A 61 LYS H 1.0 2.3 6.5 794 654 A 53 THR HA A 53 THR H 1.0 1.8 3.0 795 655 A 53 THR HG2% A 53 THR H 1.0 2.3 7.0 796 656 A 53 THR H A 53 THR HB 1.0 2.3 4.1 797 657 A 53 THR HA A 54 ASN H 1.0 2.3 6.5 798 658 A 53 THR H A 54 ASN HA 1.0 2.3 6.5 799 659 A 53 THR HA A 55 GLY H 1.0 1.8 5.0 800 660 A 53 THR H A 55 GLY H 1.0 2.3 6.5 801 661 A 53 THR HA A 56 GLY H 1.0 2.8 5.0 802 662 A 53 THR H A 56 GLY H 1.0 2.8 5.0 803 663 A 53 THR H A 57 CYS H 1.0 2.3 5.5 804 664 A 53 THR HA A 57 CYS H 1.0 3.3 6.5 805 665 A 60 CYS HBy A 53 THR H 1.0 2.3 6.5 806 666 A 64 ILE HD1% A 53 THR H 1.0 2.3 7.0 807 667 A 54 ASN H A 54 ASN HA 1.0 1.8 3.0 808 668 A 54 ASN H A 54 ASN HBx 1.0 2.3 6.5 809 668 A 54 ASN HBy A 54 ASN H 1.0 2.3 6.5 810 669 A 55 GLY H A 54 ASN HA 1.0 2.3 6.5 811 670 A 55 GLY H A 54 ASN HBx 1.0 2.3 6.5 812 670 A 54 ASN HBy A 55 GLY H 1.0 2.3 6.5 813 671 A 54 ASN H A 55 GLY H 1.0 2.3 6.5 814 672 A 54 ASN H A 56 GLY H 1.0 2.3 6.5 815 673 A 54 ASN H A 57 CYS H 1.0 2.3 6.5 816 674 A 57 CYS H A 54 ASN HBx 1.0 2.3 7.0 817 674 A 54 ASN HBy A 57 CYS H 1.0 2.3 7.0 818 675 A 55 GLY H A 55 GLY HAx 1.0 1.8 3.0 819 675 A 55 GLY HAy A 55 GLY H 1.0 1.8 3.0 820 676 A 55 GLY H A 56 GLY H 1.0 2.3 6.5 821 677 A 56 GLY H A 55 GLY HAx 1.0 2.3 4.6 822 677 A 55 GLY HAy A 56 GLY H 1.0 2.3 4.6 823 678 A 57 CYS HBy A 55 GLY H 1.0 2.3 6.5 824 679 A 55 GLY H A 57 CYS H 1.0 2.3 6.5 825 680 A 57 CYS HA A 55 GLY H 1.0 3.3 6.5 826 681 A 56 GLY H A 56 GLY HAx 1.0 1.8 3.0 827 681 A 56 GLY HAy A 56 GLY H 1.0 1.8 3.0 828 682 A 56 GLY H A 57 CYS H 1.0 2.2 3.5 829 683 A 57 CYS H A 56 GLY HAx 1.0 2.3 4.6 830 683 A 56 GLY HAy A 57 CYS H 1.0 2.3 4.6 831 684 A 57 CYS HBy A 56 GLY H 1.0 2.3 6.5 832 685 A 57 CYS HA A 56 GLY H 1.0 3.3 5.5 833 686 A 57 CYS HBx A 56 GLY H 1.0 2.3 6.5 834 687 A 60 CYS HBy A 56 GLY H 1.0 2.3 6.5 835 688 A 57 CYS HA A 57 CYS H 1.0 1.8 3.0 836 689 A 57 CYS HBy A 57 CYS H 1.0 1.8 3.0 837 690 A 57 CYS HBx A 57 CYS H 1.0 1.8 3.0 838 691 A 57 CYS H A 58 PRO HA 1.0 2.3 6.5 839 692 A 57 CYS H A 58 PRO HDy 1.0 1.8 5.0 840 693 A 57 CYS H A 58 PRO HGx 1.0 2.3 6.5 841 694 A 60 CYS H A 57 CYS H 1.0 2.8 4.0 842 695 A 57 CYS HBy A 60 CYS H 1.0 1.8 5.0 843 696 A 60 CYS HA A 57 CYS H 1.0 3.3 5.5 844 697 A 57 CYS H A 61 LYS HBy 1.0 2.3 6.5 845 698 A 57 CYS H A 61 LYS HBx 1.0 2.8 8.0 846 699 A 57 CYS HA A 61 LYS H 1.0 2.3 6.5 847 700 A 57 CYS H A 61 LYS H 1.0 2.3 4.1 848 701 A 57 CYS HBy A 61 LYS H 1.0 1.8 5.0 849 702 B 27 PRO HDy A 57 CYS H 1.0 2.3 6.7 850 703 B 27 PRO HDx A 57 CYS H 1.0 2.3 6.7 851 704 A 57 CYS H B 27 PRO HBx 1.0 2.3 6.5 852 705 A 58 PRO HBx A 59 ILE H 1.0 2.3 4.1 853 706 A 59 ILE H A 58 PRO HBy 1.0 2.3 4.1 854 707 A 60 CYS H A 58 PRO HDx 1.0 2.3 6.5 855 708 A 60 CYS H A 58 PRO HDy 1.0 2.3 6.5 856 709 A 58 PRO HBx A 60 CYS H 1.0 2.3 6.5 857 710 A 58 PRO HGy A 60 CYS H 1.0 2.3 6.5 858 711 A 61 LYS H A 58 PRO HA 1.0 2.3 6.5 859 712 A 58 PRO HBx A 61 LYS H 1.0 2.3 6.5 860 713 A 61 LYS H A 58 PRO HBy 1.0 2.3 5.5 861 714 A 58 PRO HA A 62 GLN H 1.0 2.3 6.5 862 715 A 59 ILE HA A 59 ILE H 1.0 1.8 3.0 863 716 A 59 ILE HB A 59 ILE H 1.0 1.8 3.0 864 717 A 59 ILE H A 59 ILE HG1x 1.0 2.3 3.5 865 718 A 59 ILE H A 59 ILE HG1y 1.0 1.8 5.0 866 719 A 59 ILE HG2% A 59 ILE H 1.0 2.3 4.6 867 720 A 59 ILE HD1% A 59 ILE H 1.0 2.8 5.1 868 721 A 59 ILE HA A 60 CYS H 1.0 2.3 6.5 869 722 A 59 ILE HB A 60 CYS H 1.0 2.8 4.0 870 723 A 60 CYS H A 59 ILE HG1x 1.0 1.8 5.0 871 724 A 59 ILE HG2% A 60 CYS H 1.0 2.3 4.6 872 725 A 59 ILE HD1% A 60 CYS H 1.0 2.3 7.0 873 726 A 60 CYS H A 59 ILE H 1.0 2.0 5.0 874 727 A 60 CYS HA A 59 ILE H 1.0 2.8 5.0 875 728 A 59 ILE HA A 61 LYS H 1.0 2.8 4.6 876 729 B 25 LEU HA A 59 ILE H 1.0 2.3 6.5 877 730 A 60 CYS HA A 60 CYS H 1.0 1.8 3.0 878 731 A 60 CYS HBx A 60 CYS H 1.0 2.3 4.1 879 732 A 60 CYS HBy A 60 CYS H 1.0 2.3 4.1 880 733 A 60 CYS H A 61 LYS HBy 1.0 2.3 6.5 881 733 A 60 CYS H A 61 LYS HBx 1.0 2.3 6.5 882 734 A 60 CYS H A 61 LYS H 1.0 2.3 3.6 883 735 A 60 CYS HA A 61 LYS H 1.0 2.3 4.1 884 736 A 60 CYS HBx A 61 LYS H 1.0 2.3 4.1 885 737 A 60 CYS H A 62 GLN H 1.0 2.3 6.5 886 738 A 60 CYS HBx A 62 GLN H 1.0 2.3 6.5 887 739 A 60 CYS H A 63 LEU H 1.0 2.3 6.5 888 740 A 64 ILE H A 60 CYS H 1.0 3.3 5.5 889 741 A 60 CYS HBx A 64 ILE H 1.0 2.3 6.5 890 742 A 61 LYS HA A 61 LYS H 1.0 1.8 3.0 891 743 A 61 LYS H A 61 LYS HBx 1.0 1.8 3.1 892 744 A 61 LYS H A 61 LYS HEx 1.0 2.3 4.1 893 744 A 61 LYS HEy A 61 LYS H 1.0 2.3 4.1 894 745 A 61 LYS H A 61 LYS HGy 1.0 2.3 4.5 895 746 A 61 LYS H A 61 LYS HGx 1.0 2.3 4.5 896 747 A 61 LYS H A 61 LYS HBy 1.0 1.8 3.1 897 748 A 61 LYS H A 62 GLN HGx 1.0 2.3 7.0 898 748 A 62 GLN HGy A 61 LYS H 1.0 2.3 7.0 899 749 A 61 LYS H A 62 GLN H 1.0 2.3 4.1 900 750 A 62 GLN H A 61 LYS HDx 1.0 2.3 7.0 901 750 A 61 LYS HDy A 62 GLN H 1.0 2.3 7.0 902 751 A 62 GLN H A 61 LYS HGx 1.0 2.3 7.0 903 751 A 62 GLN H A 61 LYS HGy 1.0 2.3 7.0 904 752 A 61 LYS H A 63 LEU H 1.0 2.8 4.0 905 753 A 61 LYS HA A 64 ILE H 1.0 2.3 4.1 906 754 A 64 ILE HD1% A 61 LYS H 1.0 2.3 7.0 907 755 A 64 ILE H A 61 LYS H 1.0 2.8 4.6 908 756 A 61 LYS HA A 65 ALA H 1.0 2.3 6.5 909 757 A 62 GLN HA A 62 GLN H 1.0 1.8 3.0 910 758 A 62 GLN H A 62 GLN HBx 1.0 2.3 7.0 911 758 A 62 GLN HBy A 62 GLN H 1.0 2.3 7.0 912 759 A 62 GLN H A 62 GLN HGx 1.0 2.3 7.0 913 759 A 62 GLN HGy A 62 GLN H 1.0 2.3 7.0 914 760 A 63 LEU H A 62 GLN HGx 1.0 2.3 7.0 915 760 A 62 GLN HGy A 63 LEU H 1.0 2.3 7.0 916 761 A 63 LEU H A 62 GLN HBx 1.0 2.3 7.0 917 761 A 62 GLN HBy A 63 LEU H 1.0 2.3 7.0 918 762 A 62 GLN H A 63 LEU H 1.0 2.3 6.5 919 763 A 62 GLN H A 63 LEU HBy 1.0 2.3 6.5 920 763 A 63 LEU HBx A 62 GLN H 1.0 2.3 6.5 921 764 A 64 ILE H A 62 GLN H 1.0 2.3 6.5 922 765 A 65 ALA H A 62 GLN HBx 1.0 2.3 7.0 923 765 A 62 GLN HBy A 65 ALA H 1.0 2.3 7.0 924 766 A 65 ALA H A 62 GLN H 1.0 2.8 5.0 925 767 A 66 LEU H A 62 GLN HBx 1.0 2.3 7.0 926 767 A 62 GLN HBy A 66 LEU H 1.0 2.3 7.0 927 768 A 63 LEU HA A 63 LEU H 1.0 1.8 3.0 928 769 A 63 LEU HDy% A 63 LEU H 1.0 2.3 7.0 929 770 A 63 LEU H A 63 LEU HBy 1.0 1.8 3.0 930 770 A 63 LEU HBx A 63 LEU H 1.0 1.8 3.0 931 771 A 63 LEU HDx% A 63 LEU H 1.0 1.8 5.5 932 772 A 63 LEU HG A 63 LEU H 1.0 2.3 6.5 933 773 A 64 ILE H A 63 LEU HBy 1.0 1.8 3.0 934 773 A 63 LEU HBx A 64 ILE H 1.0 1.8 3.0 935 774 A 64 ILE H A 63 LEU H 1.0 2.3 4.1 936 775 A 63 LEU HDy% A 64 ILE H 1.0 1.8 6.5 937 776 A 63 LEU H A 64 ILE HG1y 1.0 2.3 7.0 938 776 A 63 LEU H A 64 ILE HG1x 1.0 2.3 7.0 939 777 A 65 ALA H A 63 LEU HBy 1.0 2.3 6.5 940 777 A 63 LEU HBx A 65 ALA H 1.0 2.3 6.5 941 778 A 65 ALA H A 63 LEU H 1.0 2.3 6.5 942 779 A 63 LEU H A 66 LEU H 1.0 2.3 6.5 943 780 A 63 LEU HDx% A 67 ALA H 1.0 2.3 7.0 944 781 A 67 ALA H A 63 LEU H 1.0 2.3 6.5 945 782 A 63 LEU HA A 67 ALA H 1.0 1.8 5.0 946 783 A 64 ILE HA A 64 ILE H 1.0 1.8 3.0 947 784 A 64 ILE H A 64 ILE HG1x 1.0 2.3 3.6 948 785 A 64 ILE HG2% A 64 ILE H 1.0 2.7 4.5 949 786 A 64 ILE HD1% A 64 ILE H 1.0 2.0 5.1 950 787 A 64 ILE HB A 64 ILE H 1.0 2.3 3.6 951 788 A 64 ILE H A 64 ILE HG1y 1.0 2.3 4.1 952 789 A 64 ILE HG2% A 65 ALA H 1.0 2.3 6.0 953 790 A 64 ILE HD1% A 65 ALA H 1.0 2.3 7.0 954 791 A 64 ILE HA A 65 ALA H 1.0 2.3 6.5 955 792 A 65 ALA H A 64 ILE HG1y 1.0 2.3 7.0 956 792 A 65 ALA H A 64 ILE HG1x 1.0 2.3 7.0 957 793 A 65 ALA H A 64 ILE H 1.0 2.3 4.1 958 794 A 64 ILE HB A 65 ALA H 1.0 1.8 5.0 959 795 A 64 ILE HA A 66 LEU H 1.0 2.3 6.5 960 796 A 64 ILE HA A 67 ALA H 1.0 2.3 6.5 961 797 A 67 ALA H A 64 ILE H 1.0 1.8 5.0 962 798 A 65 ALA HA A 65 ALA H 1.0 1.8 3.0 963 799 A 65 ALA HB% A 65 ALA H 1.0 1.8 3.5 964 800 A 65 ALA H A 66 LEU HA 1.0 2.3 6.5 965 801 A 65 ALA H A 66 LEU H 1.0 2.3 6.5 966 802 A 67 ALA H A 65 ALA H 1.0 2.3 6.5 967 803 A 65 ALA HA A 67 ALA H 1.0 2.3 6.5 968 804 A 65 ALA H A 68 ALA H 1.0 2.3 4.1 969 805 A 66 LEU H A 66 LEU HA 1.0 1.8 3.0 970 806 A 66 LEU HG A 66 LEU H 1.0 1.8 5.0 971 807 A 66 LEU HDx% A 66 LEU H 1.0 2.3 7.0 972 808 A 66 LEU H A 66 LEU HBx 1.0 2.3 4.6 973 808 A 66 LEU H A 66 LEU HBy 1.0 2.3 4.6 974 809 A 67 ALA H A 66 LEU H 1.0 2.3 6.5 975 810 A 66 LEU HG A 67 ALA H 1.0 2.3 4.5 976 811 A 69 TYR H A 66 LEU H 1.0 1.8 5.0 977 812 A 67 ALA HA A 67 ALA H 1.0 1.8 3.0 978 813 A 67 ALA HB% A 67 ALA H 1.0 1.8 3.5 979 814 A 67 ALA H A 68 ALA H 1.0 2.3 4.1 980 815 A 67 ALA HA A 68 ALA H 1.0 2.3 4.1 981 816 A 67 ALA HB% A 68 ALA H 1.0 2.3 4.6 982 817 A 69 TYR H A 67 ALA H 1.0 2.3 6.5 983 818 A 67 ALA HA A 69 TYR H 1.0 2.3 6.5 984 819 A 67 ALA H A 70 HIS H 1.0 2.3 6.5 985 820 A 83 PHE HBy A 67 ALA H 1.0 2.3 6.5 986 821 A 67 ALA HA A 84 CYS H 1.0 2.3 6.5 987 822 A 87 ILE HD1% A 67 ALA H 1.0 1.8 5.5 988 823 A 68 ALA HA A 68 ALA H 1.0 1.8 3.0 989 824 A 68 ALA HB% A 68 ALA H 1.0 1.8 3.5 990 825 A 69 TYR HA A 68 ALA H 1.0 2.3 6.5 991 826 A 69 TYR H A 68 ALA H 1.0 2.3 4.1 992 827 A 68 ALA HA A 69 TYR H 1.0 1.8 5.0 993 828 A 70 HIS H A 68 ALA H 1.0 2.3 4.1 994 829 A 68 ALA HA A 71 ALA H 1.0 2.3 6.5 995 830 A 68 ALA H A 71 ALA H 1.0 1.8 5.0 996 831 A 68 ALA HA A 72 LYS H 1.0 1.8 5.0 997 832 A 68 ALA H A 83 PHE HBx 1.0 2.3 6.5 998 833 A 69 TYR HA A 69 TYR H 1.0 1.8 3.0 999 834 A 69 TYR H A 69 TYR HBx 1.0 2.3 7.0 1000 834 A 69 TYR HBy A 69 TYR H 1.0 2.3 7.0 1001 835 A 69 TYR HA A 70 HIS H 1.0 2.3 6.5 1002 836 A 69 TYR H A 70 HIS H 1.0 2.8 4.0 1003 837 A 70 HIS HA A 69 TYR H 1.0 2.3 6.5 1004 838 A 69 TYR H A 71 ALA H 1.0 2.3 6.5 1005 839 A 69 TYR H A 72 LYS H 1.0 2.3 6.5 1006 840 A 69 TYR HA A 72 LYS H 1.0 2.3 6.5 1007 841 A 69 TYR HA A 73 HIS H 1.0 1.8 5.0 1008 842 A 70 HIS HA A 70 HIS H 1.0 1.8 3.0 1009 843 A 70 HIS H A 70 HIS HBy 1.0 2.3 6.5 1010 844 A 70 HIS HBx A 70 HIS H 1.0 2.3 6.5 1011 845 A 70 HIS H A 71 ALA H 1.0 2.3 6.5 1012 846 A 70 HIS HA A 71 ALA H 1.0 2.3 6.5 1013 847 A 70 HIS HA A 72 LYS H 1.0 2.3 6.5 1014 848 A 70 HIS H A 72 LYS H 1.0 2.3 6.5 1015 849 A 70 HIS H A 73 HIS H 1.0 2.3 6.5 1016 850 A 70 HIS HA A 73 HIS H 1.0 1.8 5.0 1017 851 A 71 ALA HA A 71 ALA H 1.0 1.8 3.0 1018 852 A 71 ALA HB% A 71 ALA H 1.0 2.3 7.0 1019 853 A 71 ALA H A 72 LYS H 1.0 2.3 4.1 1020 854 A 71 ALA H A 73 HIS H 1.0 2.3 6.5 1021 855 A 71 ALA H A 74 CYS H 1.0 2.3 6.5 1022 856 A 71 ALA HA A 74 CYS H 1.0 2.3 4.1 1023 857 A 71 ALA HB% A 87 ILE H 1.0 2.3 4.6 1024 858 A 72 LYS HA A 72 LYS H 1.0 1.8 3.0 1025 859 A 72 LYS H A 72 LYS HGx 1.0 2.3 4.6 1026 859 A 72 LYS HGy A 72 LYS H 1.0 2.3 4.6 1027 860 A 72 LYS H A 72 LYS HBy 1.0 1.8 3.5 1028 860 A 72 LYS H A 72 LYS HBx 1.0 1.8 3.5 1029 861 A 72 LYS H A 72 LYS HEx 1.0 2.3 7.0 1030 861 A 72 LYS H A 72 LYS HEy 1.0 2.3 7.0 1031 862 A 72 LYS H A 72 LYS HDx 1.0 2.8 4.5 1032 862 A 72 LYS HDy A 72 LYS H 1.0 2.8 4.5 1033 863 A 73 HIS HA A 72 LYS H 1.0 2.8 5.0 1034 864 A 72 LYS H A 73 HIS H 1.0 2.8 4.0 1035 865 A 73 HIS H A 72 LYS HBy 1.0 2.3 4.6 1036 865 A 73 HIS H A 72 LYS HBx 1.0 2.3 4.6 1037 866 A 73 HIS H A 72 LYS HDx 1.0 2.3 4.6 1038 866 A 72 LYS HDy A 73 HIS H 1.0 2.3 4.6 1039 867 A 73 HIS H A 72 LYS HGx 1.0 2.3 7.0 1040 867 A 72 LYS HGy A 73 HIS H 1.0 2.3 7.0 1041 868 A 72 LYS HA A 73 HIS H 1.0 2.3 4.1 1042 869 A 72 LYS H A 74 CYS H 1.0 2.8 4.0 1043 870 A 72 LYS HA A 74 CYS H 1.0 1.8 5.0 1044 871 A 74 CYS H A 72 LYS HBy 1.0 2.3 6.5 1045 872 A 72 LYS H A 74 CYS HA 1.0 2.3 6.5 1046 873 A 87 ILE HG2% A 72 LYS H 1.0 2.3 7.0 1047 874 A 73 HIS HA A 73 HIS H 1.0 1.8 3.0 1048 875 A 73 HIS HBy A 73 HIS H 1.0 2.3 4.1 1049 876 A 73 HIS H A 73 HIS HBx 1.0 2.3 4.1 1050 877 A 73 HIS H A 74 CYS H 1.0 2.8 4.0 1051 878 A 73 HIS HA A 74 CYS H 1.0 1.8 5.0 1052 879 A 73 HIS HBy A 74 CYS H 1.0 2.3 6.5 1053 880 A 74 CYS H A 73 HIS HD2 1.0 2.3 7.0 1054 880 A 74 CYS H A 73 HIS HD1 1.0 2.3 7.0 1055 881 A 73 HIS H A 74 CYS HBx 1.0 2.3 7.0 1056 881 A 74 CYS HBy A 73 HIS H 1.0 2.3 7.0 1057 882 A 73 HIS H A 74 CYS HA 1.0 2.3 6.5 1058 883 A 73 HIS HA A 75 GLN H 1.0 2.8 5.0 1059 884 A 74 CYS H A 74 CYS HA 1.0 1.8 3.0 1060 885 A 74 CYS H A 74 CYS HBx 1.0 1.8 3.5 1061 885 A 74 CYS HBy A 74 CYS H 1.0 1.8 3.5 1062 886 A 74 CYS H A 75 GLN H 1.0 2.3 6.5 1063 887 A 74 CYS HA A 75 GLN H 1.0 1.8 3.0 1064 888 A 74 CYS H A 75 GLN HBx 1.0 2.3 6.5 1065 888 A 74 CYS H A 75 GLN HBy 1.0 2.3 6.5 1066 889 A 74 CYS HA A 76 GLU H 1.0 2.3 4.1 1067 890 A 74 CYS HA A 78 LYS H 1.0 2.3 6.5 1068 891 A 75 GLN HA A 75 GLN H 1.0 1.8 3.0 1069 892 A 75 GLN H A 75 GLN HGx 1.0 1.8 5.5 1070 892 A 75 GLN HGy A 75 GLN H 1.0 1.8 5.5 1071 893 A 75 GLN H A 75 GLN HBx 1.0 2.3 6.5 1072 894 A 75 GLN H A 75 GLN HBy 1.0 2.3 6.5 1073 895 A 75 GLN H A 76 GLU HBx 1.0 2.3 7.0 1074 895 A 75 GLN H A 76 GLU HBy 1.0 2.3 7.0 1075 896 A 76 GLU HA A 75 GLN H 1.0 2.8 5.0 1076 897 A 75 GLN H A 76 GLU H 1.0 2.3 6.5 1077 898 A 75 GLN HA A 76 GLU H 1.0 1.8 3.0 1078 899 A 76 GLU HA A 76 GLU H 1.0 1.8 3.0 1079 900 A 76 GLU H A 76 GLU HGx 1.0 1.8 5.5 1080 900 A 76 GLU HGy A 76 GLU H 1.0 1.8 5.5 1081 901 A 76 GLU H A 76 GLU HBx 1.0 2.3 7.0 1082 901 A 76 GLU H A 76 GLU HBy 1.0 2.3 7.0 1083 902 A 77 ASN H A 76 GLU HBx 1.0 2.3 7.0 1084 902 A 76 GLU HBy A 77 ASN H 1.0 2.3 7.0 1085 903 A 77 ASN HA A 76 GLU H 1.0 2.8 5.0 1086 904 A 76 GLU H A 78 LYS H 1.0 2.3 6.5 1087 905 A 78 LYS H A 76 GLU HGx 1.0 2.3 7.0 1088 905 A 76 GLU HGy A 78 LYS H 1.0 2.3 7.0 1089 906 A 78 LYS H A 76 GLU HBx 1.0 2.3 7.0 1090 906 A 78 LYS H A 76 GLU HBy 1.0 2.3 7.0 1091 907 A 77 ASN HA A 77 ASN H 1.0 1.8 3.0 1092 908 A 77 ASN H A 77 ASN HBy 1.0 2.3 7.0 1093 908 A 77 ASN H A 77 ASN HBx 1.0 2.3 7.0 1094 909 A 78 LYS H A 77 ASN HBy 1.0 2.3 7.0 1095 909 A 78 LYS H A 77 ASN HBx 1.0 2.3 7.0 1096 910 A 77 ASN HA A 78 LYS H 1.0 2.3 4.1 1097 911 A 77 ASN H A 79 CYS HBy 1.0 2.3 6.5 1098 912 A 78 LYS HA A 78 LYS H 1.0 1.8 3.0 1099 913 A 78 LYS HBx A 78 LYS H 1.0 2.3 6.5 1100 914 A 78 LYS H A 78 LYS HGx 1.0 2.3 7.0 1101 914 A 78 LYS HGy A 78 LYS H 1.0 2.3 7.0 1102 915 A 78 LYS H A 78 LYS HBy 1.0 1.8 5.0 1103 916 A 78 LYS H A 78 LYS HDx 1.0 2.3 7.0 1104 916 A 78 LYS HDy A 78 LYS H 1.0 2.3 7.0 1105 917 A 78 LYS HBx A 79 CYS H 1.0 2.3 6.5 1106 918 A 78 LYS HBy A 79 CYS H 1.0 2.3 4.1 1107 919 A 78 LYS H A 79 CYS H 1.0 2.3 6.5 1108 920 A 78 LYS H A 79 CYS HBy 1.0 2.3 6.5 1109 921 A 78 LYS H A 79 CYS HBx 1.0 2.3 6.5 1110 922 A 78 LYS H A 79 CYS HA 1.0 2.3 6.5 1111 923 A 81 VAL H A 78 LYS HEx 1.0 2.3 7.0 1112 923 A 78 LYS HEy A 81 VAL H 1.0 2.3 7.0 1113 924 A 81 VAL H A 78 LYS HDx 1.0 2.3 7.0 1114 924 A 78 LYS HDy A 81 VAL H 1.0 2.3 7.0 1115 925 A 81 VAL H A 78 LYS HGx 1.0 2.3 7.0 1116 925 A 78 LYS HGy A 81 VAL H 1.0 2.3 7.0 1117 926 A 78 LYS H A 81 VAL H 1.0 2.3 6.5 1118 927 A 78 LYS HA A 81 VAL H 1.0 2.3 6.5 1119 928 A 79 CYS H A 79 CYS HA 1.0 1.8 3.0 1120 929 A 79 CYS H A 79 CYS HBx 1.0 1.8 5.0 1121 930 A 79 CYS HBy A 79 CYS H 1.0 1.8 5.0 1122 931 A 79 CYS HBx A 81 VAL H 1.0 2.3 6.5 1123 932 A 84 CYS HBx A 79 CYS H 1.0 2.3 6.5 1124 933 A 79 CYS H A 85 LEU H 1.0 1.8 5.0 1125 934 A 80 PRO HDy A 81 VAL H 1.0 2.3 6.5 1126 935 A 80 PRO HDx A 81 VAL H 1.0 2.3 6.5 1127 936 A 80 PRO HBy A 81 VAL H 1.0 2.3 4.1 1128 937 A 80 PRO HA A 81 VAL H 1.0 1.8 5.0 1129 938 A 80 PRO HGy A 81 VAL H 1.0 2.3 6.5 1130 939 A 81 VAL HA A 81 VAL H 1.0 1.8 3.0 1131 940 A 81 VAL H A 81 VAL HB 1.0 2.3 4.1 1132 941 A 81 VAL HGx% A 81 VAL H 1.0 2.3 7.0 1133 942 A 82 PRO HA A 81 VAL H 1.0 2.3 6.5 1134 943 A 84 CYS HBx A 81 VAL H 1.0 2.3 6.5 1135 944 A 81 VAL HGx% A 84 CYS H 1.0 2.3 7.0 1136 945 A 81 VAL HA A 84 CYS H 1.0 2.3 6.5 1137 946 A 84 CYS H A 81 VAL HB 1.0 2.3 6.5 1138 947 A 85 LEU HDx% A 81 VAL H 1.0 2.3 7.0 1139 948 A 85 LEU H A 81 VAL HB 1.0 2.3 6.5 1140 949 A 82 PRO HBy A 83 PHE H 1.0 2.3 4.1 1141 950 A 82 PRO HBx A 83 PHE H 1.0 2.3 3.5 1142 951 A 83 PHE H A 82 PRO HGx 1.0 2.3 7.0 1143 951 A 83 PHE H A 82 PRO HGy 1.0 2.3 7.0 1144 952 A 83 PHE HA A 83 PHE H 1.0 1.8 3.0 1145 953 A 83 PHE HBy A 83 PHE H 1.0 2.3 6.5 1146 954 A 83 PHE HBx A 83 PHE H 1.0 2.3 6.5 1147 955 A 84 CYS H A 83 PHE HBx 1.0 2.3 6.5 1148 956 A 83 PHE HA A 84 CYS H 1.0 2.3 6.5 1149 957 A 84 CYS H A 83 PHE H 1.0 1.8 3.0 1150 958 A 83 PHE HBx A 85 LEU H 1.0 2.3 6.5 1151 959 A 83 PHE H A 86 ASN H 1.0 2.3 6.5 1152 960 A 83 PHE HA A 86 ASN H 1.0 2.3 6.5 1153 961 A 83 PHE HBy A 86 ASN H 1.0 2.3 6.5 1154 962 A 83 PHE HBx A 86 ASN H 1.0 1.8 5.0 1155 963 A 84 CYS H A 84 CYS HA 1.0 1.8 3.0 1156 964 A 84 CYS HBx A 84 CYS H 1.0 2.3 4.1 1157 965 A 84 CYS HBy A 84 CYS H 1.0 2.3 4.1 1158 966 A 84 CYS H A 85 LEU H 1.0 2.3 6.5 1159 967 A 84 CYS H A 86 ASN H 1.0 1.8 5.0 1160 968 A 85 LEU H A 85 LEU HA 1.0 1.8 3.0 1161 969 A 85 LEU H A 85 LEU HBy 1.0 2.3 4.1 1162 969 A 85 LEU HBx A 85 LEU H 1.0 2.3 4.1 1163 970 A 85 LEU H A 85 LEU HG 1.0 1.8 3.0 1164 971 A 85 LEU HDx% A 85 LEU H 1.0 2.3 4.6 1165 972 A 85 LEU H A 85 LEU HDy% 1.0 2.3 7.0 1166 973 A 85 LEU HDx% A 86 ASN H 1.0 2.3 4.6 1167 974 A 86 ASN H A 85 LEU HBy 1.0 2.3 4.1 1168 975 A 86 ASN H A 85 LEU HDy% 1.0 2.3 7.0 1169 976 A 85 LEU HBx A 86 ASN H 1.0 2.3 6.5 1170 977 A 85 LEU H A 86 ASN H 1.0 1.8 3.0 1171 978 A 86 ASN H A 85 LEU HA 1.0 2.3 4.1 1172 979 A 86 ASN H A 85 LEU HG 1.0 2.3 6.5 1173 980 A 88 LYS H A 85 LEU HBy 1.0 2.3 6.5 1174 980 A 85 LEU HBx A 88 LYS H 1.0 2.3 6.5 1175 981 A 86 ASN HA A 86 ASN H 1.0 1.8 3.0 1176 982 A 86 ASN HBx A 86 ASN H 1.0 2.3 3.5 1177 983 A 86 ASN H A 86 ASN HBy 1.0 1.8 3.0 1178 984 A 87 ILE H A 86 ASN H 1.0 2.3 4.0 1179 985 A 86 ASN HA A 87 ILE H 1.0 2.3 4.1 1180 986 A 86 ASN HBx A 87 ILE H 1.0 2.3 4.1 1181 987 A 87 ILE H A 86 ASN HBy 1.0 2.3 4.1 1182 988 A 87 ILE HA A 86 ASN H 1.0 2.3 6.0 1183 989 A 87 ILE HB A 86 ASN H 1.0 2.3 6.5 1184 990 A 86 ASN H A 87 ILE HG1y 1.0 2.8 4.5 1185 990 A 87 ILE HG1x A 86 ASN H 1.0 2.8 4.5 1186 991 A 86 ASN H A 88 LYS H 1.0 2.3 4.1 1187 992 A 86 ASN H A 89 GLN H 1.0 2.3 6.5 1188 993 A 86 ASN H A 90 LYS H 1.0 2.8 5.0 1189 994 A 87 ILE HA A 87 ILE H 1.0 1.8 3.0 1190 995 A 87 ILE H A 87 ILE HG1y 1.0 1.8 3.0 1191 996 A 87 ILE HB A 87 ILE H 1.0 1.8 3.0 1192 997 A 87 ILE HG1x A 87 ILE H 1.0 2.3 4.1 1193 998 A 87 ILE HG2% A 87 ILE H 1.0 2.8 5.1 1194 999 A 87 ILE HD1% A 87 ILE H 1.0 2.3 6.0 1195 1000 A 87 ILE H A 88 LYS H 1.0 1.8 5.0 1196 1001 A 87 ILE HA A 88 LYS H 1.0 2.3 6.5 1197 1002 A 87 ILE HG2% A 88 LYS H 1.0 2.3 7.0 1198 1003 A 87 ILE H A 89 GLN H 1.0 2.3 6.5 1199 1004 A 87 ILE H A 90 LYS H 1.0 2.8 4.1 1200 1005 A 88 LYS HA A 88 LYS H 1.0 1.8 3.0 1201 1006 A 88 LYS H A 88 LYS HBx 1.0 2.3 4.6 1202 1006 A 88 LYS HBy A 88 LYS H 1.0 2.3 4.6 1203 1007 A 88 LYS H A 88 LYS HGx 1.0 2.3 7.0 1204 1007 A 88 LYS HGy A 88 LYS H 1.0 2.3 7.0 1205 1008 A 88 LYS H A 90 LYS HBx 1.0 2.8 5.1 1206 1008 A 90 LYS HBy A 88 LYS H 1.0 2.8 5.1 1207 1009 A 89 GLN HA A 89 GLN H 1.0 1.8 3.0 1208 1010 A 89 GLN H A 89 GLN HGx 1.0 2.3 7.0 1209 1010 A 89 GLN H A 89 GLN HGy 1.0 2.3 7.0 1210 1011 A 89 GLN H A 89 GLN HBx 1.0 2.3 7.0 1211 1011 A 89 GLN HBy A 89 GLN H 1.0 2.3 7.0 1212 1012 A 90 LYS H A 89 GLN HBx 1.0 1.8 5.5 1213 1012 A 89 GLN HBy A 90 LYS H 1.0 1.8 5.5 1214 1013 A 90 LYS H A 89 GLN HGx 1.0 2.3 7.0 1215 1013 A 90 LYS H A 89 GLN HGy 1.0 2.3 7.0 1216 1014 A 89 GLN HA A 90 LYS H 1.0 2.3 3.6 1217 1015 A 90 LYS H A 90 LYS HA 1.0 1.8 3.0 1218 1016 A 90 LYS H A 90 LYS HBx 1.0 2.3 7.0 1219 1016 A 90 LYS HBy A 90 LYS H 1.0 2.3 7.0 1220 1017 A 90 LYS H A 90 LYS HDx 1.0 2.3 4.6 1221 1017 A 90 LYS H A 90 LYS HDy 1.0 2.3 4.6 1222 1018 A 90 LYS H A 90 LYS HGx 1.0 1.8 5.5 1223 1018 A 90 LYS HGy A 90 LYS H 1.0 1.8 5.5 1224 1019 A 90 LYS H A 90 LYS HEx 1.0 2.3 7.0 1225 1019 A 90 LYS HEy A 90 LYS H 1.0 2.3 7.0 1226 1020 B 2 GLU H B 2 GLU HA 1.0 1.8 3.0 1227 1021 B 3 GLU H B 3 GLU HA 1.0 1.8 3.0 1228 1022 B 3 GLU H B 4 PRO HBy 1.0 1.8 5.0 1229 1023 B 3 GLU H B 5 GLN HA 1.0 2.8 4.1 1230 1024 B 4 PRO HA B 5 GLN H 1.0 2.3 3.5 1231 1025 B 5 GLN HA B 5 GLN H 1.0 1.8 3.0 1232 1026 B 5 GLN H B 5 GLN HBx 1.0 2.3 4.6 1233 1026 B 5 GLN H B 5 GLN HBy 1.0 2.3 4.6 1234 1027 B 5 GLN HA B 6 SER H 1.0 1.8 3.1 1235 1028 B 7 ASP H B 5 GLN HBx 1.0 2.3 7.0 1236 1028 B 5 GLN HBy B 7 ASP H 1.0 2.3 7.0 1237 1029 B 6 SER H B 6 SER HA 1.0 1.8 3.0 1238 1030 B 6 SER H B 6 SER HBx 1.0 2.3 4.6 1239 1030 B 6 SER H B 6 SER HBy 1.0 2.3 4.6 1240 1031 B 7 ASP H B 6 SER HA 1.0 1.8 3.0 1241 1032 B 7 ASP H B 6 SER HBx 1.0 1.8 5.5 1242 1032 B 7 ASP H B 6 SER HBy 1.0 1.8 5.5 1243 1033 B 7 ASP HA B 7 ASP H 1.0 1.8 3.0 1244 1034 B 7 ASP H B 7 ASP HBx 1.0 2.3 4.1 1245 1035 B 7 ASP H B 7 ASP HBy 1.0 2.3 4.1 1246 1036 B 8 PRO HA B 9 SER H 1.0 2.3 3.6 1247 1037 B 9 SER H B 8 PRO HBx 1.0 1.8 5.0 1248 1038 B 9 SER H B 8 PRO HBy 1.0 2.3 4.1 1249 1039 B 9 SER HA B 9 SER H 1.0 1.8 3.0 1250 1040 B 9 SER H B 9 SER HBy 1.0 1.8 3.5 1251 1040 B 9 SER H B 9 SER HBx 1.0 1.8 3.5 1252 1041 B 9 SER H B 10 VAL H 1.0 1.8 3.0 1253 1042 B 9 SER HA B 10 VAL H 1.0 1.8 3.1 1254 1043 B 10 VAL H B 9 SER HBy 1.0 2.3 4.0 1255 1043 B 9 SER HBx B 10 VAL H 1.0 2.3 4.0 1256 1044 B 10 VAL HA B 9 SER H 1.0 2.8 5.0 1257 1045 B 9 SER H B 11 GLU H 1.0 2.3 6.5 1258 1046 B 10 VAL HA B 10 VAL H 1.0 1.8 3.0 1259 1047 B 10 VAL HB B 10 VAL H 1.0 2.3 3.5 1260 1048 B 10 VAL H B 10 VAL HGx% 1.0 2.8 4.5 1261 1049 B 10 VAL HGy% B 10 VAL H 1.0 2.3 4.6 1262 1050 B 10 VAL H B 11 GLU H 1.0 2.3 4.1 1263 1051 B 10 VAL HA B 11 GLU H 1.0 2.3 3.5 1264 1052 B 11 GLU H B 10 VAL HGx% 1.0 2.3 6.0 1265 1053 B 10 VAL HGy% B 11 GLU H 1.0 2.8 5.1 1266 1054 B 11 GLU HA B 11 GLU H 1.0 1.8 3.0 1267 1055 B 11 GLU H B 11 GLU HGy 1.0 2.3 4.6 1268 1055 B 11 GLU HGx B 11 GLU H 1.0 2.3 4.6 1269 1056 B 11 GLU H B 11 GLU HBx 1.0 1.8 3.5 1270 1056 B 11 GLU H B 11 GLU HBy 1.0 1.8 3.5 1271 1057 B 11 GLU H A 9 ARG HBx 1.0 2.3 6.5 1272 1057 A 9 ARG HBy B 11 GLU H 1.0 2.3 6.5 1273 1058 B 11 GLU H A 9 ARG HE 1.0 2.3 6.5 1274 1059 B 14 LEU H B 14 LEU HA 1.0 1.8 3.0 1275 1060 B 14 LEU HBy B 15 SER H 1.0 2.3 6.5 1276 1061 B 15 SER H B 14 LEU HG 1.0 1.8 5.0 1277 1062 B 14 LEU HDx% B 15 SER H 1.0 2.3 7.0 1278 1063 B 15 SER H B 15 SER HA 1.0 1.8 3.0 1279 1064 B 15 SER H B 15 SER HBx 1.0 2.3 4.6 1280 1064 B 15 SER H B 15 SER HBy 1.0 2.3 4.6 1281 1065 B 15 SER HA B 16 GLN H 1.0 2.3 3.5 1282 1066 B 15 SER HA B 18 THR H 1.0 2.3 6.5 1283 1067 A 12 SER HA B 15 SER H 1.0 2.3 6.5 1284 1068 B 16 GLN H B 16 GLN HA 1.0 1.8 3.0 1285 1069 B 16 GLN H B 17 GLU HA 1.0 2.3 4.1 1286 1070 B 17 GLU HA B 17 GLU H 1.0 1.8 3.0 1287 1071 B 18 THR H B 17 GLU H 1.0 1.8 5.0 1288 1072 B 18 THR H B 17 GLU HGx 1.0 1.8 5.5 1289 1072 B 17 GLU HGy B 18 THR H 1.0 1.8 5.5 1290 1073 B 18 THR H B 17 GLU HBx 1.0 1.8 3.5 1291 1073 B 17 GLU HBy B 18 THR H 1.0 1.8 3.5 1292 1074 B 17 GLU HA B 20 SER H 1.0 2.8 5.0 1293 1075 B 18 THR H B 18 THR HA 1.0 1.8 3.0 1294 1076 B 18 THR HB B 18 THR H 1.0 1.8 3.0 1295 1077 B 18 THR H B 18 THR HG2% 1.0 2.3 4.6 1296 1078 B 18 THR HB B 19 PHE H 1.0 2.3 6.5 1297 1079 B 18 THR H B 19 PHE H 1.0 2.3 4.1 1298 1080 B 18 THR H B 19 PHE HBx 1.0 2.3 7.0 1299 1080 B 18 THR H B 19 PHE HBy 1.0 2.3 7.0 1300 1081 B 18 THR H B 20 SER H 1.0 2.3 6.5 1301 1082 B 19 PHE H B 19 PHE HA 1.0 1.8 3.0 1302 1083 B 19 PHE H B 19 PHE HBx 1.0 2.3 4.6 1303 1083 B 19 PHE H B 19 PHE HBy 1.0 2.3 4.6 1304 1084 B 20 SER H B 19 PHE H 1.0 1.8 5.0 1305 1085 B 20 SER H B 19 PHE HD% 1.0 2.3 7.0 1306 1086 B 20 SER H B 19 PHE HA 1.0 2.3 6.5 1307 1087 B 20 SER H B 19 PHE HBx 1.0 2.3 4.6 1308 1087 B 20 SER H B 19 PHE HBy 1.0 2.3 4.6 1309 1088 B 20 SER H B 20 SER HA 1.0 1.8 3.0 1310 1089 B 20 SER H B 21 ASP H 1.0 2.3 4.1 1311 1090 B 20 SER HA B 21 ASP H 1.0 2.3 4.1 1312 1091 B 20 SER H B 21 ASP HA 1.0 2.3 6.5 1313 1092 B 21 ASP H B 21 ASP HA 1.0 1.8 3.0 1314 1093 B 21 ASP H B 21 ASP HBx 1.0 2.3 4.1 1315 1094 B 21 ASP H B 21 ASP HBy 1.0 2.3 4.1 1316 1095 B 21 ASP H B 22 LEU H 1.0 1.8 5.0 1317 1096 B 21 ASP HA B 22 LEU H 1.0 2.3 3.6 1318 1097 B 21 ASP HBx B 22 LEU H 1.0 2.3 4.1 1319 1098 B 21 ASP HBy B 22 LEU H 1.0 2.3 4.1 1320 1099 B 22 LEU HBy B 21 ASP H 1.0 2.3 6.5 1321 1100 B 22 LEU HDx% B 21 ASP H 1.0 2.3 7.0 1322 1101 B 21 ASP HA B 23 TRP H 1.0 2.3 6.5 1323 1102 B 21 ASP HA B 24 LYS H 1.0 2.3 6.5 1324 1103 B 21 ASP HBx B 24 LYS H 1.0 2.3 6.5 1325 1104 B 22 LEU HA B 22 LEU H 1.0 1.8 3.0 1326 1105 B 22 LEU HBx B 22 LEU H 1.0 2.3 3.5 1327 1106 B 22 LEU HG B 22 LEU H 1.0 1.8 3.0 1328 1107 B 22 LEU HBy B 22 LEU H 1.0 2.3 3.5 1329 1108 B 22 LEU HDx% B 22 LEU H 1.0 2.8 4.5 1330 1109 B 22 LEU HD21 B 22 LEU H 1.0 2.3 4.0 1331 1110 B 23 TRP HBx B 22 LEU H 1.0 2.3 6.5 1332 1111 B 22 LEU H B 23 TRP H 1.0 2.3 6.5 1333 1112 B 22 LEU HA B 23 TRP H 1.0 2.3 4.1 1334 1113 B 22 LEU HA B 24 LYS H 1.0 2.3 6.5 1335 1114 B 22 LEU HA B 25 LEU H 1.0 1.8 5.0 1336 1115 B 22 LEU HG B 25 LEU H 1.0 2.3 6.5 1337 1116 B 19 PHE HA B 22 LEU H 1.0 2.3 6.5 1338 1117 B 23 TRP H B 23 TRP HA 1.0 1.8 3.0 1339 1118 B 23 TRP HBx B 24 LYS H 1.0 1.8 5.0 1340 1119 B 23 TRP HBy B 24 LYS H 1.0 1.8 5.0 1341 1120 B 23 TRP HBx B 25 LEU H 1.0 2.3 6.5 1342 1121 B 23 TRP HA B 26 LEU H 1.0 1.8 5.0 1343 1122 A 39 MET HGy B 23 TRP H 1.0 2.3 7.0 1344 1123 B 23 TRP H A 38 LYS HBx 1.0 2.3 6.5 1345 1123 A 38 LYS HBy B 23 TRP H 1.0 2.3 6.5 1346 1124 B 23 TRP H A 38 LYS HGy 1.0 2.3 6.5 1347 1124 A 38 LYS HGx B 23 TRP H 1.0 2.3 6.5 1348 1125 B 24 LYS HA B 24 LYS H 1.0 1.8 3.0 1349 1126 B 24 LYS H B 24 LYS HBy 1.0 1.8 3.5 1350 1126 B 24 LYS HBx B 24 LYS H 1.0 1.8 3.5 1351 1127 B 24 LYS H B 24 LYS HDx 1.0 1.8 5.5 1352 1127 B 24 LYS HDy B 24 LYS H 1.0 1.8 5.5 1353 1128 B 24 LYS H B 24 LYS HGy 1.0 2.3 4.1 1354 1129 B 24 LYS HGx B 24 LYS H 1.0 2.3 3.6 1355 1130 B 24 LYS H B 25 LEU H 1.0 1.8 3.0 1356 1131 B 24 LYS HA B 25 LEU H 1.0 2.3 3.6 1357 1132 B 25 LEU HDy% B 24 LYS H 1.0 2.3 7.0 1358 1133 B 24 LYS HA B 26 LEU H 1.0 1.8 5.0 1359 1134 B 25 LEU HA B 25 LEU H 1.0 1.8 3.0 1360 1135 B 25 LEU HBx B 25 LEU H 1.0 2.3 3.5 1361 1136 B 25 LEU H B 25 LEU HBy 1.0 1.8 3.0 1362 1137 B 25 LEU H B 25 LEU HG 1.0 1.8 3.1 1363 1138 B 25 LEU HDx% B 25 LEU H 1.0 2.8 4.5 1364 1139 B 25 LEU HDy% B 25 LEU H 1.0 2.8 4.5 1365 1140 B 25 LEU H B 26 LEU H 1.0 1.8 3.0 1366 1141 B 25 LEU HA B 26 LEU H 1.0 2.3 4.1 1367 1142 B 25 LEU H A 59 ILE HG1x 1.0 2.3 7.0 1368 1142 B 25 LEU H A 59 ILE HG1y 1.0 2.3 7.0 1369 1143 B 26 LEU HA B 26 LEU H 1.0 1.8 3.0 1370 1144 B 26 LEU HG B 26 LEU H 1.0 1.8 3.0 1371 1145 B 26 LEU HBx B 26 LEU H 1.0 2.3 3.6 1372 1146 B 26 LEU HBy B 26 LEU H 1.0 2.3 3.5 1373 1147 B 26 LEU HDx% B 26 LEU H 1.0 2.8 4.5 1374 1148 B 26 LEU HDy% B 26 LEU H 1.0 2.8 4.5 1375 1149 B 27 PRO HDy B 26 LEU H 1.0 1.8 5.0 1376 1150 B 27 PRO HDx B 26 LEU H 1.0 1.8 5.0 1377 1151 B 26 LEU HBx B 28 GLU H 1.0 2.3 6.5 1378 1152 B 26 LEU HBy B 28 GLU H 1.0 2.3 6.5 1379 1153 B 26 LEU HA B 29 ASN H 1.0 2.3 6.5 1380 1154 B 26 LEU HG B 29 ASN H 1.0 2.3 6.5 1381 1155 B 27 PRO HA B 28 GLU H 1.0 2.3 3.5 1382 1156 B 27 PRO HDx B 28 GLU H 1.0 2.3 6.5 1383 1157 B 28 GLU HA B 28 GLU H 1.0 1.8 3.0 1384 1158 B 28 GLU H B 28 GLU HGy 1.0 2.3 4.6 1385 1158 B 28 GLU HGx B 28 GLU H 1.0 2.3 4.6 1386 1159 B 28 GLU H B 28 GLU HBx 1.0 1.8 3.5 1387 1159 B 28 GLU H B 28 GLU HBy 1.0 1.8 3.5 1388 1160 B 28 GLU H B 29 ASN H 1.0 2.3 6.5 1389 1161 B 28 GLU HA B 29 ASN H 1.0 2.3 3.5 1390 1162 B 29 ASN H B 28 GLU HGy 1.0 2.3 7.0 1391 1162 B 28 GLU HGx B 29 ASN H 1.0 2.3 7.0 1392 1163 B 29 ASN H B 28 GLU HBx 1.0 2.3 4.6 1393 1163 B 29 ASN H B 28 GLU HBy 1.0 2.3 4.6 1394 1164 B 28 GLU HA B 30 ASN H 1.0 2.8 5.0 1395 1165 B 30 ASN H B 28 GLU HBx 1.0 2.3 7.0 1396 1165 B 28 GLU HBy B 30 ASN H 1.0 2.3 7.0 1397 1166 B 29 ASN H B 29 ASN HA 1.0 1.8 3.0 1398 1167 B 29 ASN H B 29 ASN HBy 1.0 1.8 3.5 1399 1167 B 29 ASN H B 29 ASN HBx 1.0 1.8 3.5 1400 1168 B 29 ASN H A 45 HIS HE1 1.0 2.3 6.5 1401 1169 B 30 ASN HA B 30 ASN H 1.0 1.8 3.0 1402 1170 B 30 ASN H B 30 ASN HBy 1.0 2.3 4.6 1403 1170 B 30 ASN H B 30 ASN HBx 1.0 2.3 4.6 1404 1171 B 31 VAL H B 30 ASN HBy 1.0 2.3 4.6 1405 1171 B 30 ASN HBx B 31 VAL H 1.0 2.3 4.6 1406 1172 B 30 ASN H B 31 VAL H 1.0 1.8 5.0 1407 1173 B 32 LEU H B 30 ASN HBy 1.0 2.3 6.5 1408 1174 B 31 VAL HA B 31 VAL H 1.0 1.8 3.0 1409 1175 B 31 VAL H B 31 VAL HB 1.0 2.8 4.0 1410 1176 B 31 VAL HGx% B 31 VAL H 1.0 2.8 4.5 1411 1177 B 31 VAL H B 32 LEU H 1.0 2.8 5.0 1412 1178 B 31 VAL HA B 32 LEU H 1.0 2.3 3.6 1413 1179 B 32 LEU H B 31 VAL HB 1.0 1.8 5.0 1414 1180 B 31 VAL H B 32 LEU HBx 1.0 2.3 7.0 1415 1180 B 31 VAL H B 32 LEU HBy 1.0 2.3 7.0 1416 1181 B 31 VAL HA B 33 SER H 1.0 2.3 4.1 1417 1182 A 47 LYS H B 31 VAL H 1.0 2.3 7.0 1418 1183 B 31 VAL H A 45 HIS HD1 1.0 2.3 7.0 1419 1184 B 32 LEU HA B 32 LEU H 1.0 1.8 3.0 1420 1185 B 32 LEU H B 32 LEU HBx 1.0 1.8 3.5 1421 1185 B 32 LEU H B 32 LEU HBy 1.0 1.8 3.5 1422 1186 B 32 LEU HG B 32 LEU H 1.0 1.8 3.1 1423 1187 B 32 LEU HDx% B 32 LEU H 1.0 2.8 4.5 1424 1188 B 32 LEU HA B 33 SER H 1.0 2.3 3.6 1425 1189 B 33 SER H B 32 LEU HBx 1.0 2.3 4.6 1426 1189 B 32 LEU HBy B 33 SER H 1.0 2.3 4.6 1427 1190 B 32 LEU HG B 33 SER H 1.0 2.8 5.0 1428 1191 B 32 LEU HDx% B 33 SER H 1.0 2.3 6.0 1429 1192 A 48 GLY H B 32 LEU H 1.0 2.3 7.0 1430 1193 B 32 LEU H A 48 GLY HAx 1.0 2.3 6.5 1431 1194 B 33 SER HA B 33 SER H 1.0 1.8 3.0 1432 1195 B 33 SER H B 33 SER HBx 1.0 2.3 3.5 1433 1196 B 33 SER H B 33 SER HBy 1.0 2.3 3.5 1434 1197 B 34 PRO HA B 35 LEU H 1.0 1.8 3.0 1435 1198 B 35 LEU H B 34 PRO HDx 1.0 2.8 5.1 1436 1198 B 35 LEU H B 34 PRO HDy 1.0 2.8 5.1 1437 1199 B 34 PRO HBx B 35 LEU H 1.0 2.3 6.5 1438 1200 B 35 LEU H B 34 PRO HBy 1.0 2.3 4.1 1439 1201 B 35 LEU HA B 35 LEU H 1.0 1.8 3.0 1440 1202 B 35 LEU H B 35 LEU HBx 1.0 2.3 4.6 1441 1202 B 35 LEU H B 35 LEU HBy 1.0 2.3 4.6 1442 1203 B 35 LEU HG B 35 LEU H 1.0 1.8 3.0 1443 1204 B 35 LEU HDx% B 35 LEU H 1.0 2.3 7.0 1444 1205 B 37 SER H B 35 LEU HBx 1.0 2.3 7.0 1445 1205 B 35 LEU HBy B 37 SER H 1.0 2.3 7.0 1446 1206 B 37 SER H B 36 PRO HBy 1.0 1.8 5.0 1447 1207 B 38 GLN H B 36 PRO HGy 1.0 1.8 5.5 1448 1207 B 36 PRO HGx B 38 GLN H 1.0 1.8 5.5 1449 1208 B 37 SER H B 37 SER HA 1.0 1.8 3.0 1450 1209 B 37 SER H B 37 SER HBx 1.0 2.3 4.6 1451 1209 B 37 SER H B 37 SER HBy 1.0 2.3 4.6 1452 1210 B 38 GLN H B 37 SER HA 1.0 1.8 3.0 1453 1211 B 37 SER H B 38 GLN HA 1.0 2.3 5.5 1454 1212 B 38 GLN H B 38 GLN HA 1.0 1.8 3.0 1455 1213 B 38 GLN H B 39 ALA HA 1.0 2.8 5.0 1456 1214 B 39 ALA HA B 39 ALA H 1.0 1.8 3.0 1457 1215 A 22 HIS HD2 A 22 HIS HBy 1.0 1.8 5.5 1458 1215 A 22 HIS HBx A 22 HIS HD2 1.0 1.8 5.5 1459 1216 A 22 HIS HA A 22 HIS HD2 1.0 2.3 6.5 1460 1217 A 22 HIS HD2 A 33 LEU HBx 1.0 1.8 3.5 1461 1217 A 22 HIS HD2 A 33 LEU HBy 1.0 1.8 3.5 1462 1218 A 33 LEU HDx% A 22 HIS HE1 1.0 1.8 5.5 1463 1219 A 42 VAL HA A 45 HIS HD2 1.0 2.3 3.5 1464 1220 A 43 VAL HA A 83 PHE HE% 1.0 1.8 5.5 1465 1221 A 43 VAL HGx% A 83 PHE HE% 1.0 2.3 5.1 1466 1222 A 46 THR HA A 45 HIS HD2 1.0 2.3 4.1 1467 1223 A 59 ILE HG2% A 45 HIS HD2 1.0 1.8 3.5 1468 1224 A 59 ILE HD1% A 45 HIS HE1 1.0 1.8 5.5 1469 1225 A 46 THR HB A 83 PHE HZ 1.0 2.3 6.5 1470 1226 A 46 THR HG2% A 83 PHE HZ 1.0 2.3 4.6 1471 1227 A 46 THR HB A 83 PHE HE% 1.0 1.8 5.5 1472 1228 A 47 LYS HA A 83 PHE HE% 1.0 1.8 5.5 1473 1229 A 83 PHE HE% A 47 LYS HEx 1.0 1.8 6.0 1474 1229 A 47 LYS HEy A 83 PHE HE% 1.0 1.8 6.0 1475 1230 A 63 LEU HBx A 83 PHE HE% 1.0 2.8 5.1 1476 1231 A 69 TYR HDx A 69 TYR HEx 1.0 1.8 3.0 1477 1232 A 17 ILE HD1% A 69 TYR HDx 1.0 2.3 6.5 1478 1232 A 17 ILE HD1% A 69 TYR HDy 1.0 2.3 6.5 1479 1233 A 74 CYS HA A 70 HIS HE1 1.0 1.8 5.0 1480 1234 A 83 PHE HD% A 82 PRO HDy 1.0 1.8 4.0 1481 1234 A 82 PRO HDx A 83 PHE HD% 1.0 1.8 4.0 1482 1235 A 82 PRO HBy A 83 PHE HE% 1.0 2.3 4.6 1483 1236 A 83 PHE HBy A 83 PHE HD% 1.0 1.8 3.5 1484 1237 A 83 PHE HBx A 83 PHE HE% 1.0 1.8 5.5 1485 1238 A 84 CYS HA A 83 PHE HD% 1.0 1.8 5.5 1486 1239 A 84 CYS HBx A 83 PHE HD% 1.0 2.8 5.1 1487 1240 A 84 CYS HBy A 83 PHE HD% 1.0 2.3 7.0 1488 1241 B 18 THR HA B 23 TRP HZ3 1.0 2.3 6.5 1489 1242 B 19 PHE HD% B 19 PHE HBx 1.0 1.8 4.0 1490 1242 B 19 PHE HBy B 19 PHE HD% 1.0 1.8 4.0 1491 1243 A 16 ALA HA B 19 PHE HZ 1.0 2.3 6.5 1492 1244 B 19 PHE HD% A 19 SER HBx 1.0 2.3 6.5 1493 1245 A 19 SER HBy B 19 PHE HD% 1.0 2.3 6.5 1494 1246 B 19 PHE HD% A 15 ARG HBx 1.0 2.3 6.5 1495 1246 A 15 ARG HBy B 19 PHE HD% 1.0 2.3 6.5 1496 1247 B 19 PHE HD% A 15 ARG HGy 1.0 2.3 6.5 1497 1247 A 15 ARG HGx B 19 PHE HD% 1.0 2.3 6.5 1498 1248 B 19 PHE HD% A 38 LYS HEx 1.0 2.3 6.5 1499 1248 A 38 LYS HEy B 19 PHE HD% 1.0 2.3 6.5 1500 1249 B 21 ASP HBx B 23 TRP HZ3 1.0 2.3 6.5 1501 1250 B 21 ASP HA B 23 TRP HZ3 1.0 2.8 5.0 1502 1251 B 22 LEU HG B 23 TRP HZ3 1.0 2.8 5.0 1503 1252 B 22 LEU HBy B 23 TRP HZ3 1.0 3.3 6.5 1504 1253 B 22 LEU HDx% B 23 TRP HZ3 1.0 2.8 5.0 1505 1254 B 23 TRP HZ2 B 23 TRP HH2 1.0 1.8 3.0 1506 1255 B 23 TRP HBx B 23 TRP HZ2 1.0 2.3 6.5 1507 1256 B 23 TRP HBy B 23 TRP HE3 1.0 2.3 6.5 1508 1257 B 23 TRP HZ3 B 24 LYS HEy 1.0 2.8 4.0 1509 1258 B 24 LYS HEx B 23 TRP HZ3 1.0 2.8 4.0 1510 1259 B 23 TRP HH2 B 24 LYS HBy 1.0 2.3 4.6 1511 1259 B 24 LYS HBx B 23 TRP HH2 1.0 2.3 4.6 1512 1260 B 31 VAL HGx% A 50 LYS H 1.0 7.0 11.5 1513 1261 B 31 VAL HGx% A 55 GLY H 1.0 7.0 11.5 1514 1262 B 31 VAL HGx% A 57 CYS H 1.0 7.0 11.5 1515 1263 A 50 LYS H B 31 VAL HG21 1.0 7.0 11.5 1516 1264 A 55 GLY H B 31 VAL HG21 1.0 7.0 11.5 1517 1265 A 57 CYS H B 31 VAL HG21 1.0 7.0 11.5 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_5 _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 9 ARG H A 5 PRO O 1.0 1.5 2.3 2 2 A 5 PRO O A 9 ARG N 1.0 2.3 3.1 3 3 A 10 ARG H A 6 GLY O 1.0 1.5 2.3 4 4 A 6 GLY O A 10 ARG N 1.0 2.3 3.1 5 5 A 11 LEU H A 7 ASP O 1.0 1.5 2.3 6 6 A 7 ASP O A 11 LEU N 1.0 2.3 3.1 7 7 A 12 SER H A 8 SER O 1.0 1.5 2.3 8 8 A 8 SER O A 12 SER N 1.0 2.3 3.1 9 9 A 13 ILE H A 9 ARG O 1.0 1.5 2.3 10 10 A 9 ARG O A 13 ILE N 1.0 2.3 3.1 11 11 A 14 GLN H A 10 ARG O 1.0 1.5 2.3 12 12 A 10 ARG O A 14 GLN N 1.0 2.3 3.1 13 13 A 15 ARG H A 11 LEU O 1.0 1.5 2.3 14 14 A 11 LEU O A 15 ARG N 1.0 2.3 3.1 15 15 A 16 ALA H A 12 SER O 1.0 1.5 2.3 16 16 A 12 SER O A 16 ALA N 1.0 2.3 3.1 17 17 A 17 ILE H A 13 ILE O 1.0 1.5 2.3 18 18 A 13 ILE O A 17 ILE N 1.0 2.3 3.1 19 19 A 18 GLN H A 14 GLN O 1.0 1.5 2.3 20 20 A 14 GLN O A 18 GLN N 1.0 2.3 3.1 21 21 A 19 SER H A 15 ARG O 1.0 1.5 2.3 22 22 A 15 ARG O A 19 SER N 1.0 2.3 3.1 23 23 A 20 LEU H A 16 ALA O 1.0 1.5 2.3 24 24 A 16 ALA O A 20 LEU N 1.0 2.3 3.1 25 25 A 21 VAL H A 17 ILE O 1.0 1.5 2.3 26 26 A 17 ILE O A 21 VAL N 1.0 2.3 3.1 27 27 A 22 HIS H A 18 GLN O 1.0 1.5 2.3 28 28 A 18 GLN O A 22 HIS N 1.0 2.3 3.1 29 29 A 23 ALA H A 19 SER O 1.0 1.5 2.3 30 30 A 19 SER O A 23 ALA N 1.0 2.3 3.1 31 31 A 24 ALA H A 20 LEU O 1.0 1.5 2.3 32 32 A 20 LEU O A 24 ALA N 1.0 2.3 3.1 33 33 A 38 LYS H A 34 PRO O 1.0 1.5 2.3 34 34 A 34 PRO O A 38 LYS N 1.0 2.3 3.1 35 35 A 39 MET H A 35 SER O 1.0 1.5 2.3 36 36 A 35 SER O A 39 MET N 1.0 2.3 3.1 37 37 A 40 LYS H A 36 CYS O 1.0 1.5 2.3 38 38 A 36 CYS O A 40 LYS N 1.0 2.3 3.1 39 39 A 41 ARG H A 37 GLN O 1.0 1.5 2.3 40 40 A 37 GLN O A 41 ARG N 1.0 2.3 3.1 41 41 A 42 VAL H A 38 LYS O 1.0 1.5 2.3 42 42 A 38 LYS O A 42 VAL N 1.0 2.3 3.1 43 43 A 43 VAL H A 39 MET O 1.0 1.5 2.3 44 44 A 39 MET O A 43 VAL N 1.0 2.3 3.1 45 45 A 44 GLN H A 40 LYS O 1.0 1.5 2.3 46 46 A 40 LYS O A 44 GLN N 1.0 2.3 3.1 47 47 A 45 HIS H A 41 ARG O 1.0 1.5 2.3 48 48 A 41 ARG O A 45 HIS N 1.0 2.3 3.1 49 49 A 46 THR H A 42 VAL O 1.0 1.5 2.3 50 50 A 42 VAL O A 46 THR N 1.0 2.3 3.1 51 51 A 47 LYS H A 43 VAL O 1.0 1.5 2.3 52 52 A 43 VAL O A 47 LYS N 1.0 2.3 3.1 53 53 A 53 THR H A 49 CYS O 1.0 1.5 2.4 54 54 A 49 CYS O A 53 THR N 1.0 2.3 3.2 55 55 A 62 GLN H A 58 PRO O 1.0 1.5 2.3 56 56 A 58 PRO O A 62 GLN N 1.0 2.3 3.1 57 57 A 63 LEU H A 59 ILE O 1.0 1.5 2.3 58 58 A 59 ILE O A 63 LEU N 1.0 2.3 3.1 59 59 A 64 ILE H A 60 CYS O 1.0 1.5 2.3 60 60 A 60 CYS O A 64 ILE N 1.0 2.3 3.1 61 61 A 65 ALA H A 61 LYS O 1.0 1.5 2.3 62 62 A 61 LYS O A 65 ALA N 1.0 2.3 3.1 63 63 A 66 LEU H A 62 GLN O 1.0 1.5 2.3 64 64 A 62 GLN O A 66 LEU N 1.0 2.3 3.1 65 65 A 67 ALA H A 63 LEU O 1.0 1.5 2.3 66 66 A 63 LEU O A 67 ALA N 1.0 2.3 3.1 67 67 A 68 ALA H A 64 ILE O 1.0 1.5 2.3 68 68 A 64 ILE O A 68 ALA N 1.0 2.3 3.1 69 69 A 69 TYR H A 65 ALA O 1.0 1.5 2.3 70 70 A 65 ALA O A 69 TYR N 1.0 2.3 3.1 71 71 A 70 HIS H A 66 LEU O 1.0 1.5 2.3 72 72 A 66 LEU O A 70 HIS N 1.0 2.3 3.1 73 73 A 71 ALA H A 67 ALA O 1.0 1.5 2.3 74 74 A 67 ALA O A 71 ALA N 1.0 2.3 3.1 75 75 A 72 LYS H A 68 ALA O 1.0 1.5 2.3 76 76 A 68 ALA O A 72 LYS N 1.0 2.3 3.1 77 77 A 73 HIS H A 69 TYR O 1.0 1.5 2.3 78 78 A 69 TYR O A 73 HIS N 1.0 2.3 3.1 79 79 A 86 ASN H A 82 PRO O 1.0 1.5 2.3 80 80 A 82 PRO O A 86 ASN N 1.0 2.3 3.1 81 81 A 87 ILE H A 83 PHE O 1.0 1.5 2.3 82 82 A 83 PHE O A 87 ILE N 1.0 2.3 3.1 83 83 A 88 LYS H A 84 CYS O 1.0 1.5 2.3 84 84 A 84 CYS O A 88 LYS N 1.0 2.3 3.1 85 85 A 89 GLN H A 85 LEU O 1.0 1.5 2.3 86 86 A 85 LEU O A 89 GLN N 1.0 2.3 3.1 87 87 B 22 LEU H B 18 THR O 1.0 1.5 2.3 88 88 B 18 THR O B 22 LEU N 1.0 2.3 3.1 89 89 B 23 TRP H B 19 PHE O 1.0 1.5 2.4 90 90 B 19 PHE O B 23 TRP N 1.0 2.3 3.2 91 91 B 24 LYS H B 20 SER O 1.0 1.5 2.3 92 92 B 20 SER O B 24 LYS N 1.0 2.3 3.1 93 93 B 25 LEU H B 21 ASP O 1.0 1.5 2.3 94 94 B 21 ASP O B 25 LEU N 1.0 2.3 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 7 ASP C A 8 SER N A 8 SER CA A 8 SER C 1.0 -72.60 -46.00 PHI 2 2 A 8 SER C A 9 ARG N A 9 ARG CA A 9 ARG C 1.0 -83.96 -40.92 PHI 3 3 A 9 ARG C A 10 ARG N A 10 ARG CA A 10 ARG C 1.0 -82.41 -42.97 PHI 4 4 A 10 ARG C A 11 LEU N A 11 LEU CA A 11 LEU C 1.0 -82.88 -41.84 PHI 5 5 A 11 LEU C A 12 SER N A 12 SER CA A 12 SER C 1.0 -79.47 -47.67 PHI 6 6 A 12 SER C A 13 ILE N A 13 ILE CA A 13 ILE C 1.0 -78.68 -50.76 PHI 7 7 A 13 ILE C A 14 GLN N A 14 GLN CA A 14 GLN C 1.0 -83.31 -39.19 PHI 8 8 A 14 GLN C A 15 ARG N A 15 ARG CA A 15 ARG C 1.0 -80.39 -48.39 PHI 9 9 A 15 ARG C A 16 ALA N A 16 ALA CA A 16 ALA C 1.0 -81.32 -51.00 PHI 10 10 A 16 ALA C A 17 ILE N A 17 ILE CA A 17 ILE C 1.0 -79.07 -44.87 PHI 11 11 A 17 ILE C A 18 GLN N A 18 GLN CA A 18 GLN C 1.0 -75.07 -48.47 PHI 12 12 A 18 GLN C A 19 SER N A 19 SER CA A 19 SER C 1.0 -87.64 -49.84 PHI 13 13 A 19 SER C A 20 LEU N A 20 LEU CA A 20 LEU C 1.0 -76.70 -55.02 PHI 14 14 A 20 LEU C A 21 VAL N A 21 VAL CA A 21 VAL C 1.0 -73.76 -53.28 PHI 15 15 A 21 VAL C A 22 HIS N A 22 HIS CA A 22 HIS C 1.0 -81.33 -44.05 PHI 16 16 A 22 HIS C A 23 ALA N A 23 ALA CA A 23 ALA C 1.0 -88.65 -43.37 PHI 17 17 A 23 ALA C A 24 ALA N A 24 ALA CA A 24 ALA C 1.0 -91.90 -44.58 PHI 18 18 A 25 GLN C A 26 CYS N A 26 CYS CA A 26 CYS C 1.0 -99.85 -42.25 PHI 19 19 A 30 ASN C A 31 CYS N A 31 CYS CA A 31 CYS C 1.0 -92.18 -32.38 PHI 20 20 A 32 SER C A 33 LEU N A 33 LEU CA A 33 LEU C 1.0 -100.74 -30.58 PHI 21 21 A 34 PRO C A 35 SER N A 35 SER CA A 35 SER C 1.0 -78.79 -52.43 PHI 22 22 A 35 SER C A 36 CYS N A 36 CYS CA A 36 CYS C 1.0 -72.11 -55.91 PHI 23 23 A 36 CYS C A 37 GLN N A 37 GLN CA A 37 GLN C 1.0 -68.11 -49.75 PHI 24 24 A 37 GLN C A 38 LYS N A 38 LYS CA A 38 LYS C 1.0 -79.35 -50.91 PHI 25 25 A 38 LYS C A 39 MET N A 39 MET CA A 39 MET C 1.0 -76.25 -51.97 PHI 26 26 A 39 MET C A 40 LYS N A 40 LYS CA A 40 LYS C 1.0 -79.71 -52.55 PHI 27 27 A 40 LYS C A 41 ARG N A 41 ARG CA A 41 ARG C 1.0 -85.09 -45.69 PHI 28 28 A 41 ARG C A 42 VAL N A 42 VAL CA A 42 VAL C 1.0 -79.35 -57.47 PHI 29 29 A 42 VAL C A 43 VAL N A 43 VAL CA A 43 VAL C 1.0 -73.71 -51.07 PHI 30 30 A 43 VAL C A 44 GLN N A 44 GLN CA A 44 GLN C 1.0 -82.12 -47.44 PHI 31 31 A 44 GLN C A 45 HIS N A 45 HIS CA A 45 HIS C 1.0 -89.00 -39.16 PHI 32 32 A 45 HIS C A 46 THR N A 46 THR CA A 46 THR C 1.0 -85.49 -46.65 PHI 33 33 A 46 THR C A 47 LYS N A 47 LYS CA A 47 LYS C 1.0 -85.16 -52.20 PHI 34 34 A 48 GLY C A 49 CYS N A 49 CYS CA A 49 CYS C 1.0 -110.45 -43.09 PHI 35 35 A 49 CYS C A 50 LYS N A 50 LYS CA A 50 LYS C 1.0 -91.12 -41.76 PHI 36 36 A 50 LYS C A 51 ARG N A 51 ARG CA A 51 ARG C 1.0 -102.57 -31.61 PHI 37 37 A 51 ARG C A 52 LYS N A 52 LYS CA A 52 LYS C 1.0 -106.08 -37.04 PHI 38 38 A 52 LYS C A 53 THR N A 53 THR CA A 53 THR C 1.0 -111.66 -40.38 PHI 39 39 A 56 GLY C A 57 CYS N A 57 CYS CA A 57 CYS C 1.0 -138.04 -56.84 PHI 40 40 A 58 PRO C A 59 ILE N A 59 ILE CA A 59 ILE C 1.0 -78.11 -48.23 PHI 41 41 A 59 ILE C A 60 CYS N A 60 CYS CA A 60 CYS C 1.0 -81.19 -46.87 PHI 42 42 A 60 CYS C A 61 LYS N A 61 LYS CA A 61 LYS C 1.0 -80.16 -48.32 PHI 43 43 A 61 LYS C A 62 GLN N A 62 GLN CA A 62 GLN C 1.0 -67.75 -58.35 PHI 44 44 A 62 GLN C A 63 LEU N A 63 LEU CA A 63 LEU C 1.0 -78.79 -51.23 PHI 45 45 A 63 LEU C A 64 ILE N A 64 ILE CA A 64 ILE C 1.0 -82.81 -40.97 PHI 46 46 A 64 ILE C A 65 ALA N A 65 ALA CA A 65 ALA C 1.0 -78.34 -49.42 PHI 47 47 A 65 ALA C A 66 LEU N A 66 LEU CA A 66 LEU C 1.0 -79.93 -50.45 PHI 48 48 A 66 LEU C A 67 ALA N A 67 ALA CA A 67 ALA C 1.0 -74.75 -54.35 PHI 49 49 A 67 ALA C A 68 ALA N A 68 ALA CA A 68 ALA C 1.0 -82.12 -46.48 PHI 50 50 A 70 HIS C A 71 ALA N A 71 ALA CA A 71 ALA C 1.0 -73.48 -47.96 PHI 51 51 A 71 ALA C A 72 LYS N A 72 LYS CA A 72 LYS C 1.0 -97.00 -42.56 PHI 52 52 A 73 HIS C A 74 CYS N A 74 CYS CA A 74 CYS C 1.0 -78.54 -56.30 PHI 53 53 A 83 PHE C A 84 CYS N A 84 CYS CA A 84 CYS C 1.0 -80.24 -47.88 PHI 54 54 A 84 CYS C A 85 LEU N A 85 LEU CA A 85 LEU C 1.0 -76.28 -50.56 PHI 55 55 A 85 LEU C A 86 ASN N A 86 ASN CA A 86 ASN C 1.0 -87.06 -52.30 PHI 56 56 A 86 ASN C A 87 ILE N A 87 ILE CA A 87 ILE C 1.0 -93.79 -46.11 PHI 57 57 A 87 ILE C A 88 LYS N A 88 LYS CA A 88 LYS C 1.0 -83.65 -43.41 PHI 58 58 A 88 LYS C A 89 GLN N A 89 GLN CA A 89 GLN C 1.0 -95.39 -40.15 PHI 59 59 A 8 SER N A 8 SER CA A 8 SER C A 9 ARG N 1.0 -54.74 -23.46 PSI 60 60 A 9 ARG N A 9 ARG CA A 9 ARG C A 10 ARG N 1.0 -58.44 -27.44 PSI 61 61 A 10 ARG N A 10 ARG CA A 10 ARG C A 11 LEU N 1.0 -58.45 -22.01 PSI 62 62 A 11 LEU N A 11 LEU CA A 11 LEU C A 12 SER N 1.0 -57.01 -22.53 PSI 63 63 A 12 SER N A 12 SER CA A 12 SER C A 13 ILE N 1.0 -53.14 -22.82 PSI 64 64 A 13 ILE N A 13 ILE CA A 13 ILE C A 14 GLN N 1.0 -59.33 -28.65 PSI 65 65 A 14 GLN N A 14 GLN CA A 14 GLN C A 15 ARG N 1.0 -52.76 -16.32 PSI 66 66 A 15 ARG N A 15 ARG CA A 15 ARG C A 16 ALA N 1.0 -62.15 -18.91 PSI 67 67 A 16 ALA N A 16 ALA CA A 16 ALA C A 17 ILE N 1.0 -58.17 -16.89 PSI 68 68 A 17 ILE N A 17 ILE CA A 17 ILE C A 18 GLN N 1.0 -50.13 -28.85 PSI 69 69 A 18 GLN N A 18 GLN CA A 18 GLN C A 19 SER N 1.0 -52.81 -24.85 PSI 70 70 A 19 SER N A 19 SER CA A 19 SER C A 20 LEU N 1.0 -49.10 -26.30 PSI 71 71 A 20 LEU N A 20 LEU CA A 20 LEU C A 21 VAL N 1.0 -55.30 -29.74 PSI 72 72 A 21 VAL N A 21 VAL CA A 21 VAL C A 22 HIS N 1.0 -61.79 -31.55 PSI 73 73 A 22 HIS N A 22 HIS CA A 22 HIS C A 23 ALA N 1.0 -57.17 -20.73 PSI 74 74 A 23 ALA N A 23 ALA CA A 23 ALA C A 24 ALA N 1.0 -49.15 -26.03 PSI 75 75 A 24 ALA N A 24 ALA CA A 24 ALA C A 25 GLN N 1.0 -54.01 -2.41 PSI 76 76 A 26 CYS N A 26 CYS CA A 26 CYS C A 27 ARG N 1.0 84.98 149.10 PSI 77 77 A 31 CYS N A 31 CYS CA A 31 CYS C A 32 SER N 1.0 114.04 156.12 PSI 78 78 A 33 LEU N A 33 LEU CA A 33 LEU C A 34 PRO N 1.0 76.25 179.01 PSI 79 79 A 35 SER N A 35 SER CA A 35 SER C A 36 CYS N 1.0 -49.26 -17.46 PSI 80 80 A 36 CYS N A 36 CYS CA A 36 CYS C A 37 GLN N 1.0 -58.03 -31.15 PSI 81 81 A 37 GLN N A 37 GLN CA A 37 GLN C A 38 LYS N 1.0 -53.05 -31.45 PSI 82 82 A 38 LYS N A 38 LYS CA A 38 LYS C A 39 MET N 1.0 -58.73 -24.45 PSI 83 83 A 39 MET N A 39 MET CA A 39 MET C A 40 LYS N 1.0 -56.56 -22.96 PSI 84 84 A 40 LYS N A 40 LYS CA A 40 LYS C A 41 ARG N 1.0 -53.90 -22.90 PSI 85 85 A 41 ARG N A 41 ARG CA A 41 ARG C A 42 VAL N 1.0 -54.21 -25.53 PSI 86 86 A 42 VAL N A 42 VAL CA A 42 VAL C A 43 VAL N 1.0 -55.58 -35.06 PSI 87 87 A 43 VAL N A 43 VAL CA A 43 VAL C A 44 GLN N 1.0 -54.30 -25.86 PSI 88 88 A 44 GLN N A 44 GLN CA A 44 GLN C A 45 HIS N 1.0 -52.15 -31.99 PSI 89 89 A 45 HIS N A 45 HIS CA A 45 HIS C A 46 THR N 1.0 -54.07 -18.91 PSI 90 90 A 46 THR N A 46 THR CA A 46 THR C A 47 LYS N 1.0 -52.44 -26.36 PSI 91 91 A 47 LYS N A 47 LYS CA A 47 LYS C A 48 GLY N 1.0 -43.89 -7.61 PSI 92 92 A 49 CYS N A 49 CYS CA A 49 CYS C A 50 LYS N 1.0 68.98 152.30 PSI 93 93 A 50 LYS N A 50 LYS CA A 50 LYS C A 51 ARG N 1.0 -60.73 -10.57 PSI 94 94 A 51 ARG N A 51 ARG CA A 51 ARG C A 52 LYS N 1.0 -77.18 34.82 PSI 95 95 A 52 LYS N A 52 LYS CA A 52 LYS C A 53 THR N 1.0 -91.41 34.63 PSI 96 96 A 53 THR N A 53 THR CA A 53 THR C A 54 ASN N 1.0 -84.49 21.59 PSI 97 97 A 57 CYS N A 57 CYS CA A 57 CYS C A 58 PRO N 1.0 64.95 184.15 PSI 98 98 A 59 ILE N A 59 ILE CA A 59 ILE C A 60 CYS N 1.0 -49.04 -26.60 PSI 99 99 A 60 CYS N A 60 CYS CA A 60 CYS C A 61 LYS N 1.0 -54.02 -33.22 PSI 100 100 A 61 LYS N A 61 LYS CA A 61 LYS C A 62 GLN N 1.0 -52.01 -26.73 PSI 101 101 A 62 GLN N A 62 GLN CA A 62 GLN C A 63 LEU N 1.0 -59.27 -31.19 PSI 102 102 A 63 LEU N A 63 LEU CA A 63 LEU C A 64 ILE N 1.0 -59.93 -27.17 PSI 103 103 A 64 ILE N A 64 ILE CA A 64 ILE C A 65 ALA N 1.0 -48.46 -28.10 PSI 104 104 A 65 ALA N A 65 ALA CA A 65 ALA C A 66 LEU N 1.0 -58.66 -21.90 PSI 105 105 A 66 LEU N A 66 LEU CA A 66 LEU C A 67 ALA N 1.0 -58.31 -28.03 PSI 106 106 A 67 ALA N A 67 ALA CA A 67 ALA C A 68 ALA N 1.0 -52.95 -25.55 PSI 107 107 A 68 ALA N A 68 ALA CA A 68 ALA C A 69 TYR N 1.0 -58.80 -19.40 PSI 108 108 A 71 ALA N A 71 ALA CA A 71 ALA C A 72 LYS N 1.0 -46.68 -14.92 PSI 109 109 A 72 LYS N A 72 LYS CA A 72 LYS C A 73 HIS N 1.0 -63.22 11.66 PSI 110 110 A 74 CYS N A 74 CYS CA A 74 CYS C A 75 GLN N 1.0 105.02 151.30 PSI 111 111 A 84 CYS N A 84 CYS CA A 84 CYS C A 85 LEU N 1.0 -51.82 -30.74 PSI 112 112 A 85 LEU N A 85 LEU CA A 85 LEU C A 86 ASN N 1.0 -57.29 -21.61 PSI 113 113 A 86 ASN N A 86 ASN CA A 86 ASN C A 87 ILE N 1.0 -63.79 -12.11 PSI 114 114 A 87 ILE N A 87 ILE CA A 87 ILE C A 88 LYS N 1.0 -52.00 -23.52 PSI 115 115 A 88 LYS N A 88 LYS CA A 88 LYS C A 89 GLN N 1.0 -56.68 -20.44 PSI 116 116 A 89 GLN N A 89 GLN CA A 89 GLN C A 90 LYS N 1.0 -72.89 1.55 PSI 117 117 B 10 VAL C B 11 GLU N B 11 GLU CA B 11 GLU C 1.0 -127.18 -32.66 PHI 118 118 B 17 GLU C B 18 THR N B 18 THR CA B 18 THR C 1.0 -81.40 -43.60 PHI 119 119 B 18 THR C B 19 PHE N B 19 PHE CA B 19 PHE C 1.0 -80.62 -35.54 PHI 120 120 B 19 PHE C B 20 SER N B 20 SER CA B 20 SER C 1.0 -77.65 -32.85 PHI 121 121 B 20 SER C B 21 ASP N B 21 ASP CA B 21 ASP C 1.0 -82.21 -53.01 PHI 122 122 B 21 ASP C B 22 LEU N B 22 LEU CA B 22 LEU C 1.0 -84.62 -41.10 PHI 123 123 B 22 LEU C B 23 TRP N B 23 TRP CA B 23 TRP C 1.0 -94.12 -43.00 PHI 124 124 B 23 TRP C B 24 LYS N B 24 LYS CA B 24 LYS C 1.0 -92.78 -44.50 PHI 125 125 B 24 LYS C B 25 LEU N B 25 LEU CA B 25 LEU C 1.0 -116.59 -47.71 PHI 126 126 B 34 PRO C B 35 LEU N B 35 LEU CA B 35 LEU C 1.0 -126.19 -52.03 PHI 127 127 B 11 GLU N B 11 GLU CA B 11 GLU C B 12 PRO N 1.0 66.48 195.40 PSI 128 128 B 18 THR N B 18 THR CA B 18 THR C B 19 PHE N 1.0 -60.13 -11.89 PSI 129 129 B 19 PHE N B 19 PHE CA B 19 PHE C B 20 SER N 1.0 -53.77 -26.81 PSI 130 130 B 20 SER N B 20 SER CA B 20 SER C B 21 ASP N 1.0 -60.50 -25.46 PSI 131 131 B 21 ASP N B 21 ASP CA B 21 ASP C B 22 LEU N 1.0 -53.15 -26.87 PSI 132 132 B 22 LEU N B 22 LEU CA B 22 LEU C B 23 TRP N 1.0 -67.30 -27.66 PSI 133 133 B 23 TRP N B 23 TRP CA B 23 TRP C B 24 LYS N 1.0 -57.84 -18.16 PSI 134 134 B 24 LYS N B 24 LYS CA B 24 LYS C B 25 LEU N 1.0 -57.34 8.10 PSI 135 135 B 25 LEU N B 25 LEU CA B 25 LEU C B 26 LEU N 1.0 -43.15 26.13 PSI 136 136 B 35 LEU N B 35 LEU CA B 35 LEU C B 36 PRO N 1.0 81.57 195.53 PSI stop_ save_