data_nef_c25484_2mzd save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2K8F PDB 2MZD stop_ 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 LEU start . . 92 B 2 PRO middle . false 93 B 3 SER middle . . 94 B 4 GLN middle . . 95 B 5 ALA middle . . 96 B 6 MET middle . . 97 B 7 ASP middle . . 98 B 8 ASP middle . . 99 B 9 LEU middle . . 100 B 10 MET middle . . 101 B 11 LEU middle . . 102 B 12 SER middle . . 103 B 13 PRO middle . false 104 B 14 ASP middle . . 105 B 15 ASP middle . . 106 B 16 ILE middle . . 107 B 17 GLU middle . . 108 B 18 GLN middle . . 109 B 19 TRP middle . . 110 B 20 PHE middle . . 111 B 21 THR middle . . 112 B 22 GLU middle . . 113 B 23 ASP middle . . 114 B 24 PRO middle . false 115 B 25 GLY end . false stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 2 THR HA H 1 4.415 0.04 A 2 THR HB H 1 4.220 0.04 A 2 THR HG2% H 1 1.269 0.04 A 2 THR C C 13 174.580 0.04 A 2 THR CA C 13 62.450 0.04 A 2 THR CB C 13 70.050 0.04 A 2 THR CG2 C 13 21.250 0.04 A 3 GLN H H 1 8.536 0.04 A 3 GLN HA H 1 4.480 0.04 A 3 GLN HB2 H 1 2.035 0.04 A 3 GLN HB3 H 1 2.135 0.04 A 3 GLN HGx H 1 2.405 0.04 A 3 GLN HGy H 1 2.405 0.04 A 3 GLN C C 13 176.040 0.04 A 3 GLN CA C 13 55.950 0.04 A 3 GLN CB C 13 30.550 0.04 A 3 GLN CG C 13 34.350 0.04 A 3 GLN N N 15 123.423 0.04 A 4 SER H H 1 8.150 0.04 A 4 SER HA H 1 4.834 0.04 A 4 SER HBx H 1 3.937 0.04 A 4 SER HBy H 1 3.937 0.04 A 4 SER C C 13 173.640 0.04 A 4 SER CA C 13 56.250 0.04 A 4 SER CB C 13 63.400 0.04 A 4 SER N N 15 119.390 0.04 A 5 PRO HA H 1 4.480 0.04 A 5 PRO HB2 H 1 2.020 0.04 A 5 PRO HB3 H 1 2.370 0.04 A 5 PRO HD2 H 1 3.830 0.04 A 5 PRO HD3 H 1 3.890 0.04 A 5 PRO HG2 H 1 2.070 0.04 A 5 PRO HG3 H 1 2.120 0.04 A 5 PRO C C 13 178.180 0.04 A 5 PRO CA C 13 64.040 0.04 A 5 PRO CB C 13 32.120 0.04 A 5 PRO CD C 13 50.950 0.04 A 5 PRO CG C 13 27.350 0.04 A 6 GLY H H 1 8.470 0.04 A 6 GLY HAx H 1 4.010 0.04 A 6 GLY HAy H 1 4.010 0.04 A 6 GLY C C 13 174.930 0.04 A 6 GLY CA C 13 45.750 0.04 A 6 GLY N N 15 108.600 0.04 A 7 ASP H H 1 8.130 0.04 A 7 ASP HA H 1 4.660 0.04 A 7 ASP HBx H 1 2.772 0.04 A 7 ASP HBy H 1 2.772 0.04 A 7 ASP C C 13 177.580 0.04 A 7 ASP CA C 13 55.200 0.04 A 7 ASP CB C 13 41.400 0.04 A 7 ASP N N 15 121.260 0.04 A 8 SER H H 1 8.372 0.04 A 8 SER HA H 1 4.340 0.04 A 8 SER HBx H 1 4.010 0.04 A 8 SER HBy H 1 4.010 0.04 A 8 SER C C 13 176.310 0.04 A 8 SER CA C 13 60.050 0.04 A 8 SER CB C 13 63.190 0.04 A 8 SER N N 15 116.818 0.04 A 9 ARG H H 1 8.308 0.04 A 9 ARG HA H 1 4.260 0.04 A 9 ARG HBx H 1 1.915 0.04 A 9 ARG HBy H 1 1.915 0.04 A 9 ARG HD2 H 1 3.222 0.04 A 9 ARG HD3 H 1 3.222 0.04 A 9 ARG HG2 H 1 1.692 0.04 A 9 ARG HG3 H 1 1.692 0.04 A 9 ARG C C 13 177.710 0.04 A 9 ARG CA C 13 58.050 0.04 A 9 ARG CB C 13 30.350 0.04 A 9 ARG CD C 13 43.350 0.04 A 9 ARG CG C 13 27.350 0.04 A 9 ARG N N 15 123.150 0.04 A 10 ARG H H 1 8.075 0.04 A 10 ARG HA H 1 4.110 0.04 A 10 ARG HB2 H 1 1.908 0.04 A 10 ARG HB3 H 1 1.908 0.04 A 10 ARG HD2 H 1 3.260 0.04 A 10 ARG HD3 H 1 3.260 0.04 A 10 ARG HG2 H 1 1.647 0.04 A 10 ARG HG3 H 1 1.647 0.04 A 10 ARG C C 13 178.180 0.04 A 10 ARG CA C 13 58.420 0.04 A 10 ARG CB C 13 30.260 0.04 A 10 ARG CD C 13 43.150 0.04 A 10 ARG CG C 13 27.350 0.04 A 10 ARG N N 15 119.940 0.04 A 11 LEU H H 1 8.160 0.04 A 11 LEU HA H 1 4.225 0.04 A 11 LEU HB2 H 1 1.652 0.04 A 11 LEU HB3 H 1 1.770 0.04 A 11 LEU HD1% H 1 0.940 0.04 A 11 LEU HD2% H 1 0.915 0.04 A 11 LEU HG H 1 1.690 0.04 A 11 LEU C C 13 179.950 0.04 A 11 LEU CA C 13 57.450 0.04 A 11 LEU CB C 13 41.910 0.04 A 11 LEU CD1 C 13 24.850 0.04 A 11 LEU CD2 C 13 25.050 0.04 A 11 LEU CG C 13 27.150 0.04 A 11 LEU N N 15 121.060 0.04 A 12 SER H H 1 8.179 0.04 A 12 SER HA H 1 4.317 0.04 A 12 SER HB2 H 1 3.980 0.04 A 12 SER HB3 H 1 4.080 0.04 A 12 SER C C 13 176.960 0.04 A 12 SER CA C 13 60.760 0.04 A 12 SER CB C 13 63.350 0.04 A 12 SER N N 15 116.470 0.04 A 13 ILE H H 1 8.130 0.04 A 13 ILE HA H 1 3.690 0.04 A 13 ILE HB H 1 1.785 0.04 A 13 ILE HD1% H 1 0.608 0.04 A 13 ILE HG12 H 1 0.910 0.04 A 13 ILE HG13 H 1 1.507 0.04 A 13 ILE HG2% H 1 0.615 0.04 A 13 ILE C C 13 177.660 0.04 A 13 ILE CA C 13 64.930 0.04 A 13 ILE CB C 13 37.650 0.04 A 13 ILE CD1 C 13 13.150 0.04 A 13 ILE CG1 C 13 29.100 0.04 A 13 ILE CG2 C 13 17.450 0.04 A 13 ILE N N 15 123.740 0.04 A 14 GLN H H 1 8.113 0.04 A 14 GLN HA H 1 4.040 0.04 A 14 GLN HBx H 1 2.208 0.04 A 14 GLN HBy H 1 2.208 0.04 A 14 GLN HGx H 1 2.527 0.04 A 14 GLN HGy H 1 2.527 0.04 A 14 GLN C C 13 179.490 0.04 A 14 GLN CA C 13 59.750 0.04 A 14 GLN CB C 13 27.730 0.04 A 14 GLN CG C 13 33.850 0.04 A 14 GLN N N 15 119.220 0.04 A 15 ARG H H 1 8.200 0.04 A 15 ARG HA H 1 4.150 0.04 A 15 ARG HBx H 1 1.924 0.04 A 15 ARG HBy H 1 1.924 0.04 A 15 ARG HD2 H 1 3.260 0.04 A 15 ARG HD3 H 1 3.260 0.04 A 15 ARG HG2 H 1 1.677 0.04 A 15 ARG HG3 H 1 1.677 0.04 A 15 ARG C C 13 179.460 0.04 A 15 ARG CA C 13 59.150 0.04 A 15 ARG CB C 13 30.090 0.04 A 15 ARG CD C 13 43.650 0.04 A 15 ARG CG C 13 27.650 0.04 A 15 ARG N N 15 119.160 0.04 A 16 ALA H H 1 8.071 0.04 A 16 ALA HA H 1 3.990 0.04 A 16 ALA HB% H 1 1.438 0.04 A 16 ALA C C 13 180.230 0.04 A 16 ALA CA C 13 55.550 0.04 A 16 ALA CB C 13 18.750 0.04 A 16 ALA N N 15 124.140 0.04 A 17 ILE H H 1 8.534 0.04 A 17 ILE HA H 1 3.712 0.04 A 17 ILE HB H 1 2.125 0.04 A 17 ILE HD1% H 1 0.975 0.04 A 17 ILE HG12 H 1 1.283 0.04 A 17 ILE HG13 H 1 1.918 0.04 A 17 ILE HG2% H 1 1.095 0.04 A 17 ILE C C 13 178.210 0.04 A 17 ILE CA C 13 64.870 0.04 A 17 ILE CB C 13 37.640 0.04 A 17 ILE CD1 C 13 14.450 0.04 A 17 ILE CG1 C 13 29.550 0.04 A 17 ILE CG2 C 13 18.650 0.04 A 17 ILE N N 15 118.180 0.04 A 18 GLN H H 1 8.200 0.04 A 18 GLN HA H 1 4.134 0.04 A 18 GLN HB2 H 1 1.927 0.04 A 18 GLN HB3 H 1 2.230 0.04 A 18 GLN HG2 H 1 2.560 0.04 A 18 GLN HG3 H 1 2.550 0.04 A 18 GLN C C 13 180.050 0.04 A 18 GLN CA C 13 59.340 0.04 A 18 GLN CB C 13 28.030 0.04 A 18 GLN CG C 13 33.950 0.04 A 18 GLN N N 15 118.960 0.04 A 19 SER H H 1 8.190 0.04 A 19 SER HA H 1 4.388 0.04 A 19 SER HB2 H 1 3.937 0.04 A 19 SER HB3 H 1 4.120 0.04 A 19 SER C C 13 176.460 0.04 A 19 SER CA C 13 62.250 0.04 A 19 SER CB C 13 63.270 0.04 A 19 SER N N 15 116.320 0.04 A 20 LEU H H 1 8.290 0.04 A 20 LEU HA H 1 4.075 0.04 A 20 LEU HB2 H 1 1.735 0.04 A 20 LEU HB3 H 1 2.095 0.04 A 20 LEU HD1% H 1 0.930 0.04 A 20 LEU HD2% H 1 0.883 0.04 A 20 LEU HG H 1 1.547 0.04 A 20 LEU C C 13 177.640 0.04 A 20 LEU CA C 13 58.750 0.04 A 20 LEU CB C 13 42.390 0.04 A 20 LEU CD1 C 13 25.550 0.04 A 20 LEU CD2 C 13 26.050 0.04 A 20 LEU CG C 13 27.350 0.04 A 20 LEU N N 15 125.540 0.04 A 21 VAL H H 1 8.532 0.04 A 21 VAL HA H 1 3.356 0.04 A 21 VAL HB H 1 2.128 0.04 A 21 VAL HG1% H 1 0.965 0.04 A 21 VAL HG2% H 1 0.942 0.04 A 21 VAL C C 13 178.770 0.04 A 21 VAL CA C 13 66.850 0.04 A 21 VAL CB C 13 31.450 0.04 A 21 VAL CG1 C 13 23.580 0.04 A 21 VAL CG2 C 13 23.250 0.04 A 21 VAL N N 15 118.690 0.04 A 22 HIS H H 1 7.980 0.04 A 22 HIS HA H 1 4.230 0.04 A 22 HIS HBx H 1 3.340 0.04 A 22 HIS HBy H 1 3.340 0.04 A 22 HIS C C 13 178.420 0.04 A 22 HIS CA C 13 59.980 0.04 A 22 HIS CB C 13 27.830 0.04 A 22 HIS N N 15 116.230 0.04 A 23 ALA H H 1 8.640 0.04 A 23 ALA HA H 1 4.225 0.04 A 23 ALA HB% H 1 1.580 0.04 A 23 ALA C C 13 179.540 0.04 A 23 ALA CA C 13 55.250 0.04 A 23 ALA CB C 13 19.550 0.04 A 23 ALA N N 15 121.520 0.04 A 24 ALA H H 1 8.260 0.04 A 24 ALA HA H 1 4.100 0.04 A 24 ALA HB% H 1 1.430 0.04 A 24 ALA C C 13 178.130 0.04 A 24 ALA CA C 13 54.090 0.04 A 24 ALA CB C 13 18.750 0.04 A 24 ALA N N 15 116.860 0.04 A 25 GLN H H 1 7.260 0.04 A 25 GLN HA H 1 4.495 0.04 A 25 GLN HB2 H 1 2.030 0.04 A 25 GLN HB3 H 1 2.152 0.04 A 25 GLN HG2 H 1 2.303 0.04 A 25 GLN HG3 H 1 2.485 0.04 A 25 GLN C C 13 174.940 0.04 A 25 GLN CA C 13 54.650 0.04 A 25 GLN CB C 13 30.650 0.04 A 25 GLN CG C 13 33.450 0.04 A 25 GLN N N 15 112.450 0.04 A 26 CYS H H 1 7.365 0.04 A 26 CYS HA H 1 3.915 0.04 A 26 CYS HB2 H 1 2.090 0.04 A 26 CYS HB3 H 1 2.560 0.04 A 26 CYS C C 13 176.690 0.04 A 26 CYS CA C 13 60.980 0.04 A 26 CYS CB C 13 29.350 0.04 A 26 CYS N N 15 124.510 0.04 A 27 ARG H H 1 8.880 0.04 A 27 ARG HA H 1 4.635 0.04 A 27 ARG HB2 H 1 1.690 0.04 A 27 ARG HB3 H 1 2.158 0.04 A 27 ARG HD2 H 1 3.206 0.04 A 27 ARG HD3 H 1 3.206 0.04 A 27 ARG HG2 H 1 1.625 0.04 A 27 ARG HG3 H 1 1.680 0.04 A 27 ARG C C 13 175.660 0.04 A 27 ARG CA C 13 54.550 0.04 A 27 ARG CB C 13 30.350 0.04 A 27 ARG CD C 13 43.350 0.04 A 27 ARG CG C 13 26.550 0.04 A 27 ARG N N 15 129.870 0.04 A 28 ASN H H 1 7.980 0.04 A 28 ASN HA H 1 4.870 0.04 A 28 ASN HB2 H 1 2.895 0.04 A 28 ASN HB3 H 1 2.985 0.04 A 28 ASN C C 13 176.120 0.04 A 28 ASN CA C 13 51.930 0.04 A 28 ASN CB C 13 39.060 0.04 A 28 ASN N N 15 120.810 0.04 A 29 ALA H H 1 9.134 0.04 A 29 ALA HA H 1 4.133 0.04 A 29 ALA HB% H 1 1.459 0.04 A 29 ALA C C 13 178.380 0.04 A 29 ALA CA C 13 54.290 0.04 A 29 ALA CB C 13 18.370 0.04 A 29 ALA N N 15 130.470 0.04 A 30 ASN H H 1 8.114 0.04 A 30 ASN HA H 1 4.875 0.04 A 30 ASN HB2 H 1 2.630 0.04 A 30 ASN HB3 H 1 2.975 0.04 A 30 ASN C C 13 174.530 0.04 A 30 ASN CA C 13 51.930 0.04 A 30 ASN CB C 13 38.910 0.04 A 30 ASN N N 15 114.590 0.04 A 31 CYS H H 1 7.210 0.04 A 31 CYS HA H 1 4.050 0.04 A 31 CYS HB2 H 1 2.950 0.04 A 31 CYS HB3 H 1 3.045 0.04 A 31 CYS C C 13 177.170 0.04 A 31 CYS CA C 13 61.880 0.04 A 31 CYS CB C 13 30.010 0.04 A 31 CYS N N 15 123.270 0.04 A 32 SER H H 1 8.767 0.04 A 32 SER HA H 1 4.609 0.04 A 32 SER HB2 H 1 3.900 0.04 A 32 SER HB3 H 1 4.137 0.04 A 32 SER C C 13 175.020 0.04 A 32 SER CA C 13 58.010 0.04 A 32 SER CB C 13 64.120 0.04 A 32 SER N N 15 124.300 0.04 A 33 LEU H H 1 8.546 0.04 A 33 LEU HA H 1 4.538 0.04 A 33 LEU HB2 H 1 1.457 0.04 A 33 LEU HB3 H 1 1.627 0.04 A 33 LEU HD1% H 1 0.580 0.04 A 33 LEU HD2% H 1 0.620 0.04 A 33 LEU HG H 1 1.626 0.04 A 33 LEU C C 13 177.230 0.04 A 33 LEU CA C 13 54.450 0.04 A 33 LEU CB C 13 40.970 0.04 A 33 LEU CD1 C 13 24.350 0.04 A 33 LEU CD2 C 13 23.350 0.04 A 33 LEU CG C 13 27.350 0.04 A 33 LEU N N 15 128.860 0.04 A 34 PRO HA H 1 4.370 0.04 A 34 PRO HB2 H 1 2.059 0.04 A 34 PRO HB3 H 1 2.467 0.04 A 34 PRO HD2 H 1 3.850 0.04 A 34 PRO HD3 H 1 3.850 0.04 A 34 PRO HGx H 1 2.140 0.04 A 34 PRO HGy H 1 2.140 0.04 A 34 PRO C C 13 178.640 0.04 A 34 PRO CA C 13 65.530 0.04 A 34 PRO CB C 13 31.970 0.04 A 34 PRO CD C 13 50.950 0.04 A 34 PRO CG C 13 27.950 0.04 A 35 SER H H 1 8.350 0.04 A 35 SER HA H 1 4.127 0.04 A 35 SER HB2 H 1 3.945 0.04 A 35 SER HB3 H 1 3.945 0.04 A 35 SER C C 13 174.750 0.04 A 35 SER CA C 13 60.100 0.04 A 35 SER CB C 13 62.910 0.04 A 35 SER N N 15 111.940 0.04 A 36 CYS H H 1 7.490 0.04 A 36 CYS HA H 1 4.215 0.04 A 36 CYS HB2 H 1 2.795 0.04 A 36 CYS HB3 H 1 3.228 0.04 A 36 CYS C C 13 177.070 0.04 A 36 CYS CA C 13 63.900 0.04 A 36 CYS CB C 13 29.650 0.04 A 36 CYS N N 15 125.790 0.04 A 37 GLN H H 1 8.170 0.04 A 37 GLN HA H 1 4.010 0.04 A 37 GLN HBx H 1 2.185 0.04 A 37 GLN HBy H 1 2.185 0.04 A 37 GLN HG2 H 1 2.490 0.04 A 37 GLN HG3 H 1 2.550 0.04 A 37 GLN C C 13 179.690 0.04 A 37 GLN CA C 13 59.980 0.04 A 37 GLN CB C 13 27.820 0.04 A 37 GLN CG C 13 34.050 0.04 A 37 GLN N N 15 115.860 0.04 A 38 LYS H H 1 7.920 0.04 A 38 LYS HA H 1 4.060 0.04 A 38 LYS HB2 H 1 1.740 0.04 A 38 LYS HB3 H 1 1.830 0.04 A 38 LYS HDx H 1 1.590 0.04 A 38 LYS HDy H 1 1.590 0.04 A 38 LYS HEx H 1 2.880 0.04 A 38 LYS HEy H 1 2.880 0.04 A 38 LYS HG2 H 1 1.380 0.04 A 38 LYS HG3 H 1 1.520 0.04 A 38 LYS C C 13 179.230 0.04 A 38 LYS CA C 13 59.450 0.04 A 38 LYS CB C 13 32.650 0.04 A 38 LYS CD C 13 29.350 0.04 A 38 LYS CE C 13 41.910 0.04 A 38 LYS CG C 13 25.350 0.04 A 38 LYS N N 15 117.470 0.04 A 39 MET H H 1 8.370 0.04 A 39 MET HA H 1 4.559 0.04 A 39 MET HB2 H 1 1.928 0.04 A 39 MET HB3 H 1 2.354 0.04 A 39 MET HG2 H 1 2.590 0.04 A 39 MET HG3 H 1 2.754 0.04 A 39 MET C C 13 179.720 0.04 A 39 MET CA C 13 57.250 0.04 A 39 MET CB C 13 32.550 0.04 A 39 MET CG C 13 33.650 0.04 A 39 MET N N 15 118.050 0.04 A 40 LYS H H 1 9.490 0.04 A 40 LYS HA H 1 3.840 0.04 A 40 LYS HB2 H 1 1.999 0.04 A 40 LYS HB3 H 1 2.153 0.04 A 40 LYS HDx H 1 1.702 0.04 A 40 LYS HDy H 1 1.702 0.04 A 40 LYS HE2 H 1 3.150 0.04 A 40 LYS HE3 H 1 3.284 0.04 A 40 LYS HGx H 1 1.418 0.04 A 40 LYS HGy H 1 1.418 0.04 A 40 LYS C C 13 180.150 0.04 A 40 LYS CA C 13 61.520 0.04 A 40 LYS CB C 13 32.620 0.04 A 40 LYS CD C 13 30.150 0.04 A 40 LYS CE C 13 43.350 0.04 A 40 LYS CG C 13 27.350 0.04 A 40 LYS N N 15 121.630 0.04 A 41 ARG H H 1 7.610 0.04 A 41 ARG HA H 1 4.180 0.04 A 41 ARG HB2 H 1 2.040 0.04 A 41 ARG HB3 H 1 2.210 0.04 A 41 ARG HD2 H 1 3.294 0.04 A 41 ARG HD3 H 1 3.294 0.04 A 41 ARG HG2 H 1 1.780 0.04 A 41 ARG HG3 H 1 1.990 0.04 A 41 ARG C C 13 180.080 0.04 A 41 ARG CA C 13 59.750 0.04 A 41 ARG CB C 13 30.010 0.04 A 41 ARG CD C 13 43.550 0.04 A 41 ARG CG C 13 27.650 0.04 A 41 ARG N N 15 118.300 0.04 A 42 VAL H H 1 7.760 0.04 A 42 VAL HA H 1 3.745 0.04 A 42 VAL HB H 1 2.454 0.04 A 42 VAL HG1% H 1 1.116 0.04 A 42 VAL HG2% H 1 0.960 0.04 A 42 VAL C C 13 178.130 0.04 A 42 VAL CA C 13 66.760 0.04 A 42 VAL CB C 13 31.520 0.04 A 42 VAL CG1 C 13 22.860 0.04 A 42 VAL CG2 C 13 22.750 0.04 A 42 VAL N N 15 121.750 0.04 A 43 VAL H H 1 8.500 0.04 A 43 VAL HA H 1 3.531 0.04 A 43 VAL HB H 1 2.221 0.04 A 43 VAL HG1% H 1 0.958 0.04 A 43 VAL HG2% H 1 0.975 0.04 A 43 VAL C C 13 179.310 0.04 A 43 VAL CA C 13 67.120 0.04 A 43 VAL CB C 13 31.510 0.04 A 43 VAL CG1 C 13 21.750 0.04 A 43 VAL CG2 C 13 21.980 0.04 A 43 VAL N N 15 120.580 0.04 A 44 GLN H H 1 8.400 0.04 A 44 GLN HA H 1 4.010 0.04 A 44 GLN HBx H 1 2.253 0.04 A 44 GLN HBy H 1 2.253 0.04 A 44 GLN HGx H 1 2.530 0.04 A 44 GLN HGy H 1 2.530 0.04 A 44 GLN C C 13 179.330 0.04 A 44 GLN CA C 13 59.060 0.04 A 44 GLN CB C 13 28.030 0.04 A 44 GLN CG C 13 34.250 0.04 A 44 GLN N N 15 119.280 0.04 A 45 HIS H H 1 8.1900 0.04 A 45 HIS HA H 1 4.283 0.04 A 45 HIS HBx H 1 3.380 0.04 A 45 HIS HBy H 1 3.380 0.04 A 45 HIS C C 13 178.250 0.04 A 45 HIS CA C 13 59.950 0.04 A 45 HIS CB C 13 27.150 0.04 A 45 HIS N N 15 119.160 0.04 A 46 THR H H 1 7.980 0.04 A 46 THR HA H 1 3.859 0.04 A 46 THR HB H 1 4.225 0.04 A 46 THR HG2% H 1 1.669 0.04 A 46 THR C C 13 176.350 0.04 A 46 THR CA C 13 65.670 0.04 A 46 THR CB C 13 69.190 0.04 A 46 THR CG2 C 13 22.250 0.04 A 46 THR N N 15 111.110 0.04 A 47 LYS H H 1 7.410 0.04 A 47 LYS HA H 1 4.090 0.04 A 47 LYS HBx H 1 1.899 0.04 A 47 LYS HBy H 1 1.899 0.04 A 47 LYS HD2 H 1 1.660 0.04 A 47 LYS HD3 H 1 1.660 0.04 A 47 LYS HE2 H 1 2.920 0.04 A 47 LYS HE3 H 1 2.920 0.04 A 47 LYS HGx H 1 1.490 0.04 A 47 LYS HGy H 1 1.490 0.04 A 47 LYS C C 13 178.150 0.04 A 47 LYS CA C 13 58.750 0.04 A 47 LYS CB C 13 32.360 0.04 A 47 LYS CD C 13 29.250 0.04 A 47 LYS CE C 13 42.250 0.04 A 47 LYS CG C 13 25.500 0.04 A 47 LYS N N 15 120.510 0.04 A 48 GLY H H 1 7.180 0.04 A 48 GLY HA2 H 1 3.656 0.04 A 48 GLY HA3 H 1 4.409 0.04 A 48 GLY C C 13 174.220 0.04 A 48 GLY CA C 13 44.753 0.04 A 48 GLY N N 15 104.210 0.04 A 49 CYS H H 1 6.981 0.04 A 49 CYS HA H 1 4.010 0.04 A 49 CYS HB2 H 1 2.085 0.04 A 49 CYS HB3 H 1 2.730 0.04 A 49 CYS C C 13 177.230 0.04 A 49 CYS CA C 13 61.230 0.04 A 49 CYS CB C 13 29.850 0.04 A 49 CYS N N 15 123.560 0.04 A 50 LYS H H 1 8.999 0.04 A 50 LYS HA H 1 4.524 0.04 A 50 LYS HB2 H 1 1.877 0.04 A 50 LYS HB3 H 1 2.090 0.04 A 50 LYS HD2 H 1 1.775 0.04 A 50 LYS HD3 H 1 1.775 0.04 A 50 LYS HE2 H 1 3.090 0.04 A 50 LYS HE3 H 1 3.090 0.04 A 50 LYS HG2 H 1 1.650 0.04 A 50 LYS HG3 H 1 1.570 0.04 A 50 LYS C C 13 178.040 0.04 A 50 LYS CA C 13 56.750 0.04 A 50 LYS CB C 13 32.950 0.04 A 50 LYS CD C 13 28.850 0.04 A 50 LYS CE C 13 42.410 0.04 A 50 LYS CG C 13 25.050 0.04 A 50 LYS N N 15 128.350 0.04 A 51 ARG H H 1 8.558 0.04 A 51 ARG HA H 1 4.428 0.04 A 51 ARG HB2 H 1 1.837 0.04 A 51 ARG HB3 H 1 1.890 0.04 A 51 ARG HD2 H 1 3.330 0.04 A 51 ARG HD3 H 1 3.330 0.04 A 51 ARG HG2 H 1 1.760 0.04 A 51 ARG HG3 H 1 1.810 0.04 A 51 ARG C C 13 177.410 0.04 A 51 ARG CA C 13 57.750 0.04 A 51 ARG CB C 13 31.860 0.04 A 51 ARG CD C 13 43.650 0.04 A 51 ARG CG C 13 27.550 0.04 A 51 ARG N N 15 122.550 0.04 A 52 LYS H H 1 8.490 0.04 A 52 LYS HA H 1 4.534 0.04 A 52 LYS HB2 H 1 2.140 0.04 A 52 LYS HB3 H 1 2.330 0.04 A 52 LYS HD2 H 1 2.080 0.04 A 52 LYS HD3 H 1 1.820 0.04 A 52 LYS HE2 H 1 3.210 0.04 A 52 LYS HE3 H 1 3.210 0.04 A 52 LYS HG2 H 1 1.650 0.04 A 52 LYS HG3 H 1 1.420 0.04 A 52 LYS C C 13 177.610 0.04 A 52 LYS CA C 13 57.970 0.04 A 52 LYS CB C 13 32.350 0.04 A 52 LYS CD C 13 29.350 0.04 A 52 LYS CE C 13 42.650 0.04 A 52 LYS CG C 13 25.050 0.04 A 52 LYS N N 15 119.040 0.04 A 53 THR H H 1 7.760 0.04 A 53 THR HA H 1 4.160 0.04 A 53 THR HB H 1 4.256 0.04 A 53 THR HG2% H 1 1.213 0.04 A 53 THR C C 13 175.610 0.04 A 53 THR CA C 13 64.050 0.04 A 53 THR CB C 13 69.120 0.04 A 53 THR CG2 C 13 22.450 0.04 A 53 THR N N 15 113.034 0.04 A 54 ASN H H 1 8.290 0.04 A 54 ASN HA H 1 4.920 0.04 A 54 ASN HBx H 1 2.930 0.04 A 54 ASN HBy H 1 2.930 0.04 A 54 ASN C C 13 176.330 0.04 A 54 ASN CA C 13 53.720 0.04 A 54 ASN CB C 13 38.350 0.04 A 54 ASN N N 15 119.860 0.04 A 55 GLY H H 1 8.006 0.04 A 55 GLY HA2 H 1 4.030 0.04 A 55 GLY HA3 H 1 4.030 0.04 A 55 GLY C C 13 175.660 0.04 A 55 GLY CA C 13 45.938 0.04 A 55 GLY N N 15 107.570 0.04 A 56 GLY H H 1 7.840 0.04 A 56 GLY HA2 H 1 4.015 0.04 A 56 GLY HA3 H 1 4.015 0.04 A 56 GLY C C 13 173.710 0.04 A 56 GLY CA C 13 45.570 0.04 A 56 GLY N N 15 107.290 0.04 A 57 CYS H H 1 8.048 0.04 A 57 CYS HA H 1 4.505 0.04 A 57 CYS HB2 H 1 2.901 0.04 A 57 CYS HB3 H 1 2.978 0.04 A 57 CYS C C 13 175.090 0.04 A 57 CYS CA C 13 55.950 0.04 A 57 CYS CB C 13 30.760 0.04 A 57 CYS N N 15 122.730 0.04 A 58 PRO HA H 1 4.338 0.04 A 58 PRO HB2 H 1 2.020 0.04 A 58 PRO HB3 H 1 2.420 0.04 A 58 PRO HD2 H 1 3.815 0.04 A 58 PRO HD3 H 1 4.085 0.04 A 58 PRO HG2 H 1 2.107 0.04 A 58 PRO HG3 H 1 2.215 0.04 A 58 PRO CA C 13 65.050 0.04 A 58 PRO CB C 13 32.620 0.04 A 58 PRO CD C 13 51.150 0.04 A 58 PRO CG C 13 27.855 0.04 A 59 ILE H H 1 7.900 0.04 A 59 ILE HA H 1 3.818 0.04 A 59 ILE HB H 1 1.547 0.04 A 59 ILE HD1% H 1 0.480 0.04 A 59 ILE HG12 H 1 0.935 0.04 A 59 ILE HG13 H 1 1.435 0.04 A 59 ILE HG2% H 1 0.725 0.04 A 59 ILE C C 13 178.820 0.04 A 59 ILE CA C 13 64.590 0.04 A 59 ILE CB C 13 38.890 0.04 A 59 ILE CD1 C 13 12.850 0.04 A 59 ILE CG1 C 13 28.100 0.04 A 59 ILE CG2 C 13 18.650 0.04 A 59 ILE N N 15 121.256 0.04 A 60 CYS H H 1 8.914 0.04 A 60 CYS HA H 1 4.117 0.04 A 60 CYS HB2 H 1 2.806 0.04 A 60 CYS HB3 H 1 3.005 0.04 A 60 CYS C C 13 178.110 0.04 A 60 CYS CA C 13 66.090 0.04 A 60 CYS CB C 13 29.150 0.04 A 60 CYS N N 15 123.970 0.04 A 61 LYS H H 1 8.090 0.04 A 61 LYS HA H 1 3.910 0.04 A 61 LYS HB2 H 1 1.780 0.04 A 61 LYS HB3 H 1 1.890 0.04 A 61 LYS HDx H 1 1.640 0.04 A 61 LYS HDy H 1 1.640 0.04 A 61 LYS HEx H 1 2.950 0.04 A 61 LYS HEy H 1 2.950 0.04 A 61 LYS HG2 H 1 1.400 0.04 A 61 LYS HG3 H 1 1.550 0.04 A 61 LYS C C 13 179.460 0.04 A 61 LYS CA C 13 59.970 0.04 A 61 LYS CB C 13 32.650 0.04 A 61 LYS CD C 13 29.550 0.04 A 61 LYS CE C 13 42.150 0.04 A 61 LYS CG C 13 25.350 0.04 A 61 LYS N N 15 117.210 0.04 A 62 GLN H H 1 7.360 0.04 A 62 GLN HA H 1 4.203 0.04 A 62 GLN HB2 H 1 2.000 0.04 A 62 GLN HB3 H 1 2.000 0.04 A 62 GLN HG2 H 1 2.270 0.04 A 62 GLN HG3 H 1 2.480 0.04 A 62 GLN C C 13 178.564 0.04 A 62 GLN CA C 13 58.450 0.04 A 62 GLN CB C 13 29.140 0.04 A 62 GLN CG C 13 34.350 0.04 A 62 GLN N N 15 117.780 0.04 A 63 LEU H H 1 8.075 0.04 A 63 LEU HA H 1 4.218 0.04 A 63 LEU HBx H 1 1.960 0.04 A 63 LEU HBy H 1 1.960 0.04 A 63 LEU HD1% H 1 1.054 0.04 A 63 LEU HD2% H 1 1.025 0.04 A 63 LEU HG H 1 1.925 0.04 A 63 LEU C C 13 179.440 0.04 A 63 LEU CA C 13 58.550 0.04 A 63 LEU CB C 13 41.910 0.04 A 63 LEU CD1 C 13 25.350 0.04 A 63 LEU CD2 C 13 24.850 0.04 A 63 LEU CG C 13 27.750 0.04 A 63 LEU N N 15 119.930 0.04 A 64 ILE H H 1 8.466 0.04 A 64 ILE HA H 1 3.600 0.04 A 64 ILE HB H 1 1.489 0.04 A 64 ILE HD1% H 1 0.449 0.04 A 64 ILE HG12 H 1 0.445 0.04 A 64 ILE HG13 H 1 1.115 0.04 A 64 ILE HG2% H 1 0.827 0.04 A 64 ILE C C 13 177.950 0.04 A 64 ILE CA C 13 65.250 0.04 A 64 ILE CB C 13 37.320 0.04 A 64 ILE CD1 C 13 13.450 0.04 A 64 ILE CG1 C 13 29.850 0.04 A 64 ILE CG2 C 13 17.200 0.04 A 64 ILE N N 15 120.280 0.04 A 65 ALA H H 1 7.496 0.04 A 65 ALA HA H 1 4.185 0.04 A 65 ALA HB% H 1 1.550 0.04 A 65 ALA C C 13 181.010 0.04 A 65 ALA CA C 13 55.220 0.04 A 65 ALA CB C 13 18.450 0.04 A 65 ALA N N 15 122.590 0.04 A 66 LEU H H 1 8.139 0.04 A 66 LEU HA H 1 4.100 0.04 A 66 LEU HB2 H 1 1.598 0.04 A 66 LEU HB3 H 1 1.766 0.04 A 66 LEU HD1% H 1 0.973 0.04 A 66 LEU HD2% H 1 0.970 0.04 A 66 LEU HG H 1 1.804 0.04 A 66 LEU C C 13 179.380 0.04 A 66 LEU CA C 13 57.930 0.04 A 66 LEU CB C 13 41.410 0.04 A 66 LEU CD1 C 13 25.150 0.04 A 66 LEU CD2 C 13 24.050 0.04 A 66 LEU CG C 13 27.550 0.04 A 66 LEU N N 15 115.599 0.04 A 67 ALA H H 1 8.770 0.04 A 67 ALA HA H 1 3.958 0.04 A 67 ALA HB% H 1 1.695 0.04 A 67 ALA C C 13 180.060 0.04 A 67 ALA CA C 13 55.750 0.04 A 67 ALA CB C 13 19.220 0.04 A 67 ALA N N 15 122.670 0.04 A 68 ALA H H 1 8.604 0.04 A 68 ALA HA H 1 4.142 0.04 A 68 ALA HB% H 1 1.542 0.04 A 68 ALA C C 13 179.540 0.04 A 68 ALA CA C 13 55.450 0.04 A 68 ALA CB C 13 18.220 0.04 A 68 ALA N N 15 120.580 0.04 A 69 TYR HA H 1 4.345 0.04 A 69 TYR HB2 H 1 2.850 0.04 A 69 TYR HB3 H 1 2.968 0.04 A 69 TYR CA C 13 57.750 0.04 A 69 TYR CB C 13 38.580 0.04 A 71 ALA HA H 1 4.000 0.04 A 71 ALA HB% H 1 1.625 0.04 A 71 ALA C C 13 179.540 0.04 A 71 ALA CA C 13 54.850 0.04 A 71 ALA CB C 13 19.650 0.04 A 72 LYS H H 1 7.080 0.04 A 72 LYS HA H 1 3.904 0.04 A 72 LYS HB2 H 1 1.495 0.04 A 72 LYS HB3 H 1 1.622 0.04 A 72 LYS HD2 H 1 1.380 0.04 A 72 LYS HD3 H 1 1.380 0.04 A 72 LYS HE2 H 1 2.946 0.04 A 72 LYS HE3 H 1 2.946 0.04 A 72 LYS HG2 H 1 1.260 0.04 A 72 LYS HG3 H 1 1.370 0.04 A 72 LYS C C 13 177.120 0.04 A 72 LYS CA C 13 58.230 0.04 A 72 LYS CB C 13 32.340 0.04 A 72 LYS CD C 13 25.360 0.04 A 72 LYS CE C 13 42.050 0.04 A 72 LYS CG C 13 24.540 0.04 A 72 LYS N N 15 114.680 0.04 A 73 HIS H H 1 7.250 0.04 A 73 HIS HA H 1 4.826 0.04 A 73 HIS HB2 H 1 2.940 0.04 A 73 HIS HB3 H 1 3.445 0.04 A 73 HIS C C 13 173.660 0.04 A 73 HIS CA C 13 54.380 0.04 A 73 HIS CB C 13 30.350 0.04 A 73 HIS N N 15 113.498 0.04 A 74 CYS H H 1 7.140 0.04 A 74 CYS HA H 1 4.150 0.04 A 74 CYS HB2 H 1 1.820 0.04 A 74 CYS HB3 H 1 2.480 0.04 A 74 CYS C C 13 176.480 0.04 A 74 CYS CA C 13 60.250 0.04 A 74 CYS CB C 13 29.930 0.04 A 74 CYS N N 15 123.830 0.04 A 75 GLN H H 1 9.088 0.04 A 75 GLN HA H 1 4.685 0.04 A 75 GLN HBx H 1 2.347 0.04 A 75 GLN HBy H 1 2.347 0.04 A 75 GLN HG2 H 1 2.370 0.04 A 75 GLN HG3 H 1 2.370 0.04 A 75 GLN C C 13 176.090 0.04 A 75 GLN CA C 13 54.900 0.04 A 75 GLN CB C 13 29.840 0.04 A 75 GLN CG C 13 33.850 0.04 A 75 GLN N N 15 128.740 0.04 A 76 GLU H H 1 8.390 0.04 A 76 GLU HA H 1 4.480 0.04 A 76 GLU HB2 H 1 2.150 0.04 A 76 GLU HB3 H 1 2.080 0.04 A 76 GLU HG2 H 1 2.480 0.04 A 76 GLU HG3 H 1 2.480 0.04 A 76 GLU C C 13 177.030 0.04 A 76 GLU CA C 13 56.210 0.04 A 76 GLU CB C 13 30.660 0.04 A 76 GLU CG C 13 34.350 0.04 A 76 GLU N N 15 123.190 0.04 A 77 ASN H H 1 8.848 0.04 A 77 ASN HA H 1 4.549 0.04 A 77 ASN HBx H 1 2.855 0.04 A 77 ASN HBy H 1 2.855 0.04 A 77 ASN C C 13 176.070 0.04 A 77 ASN CA C 13 55.100 0.04 A 77 ASN CB C 13 38.650 0.04 A 77 ASN N N 15 124.760 0.04 A 78 LYS H H 1 8.636 0.04 A 78 LYS HA H 1 4.460 0.04 A 78 LYS HB2 H 1 1.690 0.04 A 78 LYS HB3 H 1 1.960 0.04 A 78 LYS HD2 H 1 1.740 0.04 A 78 LYS HD3 H 1 1.740 0.04 A 78 LYS HE2 H 1 3.044 0.04 A 78 LYS HE3 H 1 3.044 0.04 A 78 LYS HG2 H 1 1.380 0.04 A 78 LYS HG3 H 1 1.441 0.04 A 78 LYS C C 13 175.230 0.04 A 78 LYS CA C 13 54.920 0.04 A 78 LYS CB C 13 31.020 0.04 A 78 LYS CD C 13 28.950 0.04 A 78 LYS CE C 13 42.050 0.04 A 78 LYS CG C 13 24.250 0.04 A 78 LYS N N 15 120.810 0.04 A 80 PRO HA H 1 4.710 0.04 A 80 PRO HB2 H 1 2.080 0.04 A 80 PRO HB3 H 1 2.170 0.04 A 80 PRO HD2 H 1 3.880 0.04 A 80 PRO HD3 H 1 4.214 0.04 A 80 PRO HG2 H 1 1.690 0.04 A 80 PRO HG3 H 1 2.080 0.04 A 80 PRO CA C 13 62.850 0.04 A 80 PRO CB C 13 32.150 0.04 A 80 PRO CD C 13 51.450 0.04 A 80 PRO CG C 13 26.950 0.04 A 81 VAL HA H 1 3.578 0.04 A 81 VAL HB H 1 2.230 0.04 A 81 VAL HG1% H 1 0.691 0.04 A 81 VAL HG2% H 1 0.441 0.04 A 81 VAL CA C 13 62.350 0.04 A 81 VAL CB C 13 31.616 0.04 A 81 VAL CG1 C 13 19.980 0.04 A 81 VAL CG2 C 13 24.080 0.04 A 82 PRO HA H 1 4.850 0.04 A 82 PRO HB2 H 1 2.000 0.04 A 82 PRO HB3 H 1 2.403 0.04 A 82 PRO HD2 H 1 3.580 0.04 A 82 PRO HD3 H 1 3.690 0.04 A 82 PRO HG2 H 1 1.910 0.04 A 82 PRO HG3 H 1 2.240 0.04 A 82 PRO CA C 13 63.350 0.04 A 82 PRO CB C 13 32.050 0.04 A 82 PRO CD C 13 49.950 0.04 A 82 PRO CG C 13 27.250 0.04 A 83 PHE HA H 1 4.160 0.04 A 83 PHE HBx H 1 3.290 0.04 A 83 PHE HBy H 1 3.290 0.04 A 83 PHE CA C 13 58.950 0.04 A 83 PHE CB C 13 38.250 0.04 A 84 CYS HA H 1 4.597 0.04 A 84 CYS HB2 H 1 2.600 0.04 A 84 CYS HB3 H 1 2.740 0.04 A 84 CYS CA C 13 56.750 0.04 A 84 CYS CB C 13 30.150 0.04 A 85 LEU H H 1 8.220 0.04 A 85 LEU HA H 1 3.958 0.04 A 85 LEU HB2 H 1 1.577 0.04 A 85 LEU HB3 H 1 1.928 0.04 A 85 LEU HD1% H 1 0.875 0.04 A 85 LEU HD2% H 1 0.875 0.04 A 85 LEU HG H 1 1.203 0.04 A 85 LEU CA C 13 59.350 0.04 A 85 LEU CB C 13 38.180 0.04 A 85 LEU CD1 C 13 25.350 0.04 A 85 LEU CD2 C 13 24.550 0.04 A 85 LEU CG C 13 28.270 0.04 A 85 LEU N N 15 119.930 0.04 A 86 ASN H H 1 7.789 0.04 A 86 ASN HA H 1 4.580 0.04 A 86 ASN HB2 H 1 2.855 0.04 A 86 ASN HB3 H 1 3.035 0.04 A 86 ASN CA C 13 51.860 0.04 A 86 ASN CB C 13 38.610 0.04 A 86 ASN N N 15 115.750 0.04 A 87 ILE H H 1 7.160 0.04 A 87 ILE HA H 1 4.220 0.04 A 87 ILE HB H 1 1.830 0.04 A 87 ILE HD1% H 1 0.670 0.04 A 87 ILE HG12 H 1 1.520 0.04 A 87 ILE HG13 H 1 1.520 0.04 A 87 ILE HG2% H 1 0.996 0.04 A 87 ILE CA C 13 61.850 0.04 A 87 ILE CB C 13 41.330 0.04 A 87 ILE N N 15 123.260 0.04 A 88 LYS HA H 1 4.450 0.04 A 88 LYS HB2 H 1 1.960 0.04 A 88 LYS HB3 H 1 1.960 0.04 A 88 LYS HD2 H 1 1.750 0.04 A 88 LYS HD3 H 1 1.750 0.04 A 88 LYS HE2 H 1 3.040 0.04 A 88 LYS HE3 H 1 3.040 0.04 A 88 LYS HG2 H 1 1.384 0.04 A 88 LYS HG3 H 1 1.446 0.04 A 88 LYS CA C 13 54.530 0.04 A 88 LYS CB C 13 31.450 0.04 A 88 LYS CD C 13 28.950 0.04 A 88 LYS CE C 13 42.050 0.04 A 88 LYS CG C 13 24.380 0.04 A 89 GLN HA H 1 4.450 0.04 A 89 GLN HB2 H 1 2.040 0.04 A 89 GLN HB3 H 1 2.140 0.04 A 89 GLN HGx H 1 2.410 0.04 A 89 GLN HGy H 1 2.410 0.04 A 89 GLN CA C 13 56.210 0.04 A 89 GLN CB C 13 29.250 0.04 A 89 GLN CG C 13 33.950 0.04 A 90 LYS H H 1 7.750 0.04 A 90 LYS HA H 1 4.180 0.04 A 90 LYS HB2 H 1 1.784 0.04 A 90 LYS HB3 H 1 1.884 0.04 A 90 LYS HD2 H 1 1.720 0.04 A 90 LYS HD3 H 1 1.720 0.04 A 90 LYS HE2 H 1 3.050 0.04 A 90 LYS HE3 H 1 3.050 0.04 A 90 LYS HG2 H 1 1.480 0.04 A 90 LYS HG3 H 1 1.480 0.04 A 90 LYS CA C 13 58.040 0.04 A 90 LYS CB C 13 33.370 0.04 A 90 LYS CD C 13 29.150 0.04 A 90 LYS CE C 13 42.150 0.04 A 90 LYS CG C 13 25.350 0.04 A 90 LYS N N 15 127.480 0.04 stop_ save_ save_assigned_chem_shift_list_2 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_2 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 B 1 LEU H1 H 1 7.752 . B 1 LEU HA H 1 4.713 . B 1 LEU HBx H 1 1.645 . B 1 LEU HBy H 1 1.645 . B 1 LEU HDx% H 1 0.995 . B 1 LEU HDy% H 1 0.983 . B 1 LEU HG H 1 1.746 . B 1 LEU CA C 13 53.010 . B 1 LEU CB C 13 41.880 . B 1 LEU CDy C 13 24.950 . B 1 LEU CDx C 13 23.350 . B 1 LEU CG C 13 27.150 . B 1 LEU N N 15 120.830 . B 2 PRO HA H 1 4.520 . B 2 PRO HBx H 1 2.250 . B 2 PRO HBy H 1 2.385 . B 2 PRO HDx H 1 3.725 . B 2 PRO HDy H 1 3.924 . B 2 PRO HGx H 1 2.050 . B 2 PRO HGy H 1 2.120 . B 2 PRO C C 13 176.940 . B 2 PRO CA C 13 63.580 . B 2 PRO CB C 13 31.850 . B 2 PRO CD C 13 50.350 . B 2 PRO CG C 13 27.150 . B 3 SER H H 1 8.310 . B 3 SER HA H 1 4.440 . B 3 SER HBx H 1 3.959 . B 3 SER HBy H 1 3.959 . B 3 SER C C 13 174.990 . B 3 SER CA C 13 58.490 . B 3 SER CB C 13 63.590 . B 3 SER N N 15 115.350 . B 4 GLN H H 1 8.356 . B 4 GLN HA H 1 4.440 . B 4 GLN HBx H 1 2.058 . B 4 GLN HBy H 1 2.153 . B 4 GLN HE2y H 1 7.579 . B 4 GLN HE2x H 1 6.860 . B 4 GLN HGx H 1 2.434 . B 4 GLN HGy H 1 2.434 . B 4 GLN C C 13 175.950 . B 4 GLN CA C 13 55.850 . B 4 GLN CB C 13 29.010 . B 4 GLN CG C 13 34.350 . B 4 GLN N N 15 121.810 . B 4 GLN NE2 N 15 112.200 . B 5 ALA H H 1 8.240 . B 5 ALA HA H 1 4.239 . B 5 ALA HB% H 1 1.465 . B 5 ALA C C 13 178.140 . B 5 ALA CA C 13 52.880 . B 5 ALA CB C 13 18.850 . B 5 ALA N N 15 124.430 . B 6 MET H H 1 8.268 . B 6 MET HA H 1 4.483 . B 6 MET HBx H 1 2.087 . B 6 MET HBy H 1 2.087 . B 6 MET HGx H 1 2.615 . B 6 MET HGy H 1 2.615 . B 6 MET C C 13 176.480 . B 6 MET CA C 13 55.650 . B 6 MET CB C 13 32.580 . B 6 MET CG C 13 32.160 . B 6 MET N N 15 118.630 . B 7 ASP H H 1 8.205 . B 7 ASP HA H 1 4.505 . B 7 ASP HBx H 1 2.695 . B 7 ASP HBy H 1 2.695 . B 7 ASP C C 13 176.550 . B 7 ASP CA C 13 55.230 . B 7 ASP CB C 13 41.150 . B 7 ASP N N 15 120.450 . B 8 ASP H H 1 8.210 . B 8 ASP HA H 1 4.590 . B 8 ASP HBx H 1 2.719 . B 8 ASP HBy H 1 2.719 . B 8 ASP C C 13 176.580 . B 8 ASP CA C 13 54.650 . B 8 ASP CB C 13 40.950 . B 8 ASP N N 15 119.550 . B 9 LEU H H 1 8.001 . B 9 LEU HA H 1 4.305 . B 9 LEU HBx H 1 1.688 . B 9 LEU HBy H 1 1.688 . B 9 LEU HDx% H 1 0.934 . B 9 LEU HDy% H 1 0.875 . B 9 LEU HG H 1 1.665 . B 9 LEU C C 13 176.950 . B 9 LEU CA C 13 55.390 . B 9 LEU CB C 13 42.390 . B 9 LEU CDx C 13 25.520 . B 9 LEU CG C 13 27.550 . B 9 LEU N N 15 120.800 . B 10 MET H H 1 8.088 . B 10 MET HA H 1 4.485 . B 10 MET HBx H 1 2.095 . B 10 MET HBy H 1 2.095 . B 10 MET HGx H 1 2.575 . B 10 MET HGy H 1 2.615 . B 10 MET C C 13 176.050 . B 10 MET CA C 13 55.400 . B 10 MET CB C 13 32.140 . B 10 MET CG C 13 32.140 . B 10 MET N N 15 118.720 . B 11 LEU H H 1 7.950 . B 11 LEU HA H 1 4.453 . B 11 LEU HBx H 1 1.575 . B 11 LEU HBy H 1 1.625 . B 11 LEU HDx% H 1 0.881 . B 11 LEU HDy% H 1 0.883 . B 11 LEU HG H 1 1.626 . B 11 LEU C C 13 177.570 . B 11 LEU CA C 13 54.680 . B 11 LEU CB C 13 42.880 . B 11 LEU CDy C 13 25.250 . B 11 LEU CDx C 13 23.650 . B 11 LEU CG C 13 27.450 . B 11 LEU N N 15 121.830 . B 12 SER H H 1 8.590 . B 12 SER HA H 1 4.875 . B 12 SER HBx H 1 3.915 . B 12 SER HBy H 1 4.035 . B 12 SER CA C 13 55.550 . B 12 SER CB C 13 63.680 . B 12 SER N N 15 117.880 . B 13 PRO HA H 1 4.345 . B 13 PRO HBx H 1 2.024 . B 13 PRO HBy H 1 2.297 . B 13 PRO HDx H 1 3.870 . B 13 PRO HDy H 1 3.870 . B 13 PRO HGx H 1 1.994 . B 13 PRO HGy H 1 2.108 . B 13 PRO C C 13 177.390 . B 13 PRO CA C 13 64.450 . B 13 PRO CB C 13 31.760 . B 13 PRO CD C 13 50.250 . B 13 PRO CG C 13 27.450 . B 14 ASP H H 1 8.101 . B 14 ASP HA H 1 4.480 . B 14 ASP HBx H 1 2.550 . B 14 ASP HBy H 1 2.700 . B 14 ASP C C 13 177.110 . B 14 ASP CA C 13 55.390 . B 14 ASP CB C 13 40.950 . B 14 ASP N N 15 117.110 . B 15 ASP H H 1 7.862 . B 15 ASP HA H 1 4.502 . B 15 ASP HBx H 1 2.700 . B 15 ASP HBy H 1 2.700 . B 15 ASP C C 13 177.230 . B 15 ASP CA C 13 55.390 . B 15 ASP CB C 13 41.120 . B 15 ASP N N 15 119.620 . B 16 ILE H H 1 7.620 . B 16 ILE HA H 1 3.380 . B 16 ILE HB H 1 1.739 . B 16 ILE HD1% H 1 0.748 . B 16 ILE HG1y H 1 1.349 . B 16 ILE HG1x H 1 0.970 . B 16 ILE HG2% H 1 0.760 . B 16 ILE C C 13 176.950 . B 16 ILE CA C 13 62.740 . B 16 ILE CB C 13 37.880 . B 16 ILE CD1 C 13 13.810 . B 16 ILE CG1 C 13 28.390 . B 16 ILE CG2 C 13 17.570 . B 16 ILE N N 15 119.210 . B 17 GLU H H 1 8.065 . B 17 GLU HA H 1 4.049 . B 17 GLU HBx H 1 2.038 . B 17 GLU HBy H 1 2.038 . B 17 GLU HGx H 1 2.287 . B 17 GLU HGy H 1 2.320 . B 17 GLU C C 13 178.190 . B 17 GLU CA C 13 58.450 . B 17 GLU CB C 13 29.480 . B 17 GLU CG C 13 36.550 . B 17 GLU N N 15 119.710 . B 18 GLN H H 1 7.801 . B 18 GLN HA H 1 4.232 . B 18 GLN HBx H 1 2.150 . B 18 GLN HBy H 1 2.150 . B 18 GLN HE2y H 1 7.470 . B 18 GLN HE2x H 1 6.770 . B 18 GLN HGx H 1 2.320 . B 18 GLN HGy H 1 2.320 . B 18 GLN C C 13 177.110 . B 18 GLN CA C 13 56.920 . B 18 GLN CB C 13 28.640 . B 18 GLN CG C 13 34.050 . B 18 GLN N N 15 116.780 . B 18 GLN NE2 N 15 111.960 . B 19 TRP H H 1 7.865 . B 19 TRP HA H 1 4.526 . B 19 TRP HBx H 1 2.874 . B 19 TRP HBy H 1 3.051 . B 19 TRP HD1 H 1 7.370 . B 19 TRP HE1 H 1 10.020 . B 19 TRP C C 13 176.820 . B 19 TRP CA C 13 57.750 . B 19 TRP CB C 13 29.280 . B 19 TRP N N 15 119.620 . B 19 TRP NE1 N 15 128.220 . B 20 PHE H H 1 7.943 . B 20 PHE HA H 1 4.726 . B 20 PHE HBx H 1 3.032 . B 20 PHE HBy H 1 3.295 . B 20 PHE HDx H 1 7.320 . B 20 PHE HDy H 1 7.320 . B 20 PHE HEx H 1 7.039 . B 20 PHE HEy H 1 7.039 . B 20 PHE C C 13 175.820 . B 20 PHE CA C 13 57.620 . B 20 PHE CB C 13 39.040 . B 20 PHE N N 15 116.350 . B 21 THR H H 1 7.770 . B 21 THR HA H 1 4.404 . B 21 THR HB H 1 4.299 . B 21 THR HG2% H 1 1.264 . B 21 THR C C 13 174.460 . B 21 THR CA C 13 61.980 . B 21 THR CB C 13 66.990 . B 21 THR CG2 C 13 21.950 . B 21 THR N N 15 115.610 . B 22 GLU H H 1 8.278 . B 22 GLU HA H 1 4.380 . B 22 GLU HBx H 1 1.970 . B 22 GLU HBy H 1 2.090 . B 22 GLU HGx H 1 2.315 . B 22 GLU HGy H 1 2.315 . B 22 GLU C C 13 175.840 . B 22 GLU CA C 13 56.150 . B 22 GLU CB C 13 30.400 . B 22 GLU CG C 13 36.250 . B 22 GLU N N 15 122.470 . B 23 ASP H H 1 8.362 . B 23 ASP HA H 1 4.920 . B 23 ASP HBx H 1 2.600 . B 23 ASP HBy H 1 2.795 . B 23 ASP CA C 13 52.170 . B 23 ASP CB C 13 41.190 . B 23 ASP N N 15 122.810 . B 24 PRO HA H 1 4.490 . B 24 PRO HBx H 1 2.100 . B 24 PRO HBy H 1 2.250 . B 24 PRO HDx H 1 3.880 . B 24 PRO HDy H 1 3.880 . B 24 PRO HGx H 1 2.047 . B 24 PRO HGy H 1 2.047 . B 24 PRO C C 13 176.640 . B 24 PRO CA C 13 63.430 . B 24 PRO CB C 13 31.950 . B 24 PRO CD C 13 50.750 . B 24 PRO CG C 13 27.450 . B 25 GLY H H 1 8.064 . B 25 GLY HAx H 1 3.765 . B 25 GLY HAy H 1 3.825 . B 25 GLY CA C 13 46.150 . B 25 GLY N N 15 115.030 . 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 16 ALA HB% B 20 PHE HD% 1.0 2.5 7.0 2 2 A 33 LEU HD1% B 24 PRO HDx 1.0 2.5 7.0 3 2 A 33 LEU HD1% B 24 PRO HDy 1.0 2.5 7.0 4 3 A 39 MET HE1 B 19 TRP HZ2 1.0 3.0 5.2 5 4 A 39 MET HE1 B 19 TRP HD1 1.0 2.5 7.0 6 5 B 19 TRP HD1 A 42 VAL HG1% 1.0 2.5 7.0 7 6 B 19 TRP HZ2 A 42 VAL HG1% 1.0 2.5 7.0 8 7 A 42 VAL H A 41 ARG HD2 1.0 2.5 7.0 9 7 A 42 VAL H A 41 ARG HD3 1.0 2.5 7.0 10 8 A 43 VAL HG1% A 24 ALA HA 1.0 1.5 3.7 11 9 B 19 TRP HD1 A 59 ILE HG2% 1.0 2.5 7.0 12 10 B 19 TRP HZ2 A 59 ILE HG2% 1.0 2.5 7.0 13 11 A 62 GLN HE2y B 13 PRO HA 1.0 3.0 6.5 14 12 A 62 GLN HE2y B 11 LEU HG 1.0 3.0 6.5 15 13 A 62 GLN HE2y B 11 LEU HDx% 1.0 3.0 6.5 16 14 B 11 LEU HDx% A 62 GLN HE2x 1.0 3.0 6.5 17 15 A 69 TYR HA B 10 MET HBy 1.0 2.5 6.5 18 16 A 69 TYR HA B 10 MET HBx 1.0 2.5 6.5 19 17 A 69 TYR HA B 9 LEU HBx 1.0 2.5 6.5 20 17 A 69 TYR HA B 9 LEU HBy 1.0 2.5 6.5 21 18 B 5 ALA H A 17 ILE H 1.0 2.3 7.0 22 19 B 9 LEU HA A 70 HIS HA 1.0 2.3 7.0 23 20 B 9 LEU HA A 72 LYS HB3 1.0 2.3 7.0 24 21 B 11 LEU H A 65 ALA HA 1.0 2.3 7.0 25 22 B 11 LEU H A 68 ALA HB% 1.0 2.3 7.0 26 23 B 11 LEU H A 69 TYR HD% 1.0 2.3 7.0 27 24 B 11 LEU H A 69 TYR HE% 1.0 2.3 7.0 28 25 A 62 GLN HE2x B 16 ILE H 1.0 2.3 6.5 29 26 B 16 ILE H A 13 ILE HG2% 1.0 2.3 6.5 30 27 B 16 ILE H A 66 LEU HB2 1.0 2.3 6.5 31 28 B 16 ILE H A 20 LEU HD2% 1.0 2.3 6.5 32 29 A 17 ILE H B 16 ILE H 1.0 2.3 7.0 33 30 B 16 ILE HG2% A 59 ILE HB 1.0 2.3 6.5 34 31 B 16 ILE HG2% A 63 LEU HD1% 1.0 2.3 6.5 35 32 A 59 ILE HB B 16 ILE HD1% 1.0 2.3 6.5 36 33 A 17 ILE H B 17 GLU H 1.0 2.3 7.0 37 34 B 17 GLU H A 19 SER HB2 1.0 2.3 7.0 38 34 B 17 GLU H A 19 SER HB3 1.0 2.3 7.0 39 35 B 17 GLU H A 20 LEU HD1% 1.0 2.3 7.0 40 36 B 18 GLN H B 22 GLU HBx 1.0 2.3 7.0 41 37 B 18 GLN H A 16 ALA HA 1.0 2.3 7.0 42 38 B 19 TRP HE1 A 59 ILE HG12 1.0 2.3 6.5 43 39 A 59 ILE HG2% B 19 TRP HE1 1.0 2.3 6.5 44 40 A 59 ILE HG12 B 19 TRP H 1.0 2.3 6.5 45 41 B 21 THR H A 38 LYS HDx 1.0 2.3 6.5 46 41 B 21 THR H A 38 LYS HDy 1.0 2.3 6.5 47 42 B 21 THR H A 39 MET HB3 1.0 2.3 6.5 48 43 B 21 THR H A 38 LYS HEx 1.0 2.3 6.5 49 43 B 21 THR H A 38 LYS HEy 1.0 2.3 6.5 50 44 A 2 THR HB A 3 GLN H 1.0 2.3 4.1 51 45 A 3 GLN H A 3 GLN HGy 1.0 3.0 6.5 52 45 A 3 GLN H A 3 GLN HGx 1.0 3.0 6.5 53 46 A 3 GLN H A 3 GLN HB2 1.0 2.3 4.1 54 47 A 3 GLN H A 4 SER HA 1.0 2.5 3.5 55 48 A 3 GLN HA A 4 SER H 1.0 2.5 3.5 56 49 A 4 SER H A 3 GLN HGy 1.0 3.0 7.0 57 49 A 3 GLN HGx A 4 SER H 1.0 3.0 7.0 58 50 A 4 SER H A 3 GLN HB3 1.0 3.0 6.5 59 51 A 3 GLN HA A 7 ASP H 1.0 3.0 4.2 60 52 A 4 SER H A 4 SER HBy 1.0 2.8 5.0 61 53 A 4 SER H A 4 SER HBx 1.0 2.5 3.5 62 54 A 4 SER HA A 6 GLY H 1.0 2.5 3.5 63 55 A 6 GLY H A 4 SER HBy 1.0 2.8 5.0 64 56 A 4 SER HA A 7 ASP H 1.0 2.5 3.7 65 57 A 4 SER H A 7 ASP HBy 1.0 3.0 6.5 66 57 A 4 SER H A 7 ASP HBx 1.0 3.0 6.5 67 58 A 4 SER HA A 8 SER H 1.0 3.0 4.2 68 59 A 6 GLY H A 5 PRO HA 1.0 2.5 3.5 69 60 A 6 GLY H A 5 PRO HB3 1.0 3.0 6.5 70 61 A 6 GLY H A 5 PRO HB2 1.0 2.3 4.1 71 62 A 7 ASP H A 5 PRO HD2 1.0 3.0 6.5 72 63 A 8 SER H A 5 PRO HD2 1.0 3.0 6.5 73 64 A 5 PRO HA A 9 ARG H 1.0 2.8 5.0 74 65 A 7 ASP H A 6 GLY H 1.0 2.8 5.0 75 66 A 7 ASP H A 6 GLY HAx 1.0 2.5 3.5 76 66 A 7 ASP H A 6 GLY HAy 1.0 2.5 3.5 77 67 A 6 GLY H A 7 ASP HA 1.0 3.0 6.5 78 68 A 6 GLY H A 8 SER H 1.0 3.0 6.5 79 69 A 6 GLY H A 9 ARG H 1.0 3.0 6.5 80 70 A 7 ASP H A 7 ASP HBy 1.0 2.5 3.5 81 70 A 7 ASP H A 7 ASP HBx 1.0 2.5 3.5 82 71 A 7 ASP H A 8 SER H 1.0 2.5 3.5 83 72 A 8 SER H A 7 ASP HA 1.0 2.5 3.5 84 73 A 8 SER H A 7 ASP HBy 1.0 2.5 3.5 85 73 A 7 ASP HBx A 8 SER H 1.0 2.5 3.5 86 74 A 9 ARG H A 7 ASP HA 1.0 3.0 4.2 87 75 A 9 ARG H A 7 ASP HBy 1.0 3.0 6.5 88 75 A 7 ASP HBx A 9 ARG H 1.0 3.0 6.5 89 76 A 7 ASP H A 10 ARG H 1.0 3.0 4.7 90 77 A 7 ASP HA A 10 ARG H 1.0 2.5 3.5 91 78 A 10 ARG H A 7 ASP HBy 1.0 3.0 7.0 92 78 A 7 ASP HBx A 10 ARG H 1.0 3.0 7.0 93 79 A 8 SER H A 8 SER HBx 1.0 2.5 3.5 94 79 A 8 SER H A 8 SER HBy 1.0 2.5 3.5 95 80 A 8 SER H A 9 ARG H 1.0 2.5 3.5 96 81 A 8 SER H A 9 ARG HBx 1.0 3.0 6.5 97 82 A 8 SER H A 11 LEU HD1% 1.0 3.0 7.0 98 83 A 8 SER H A 11 LEU HG 1.0 3.0 6.5 99 84 A 9 ARG H A 9 ARG HG2 1.0 2.5 4.0 100 84 A 9 ARG H A 9 ARG HG3 1.0 2.5 4.0 101 85 A 9 ARG H A 9 ARG HD2 1.0 2.8 5.5 102 85 A 9 ARG H A 9 ARG HD3 1.0 2.8 5.5 103 86 A 9 ARG H A 10 ARG H 1.0 2.5 3.5 104 87 A 9 ARG H A 12 SER H 1.0 3.0 6.5 105 88 A 10 ARG H A 10 ARG HB3 1.0 2.5 4.0 106 88 A 10 ARG H A 10 ARG HB2 1.0 2.5 4.0 107 89 A 10 ARG H A 10 ARG HG2 1.0 2.5 4.0 108 89 A 10 ARG H A 10 ARG HG3 1.0 2.5 4.0 109 90 A 10 ARG H A 10 ARG HD2 1.0 2.8 5.5 110 90 A 10 ARG H A 10 ARG HD3 1.0 2.8 5.5 111 91 A 10 ARG H A 11 LEU H 1.0 2.5 3.5 112 92 A 11 LEU H A 10 ARG HA 1.0 2.5 3.5 113 93 A 11 LEU H A 10 ARG HD2 1.0 3.0 7.0 114 93 A 10 ARG HD3 A 11 LEU H 1.0 3.0 7.0 115 94 A 12 SER H A 10 ARG HD2 1.0 2.3 6.5 116 94 A 12 SER H A 10 ARG HD3 1.0 2.3 6.5 117 95 A 13 ILE H A 10 ARG HD2 1.0 3.0 7.0 118 95 A 10 ARG HD3 A 13 ILE H 1.0 3.0 7.0 119 96 A 10 ARG H A 13 ILE HD1% 1.0 3.0 7.0 120 97 A 14 GLN H A 10 ARG HB3 1.0 2.3 4.6 121 97 A 10 ARG HB2 A 14 GLN H 1.0 2.3 4.6 122 98 A 11 LEU H A 11 LEU HB3 1.0 2.5 3.5 123 99 A 11 LEU H A 11 LEU HB2 1.0 2.5 3.5 124 100 A 11 LEU HG A 11 LEU H 1.0 2.5 3.5 125 101 A 11 LEU HD1% A 11 LEU H 1.0 2.5 4.0 126 102 A 11 LEU HD1% A 12 SER H 1.0 2.3 4.6 127 103 A 12 SER H A 11 LEU HB2 1.0 2.5 3.5 128 104 A 11 LEU H A 13 ILE HD1% 1.0 3.0 7.0 129 105 A 11 LEU H A 14 GLN HBy 1.0 3.0 6.5 130 105 A 11 LEU H A 14 GLN HBx 1.0 3.0 6.5 131 106 A 14 GLN H A 11 LEU HA 1.0 2.5 3.5 132 107 A 11 LEU HG A 14 GLN HE2y 1.0 3.0 6.5 133 108 A 11 LEU HD1% A 14 GLN HE2y 1.0 3.0 7.0 134 109 A 11 LEU HD1% A 14 GLN HE2x 1.0 3.0 7.0 135 110 A 11 LEU HG A 14 GLN HE2x 1.0 3.0 6.5 136 111 A 12 SER H A 12 SER HB3 1.0 2.5 3.5 137 112 A 12 SER H A 12 SER HB2 1.0 2.5 3.5 138 113 A 13 ILE H A 12 SER HA 1.0 2.3 4.1 139 114 A 13 ILE H A 12 SER HB3 1.0 2.3 4.1 140 115 A 13 ILE H A 12 SER HB2 1.0 2.3 4.1 141 116 A 12 SER HA A 16 ALA H 1.0 3.0 6.5 142 117 A 13 ILE H A 13 ILE HB 1.0 2.5 3.5 143 118 A 13 ILE H A 13 ILE HG13 1.0 2.5 3.5 144 119 A 13 ILE H A 13 ILE HG12 1.0 2.3 4.1 145 120 A 13 ILE H A 13 ILE HD1% 1.0 2.3 4.6 146 121 A 13 ILE H A 14 GLN HBy 1.0 3.0 6.5 147 121 A 13 ILE H A 14 GLN HBx 1.0 3.0 6.5 148 122 A 14 GLN H A 13 ILE HG12 1.0 2.3 4.1 149 123 A 14 GLN H A 13 ILE HA 1.0 2.3 4.1 150 124 A 14 GLN H A 13 ILE HG13 1.0 2.8 5.0 151 125 A 14 GLN H A 13 ILE HB 1.0 2.5 3.5 152 126 A 13 ILE HD1% A 14 GLN H 1.0 2.5 4.0 153 127 A 13 ILE HA A 15 ARG H 1.0 2.8 5.0 154 128 A 13 ILE HD1% A 16 ALA H 1.0 3.0 7.0 155 129 A 16 ALA H A 13 ILE HG12 1.0 2.8 5.5 156 130 A 16 ALA H A 13 ILE HB 1.0 2.8 5.0 157 131 A 16 ALA H A 13 ILE HA 1.0 2.3 4.1 158 132 A 14 GLN H A 14 GLN HBy 1.0 2.5 3.5 159 132 A 14 GLN H A 14 GLN HBx 1.0 2.5 3.5 160 133 A 14 GLN H A 14 GLN HGy 1.0 2.5 4.0 161 133 A 14 GLN H A 14 GLN HGx 1.0 2.5 4.0 162 134 A 14 GLN HE2y A 14 GLN HGy 1.0 2.3 4.8 163 134 A 14 GLN HE2y A 14 GLN HGx 1.0 2.3 4.8 164 135 A 14 GLN HE2y A 14 GLN HBy 1.0 3.0 7.0 165 135 A 14 GLN HBx A 14 GLN HE2y 1.0 3.0 7.0 166 136 A 14 GLN HE2x A 14 GLN HBy 1.0 3.0 7.0 167 136 A 14 GLN HBx A 14 GLN HE2x 1.0 3.0 7.0 168 137 A 14 GLN HE2x A 14 GLN HGy 1.0 2.5 4.0 169 137 A 14 GLN HE2x A 14 GLN HGx 1.0 2.5 4.0 170 138 A 14 GLN HE2x A 14 GLN HA 1.0 3.0 6.5 171 139 A 15 ARG H A 14 GLN HGy 1.0 2.3 4.6 172 139 A 15 ARG H A 14 GLN HGx 1.0 2.3 4.6 173 140 A 16 ALA H A 14 GLN HGy 1.0 3.0 6.5 174 141 A 16 ALA H A 14 GLN HGx 1.0 3.0 6.5 175 142 A 17 ILE H A 14 GLN HA 1.0 2.5 3.5 176 143 A 15 ARG H A 15 ARG HG2 1.0 2.5 4.0 177 143 A 15 ARG H A 15 ARG HG3 1.0 2.5 4.0 178 144 A 15 ARG H A 15 ARG HD2 1.0 2.8 5.5 179 144 A 15 ARG H A 15 ARG HD3 1.0 2.8 5.5 180 145 A 15 ARG H A 15 ARG HBy 1.0 2.5 3.5 181 146 A 15 ARG H A 15 ARG HBx 1.0 2.5 3.5 182 147 A 16 ALA H A 15 ARG HA 1.0 2.5 3.5 183 148 A 16 ALA H A 15 ARG HBy 1.0 2.8 5.0 184 149 A 16 ALA H A 15 ARG HBx 1.0 2.5 3.5 185 150 A 16 ALA H A 15 ARG HG2 1.0 2.8 5.5 186 150 A 16 ALA H A 15 ARG HG3 1.0 2.8 5.5 187 151 A 16 ALA H A 15 ARG H 1.0 2.5 3.5 188 152 A 16 ALA H A 15 ARG HD2 1.0 3.0 7.0 189 152 A 16 ALA H A 15 ARG HD3 1.0 3.0 7.0 190 153 A 16 ALA HB% A 15 ARG H 1.0 2.8 5.5 191 154 A 17 ILE H A 15 ARG H 1.0 2.3 4.1 192 155 A 18 GLN HE2y A 15 ARG HD2 1.0 3.0 7.0 193 155 A 15 ARG HD3 A 18 GLN HE2y 1.0 3.0 7.0 194 156 A 18 GLN HE2y A 15 ARG HG2 1.0 2.8 5.5 195 156 A 15 ARG HG3 A 18 GLN HE2y 1.0 2.8 5.5 196 157 A 18 GLN HE2x A 15 ARG HG2 1.0 3.0 7.0 197 157 A 15 ARG HG3 A 18 GLN HE2x 1.0 3.0 7.0 198 158 A 16 ALA HB% A 16 ALA H 1.0 2.5 4.0 199 159 A 17 ILE H A 16 ALA H 1.0 2.3 4.1 200 160 A 17 ILE H A 16 ALA HA 1.0 3.0 6.5 201 161 A 16 ALA HB% A 17 ILE H 1.0 2.3 4.6 202 162 A 16 ALA H A 19 SER H 1.0 2.3 4.1 203 163 A 16 ALA HB% A 19 SER H 1.0 3.0 7.0 204 164 A 17 ILE H A 17 ILE HG13 1.0 2.5 3.5 205 165 A 17 ILE H A 17 ILE HG12 1.0 2.5 3.5 206 166 A 17 ILE H A 17 ILE HD1% 1.0 3.0 7.0 207 167 A 17 ILE H A 17 ILE HB 1.0 2.5 3.5 208 168 A 17 ILE H A 17 ILE HG2% 1.0 2.5 4.0 209 169 A 17 ILE HD1% A 18 GLN H 1.0 3.0 7.0 210 170 A 17 ILE HG2% A 18 GLN H 1.0 2.5 4.0 211 171 A 17 ILE H A 18 GLN H 1.0 2.5 3.5 212 172 A 17 ILE H A 19 SER H 1.0 2.8 5.0 213 173 A 19 SER H A 17 ILE HA 1.0 3.0 6.5 214 174 A 17 ILE HA A 20 LEU H 1.0 2.3 4.1 215 175 A 17 ILE HG12 A 20 LEU H 1.0 3.0 6.5 216 176 A 18 GLN H A 18 GLN HB3 1.0 2.5 3.5 217 177 A 18 GLN H A 18 GLN HG3 1.0 2.3 4.6 218 177 A 18 GLN H A 18 GLN HG2 1.0 2.3 4.6 219 178 A 18 GLN H A 18 GLN HB2 1.0 2.5 3.5 220 179 A 18 GLN HE2y A 18 GLN HB2 1.0 3.0 6.5 221 180 A 18 GLN HE2y A 18 GLN HB3 1.0 3.0 6.5 222 181 A 18 GLN HE2y A 18 GLN HG3 1.0 2.5 4.0 223 181 A 18 GLN HE2y A 18 GLN HG2 1.0 2.5 4.0 224 182 A 18 GLN HE2y A 18 GLN HA 1.0 3.0 6.5 225 183 A 18 GLN HE2x A 18 GLN HB2 1.0 3.0 6.5 226 184 A 18 GLN HE2x A 18 GLN HB3 1.0 3.0 6.5 227 185 A 18 GLN HE2x A 18 GLN HG3 1.0 2.5 4.0 228 185 A 18 GLN HE2x A 18 GLN HG2 1.0 2.5 4.0 229 186 A 18 GLN HE2x A 18 GLN HA 1.0 3.0 6.5 230 187 A 19 SER H A 18 GLN HG3 1.0 2.8 5.5 231 187 A 19 SER H A 18 GLN HG2 1.0 2.8 5.5 232 188 A 19 SER H A 18 GLN HB3 1.0 2.5 3.5 233 189 A 19 SER H A 18 GLN HB2 1.0 2.8 5.0 234 190 A 20 LEU H A 18 GLN HB3 1.0 3.0 6.5 235 191 A 20 LEU H A 18 GLN HG3 1.0 3.0 6.5 236 191 A 20 LEU H A 18 GLN HG2 1.0 3.0 6.5 237 192 A 18 GLN HB2 A 22 HIS H 1.0 3.0 6.5 238 193 A 19 SER H A 19 SER HB2 1.0 2.5 4.0 239 193 A 19 SER HB3 A 19 SER H 1.0 2.5 4.0 240 194 A 20 LEU H A 19 SER HA 1.0 2.8 5.0 241 195 A 19 SER H A 20 LEU H 1.0 2.5 3.5 242 196 A 20 LEU H A 19 SER HB2 1.0 2.5 4.0 243 196 A 19 SER HB3 A 20 LEU H 1.0 2.5 4.0 244 197 A 19 SER HA A 21 VAL H 1.0 3.0 6.5 245 198 A 19 SER H A 21 VAL H 1.0 2.8 5.0 246 199 A 22 HIS H A 19 SER HA 1.0 2.5 3.5 247 200 A 19 SER HA A 23 ALA H 1.0 3.0 6.5 248 201 A 20 LEU H A 20 LEU HB3 1.0 2.5 3.5 249 202 A 20 LEU H A 20 LEU HB2 1.0 2.5 3.5 250 203 A 20 LEU HD2% A 20 LEU H 1.0 2.3 4.6 251 204 A 20 LEU HD1% A 20 LEU H 1.0 2.5 4.0 252 205 A 20 LEU H A 20 LEU HG 1.0 3.0 4.5 253 206 A 20 LEU H A 21 VAL H 1.0 2.5 3.5 254 207 A 21 VAL H A 20 LEU HB2 1.0 2.8 5.0 255 208 A 21 VAL H A 20 LEU HA 1.0 2.5 3.5 256 209 A 20 LEU H A 22 HIS H 1.0 2.8 5.0 257 210 A 20 LEU H A 22 HIS HBy 1.0 3.0 6.5 258 211 A 22 HIS H A 20 LEU HA 1.0 2.8 5.0 259 212 A 21 VAL H A 21 VAL HG1% 1.0 2.5 4.0 260 213 A 21 VAL H A 21 VAL HB 1.0 2.5 3.5 261 214 A 22 HIS H A 21 VAL H 1.0 2.5 3.5 262 215 A 22 HIS H A 21 VAL HG1% 1.0 2.5 4.0 263 216 A 22 HIS H A 21 VAL HB 1.0 2.5 3.5 264 217 A 23 ALA H A 21 VAL HB 1.0 3.0 6.5 265 218 A 23 ALA H A 21 VAL HG1% 1.0 3.0 7.0 266 219 A 21 VAL H A 24 ALA H 1.0 2.8 5.0 267 220 A 24 ALA H A 21 VAL HA 1.0 2.3 4.1 268 221 A 21 VAL HA A 25 GLN H 1.0 2.8 5.0 269 222 A 21 VAL HG1% A 25 GLN H 1.0 2.8 5.5 270 223 A 21 VAL HG1% A 25 GLN HE2y 1.0 2.5 4.0 271 224 A 21 VAL HG1% A 25 GLN HE2x 1.0 2.5 4.0 272 225 A 21 VAL HA A 25 GLN HE2x 1.0 3.0 6.5 273 226 A 22 HIS H A 22 HIS HD2 1.0 3.0 6.5 274 227 A 22 HIS H A 22 HIS HBy 1.0 2.5 3.5 275 228 A 22 HIS H A 22 HIS HBx 1.0 2.5 3.5 276 229 A 22 HIS H A 23 ALA H 1.0 2.5 3.5 277 230 A 23 ALA H A 22 HIS HBy 1.0 2.3 4.1 278 231 A 23 ALA H A 22 HIS HBx 1.0 2.3 4.1 279 232 A 22 HIS H A 23 ALA HB% 1.0 2.8 5.5 280 233 A 22 HIS H A 24 ALA H 1.0 3.0 6.5 281 234 A 22 HIS H A 25 GLN H 1.0 3.0 6.5 282 235 A 25 GLN H A 22 HIS HA 1.0 2.8 5.0 283 236 A 25 GLN HE2y A 22 HIS HA 1.0 3.0 6.5 284 237 A 25 GLN HE2x A 22 HIS HA 1.0 3.0 6.5 285 238 A 22 HIS HA A 26 CYS H 1.0 2.5 3.5 286 239 A 23 ALA H A 23 ALA HB% 1.0 2.0 3.5 287 240 A 23 ALA H A 24 ALA H 1.0 2.5 3.5 288 241 A 23 ALA H A 24 ALA HB% 1.0 3.0 7.0 289 242 A 24 ALA H A 23 ALA HB% 1.0 2.5 4.0 290 243 A 23 ALA H A 25 GLN H 1.0 3.0 6.5 291 244 A 25 GLN H A 23 ALA HB% 1.0 2.8 5.5 292 245 A 23 ALA HB% A 26 CYS H 1.0 2.8 5.5 293 246 A 23 ALA H A 26 CYS H 1.0 2.8 5.0 294 247 A 26 CYS H A 23 ALA HA 1.0 2.5 3.5 295 248 A 23 ALA H A 26 CYS HB3 1.0 3.0 6.5 296 249 A 23 ALA HA A 27 ARG H 1.0 3.0 6.5 297 250 A 39 MET HB3 A 23 ALA H 1.0 3.0 6.5 298 251 A 23 ALA H A 39 MET HB2 1.0 3.0 6.5 299 252 A 23 ALA HB% A 39 MET H 1.0 2.5 4.0 300 253 A 24 ALA H A 24 ALA HB% 1.0 2.5 4.0 301 254 A 24 ALA H A 25 GLN HA 1.0 3.0 6.5 302 255 A 24 ALA H A 25 GLN H 1.0 2.5 3.5 303 256 A 24 ALA H A 25 GLN HG3 1.0 3.0 6.5 304 257 A 24 ALA H A 25 GLN HG2 1.0 3.0 6.5 305 258 A 24 ALA H A 25 GLN HB2 1.0 2.8 5.0 306 259 A 25 GLN H A 24 ALA HB% 1.0 2.5 4.0 307 260 A 24 ALA HA A 25 GLN H 1.0 2.5 3.5 308 261 A 24 ALA H A 26 CYS H 1.0 2.8 5.0 309 262 A 26 CYS H A 24 ALA HB% 1.0 2.8 5.5 310 263 A 24 ALA H A 81 VAL HG2% 1.0 2.5 4.0 311 264 A 24 ALA H A 82 PRO HD3 1.0 3.0 6.5 312 265 A 25 GLN H A 25 GLN HG2 1.0 3.0 4.2 313 266 A 25 GLN H A 25 GLN HG3 1.0 3.0 4.2 314 267 A 25 GLN H A 25 GLN HE2x 1.0 2.8 5.0 315 268 A 25 GLN H A 25 GLN HB3 1.0 2.5 3.5 316 269 A 25 GLN H A 25 GLN HB2 1.0 2.5 3.5 317 270 A 25 GLN HE2y A 25 GLN HG3 1.0 2.3 4.3 318 271 A 25 GLN HE2y A 25 GLN HG2 1.0 2.8 5.0 319 272 A 25 GLN HE2y A 25 GLN HB3 1.0 2.8 5.5 320 272 A 25 GLN HE2y A 25 GLN HB2 1.0 2.8 5.5 321 273 A 25 GLN HE2y A 25 GLN HA 1.0 3.0 6.5 322 274 A 25 GLN HE2x A 25 GLN HB3 1.0 2.8 5.5 323 274 A 25 GLN HE2x A 25 GLN HB2 1.0 2.8 5.5 324 275 A 25 GLN HE2x A 25 GLN HG2 1.0 2.3 4.3 325 276 A 25 GLN HE2x A 25 GLN HG3 1.0 2.5 3.5 326 277 A 25 GLN HE2x A 25 GLN HA 1.0 3.0 6.5 327 278 A 26 CYS H A 25 GLN HG2 1.0 2.3 4.1 328 279 A 25 GLN H A 26 CYS H 1.0 2.5 3.5 329 280 A 26 CYS H A 25 GLN HA 1.0 2.5 3.5 330 281 A 25 GLN H A 26 CYS HA 1.0 3.0 6.5 331 282 A 25 GLN HE2y A 26 CYS HA 1.0 3.0 6.5 332 283 A 25 GLN HE2x A 26 CYS HA 1.0 3.0 6.5 333 284 A 27 ARG H A 25 GLN HA 1.0 3.0 6.5 334 285 A 25 GLN H A 27 ARG H 1.0 3.0 6.5 335 286 A 26 CYS H A 26 CYS HB3 1.0 2.5 3.5 336 287 A 26 CYS H A 26 CYS HB2 1.0 2.5 3.5 337 288 A 26 CYS HB3 A 27 ARG H 1.0 3.0 6.5 338 289 A 27 ARG H A 26 CYS HA 1.0 2.5 3.5 339 290 A 26 CYS H A 27 ARG H 1.0 3.0 6.5 340 291 A 26 CYS H A 27 ARG HA 1.0 3.0 6.5 341 292 A 26 CYS H A 28 ASN H 1.0 3.0 6.5 342 293 A 26 CYS HA A 28 ASN H 1.0 3.0 4.7 343 294 A 26 CYS HB3 A 28 ASN H 1.0 3.0 6.5 344 295 A 26 CYS H A 40 LYS HE3 1.0 2.8 5.0 345 295 A 26 CYS H A 40 LYS HE2 1.0 2.8 5.0 346 296 A 27 ARG H A 27 ARG HB3 1.0 2.3 4.1 347 297 A 27 ARG H A 27 ARG HD2 1.0 3.0 7.0 348 297 A 27 ARG H A 27 ARG HD3 1.0 3.0 7.0 349 298 A 27 ARG H A 27 ARG HG3 1.0 2.5 4.0 350 298 A 27 ARG H A 27 ARG HG2 1.0 2.5 4.0 351 299 A 27 ARG H A 27 ARG HB2 1.0 2.3 4.1 352 300 A 27 ARG H A 28 ASN HA 1.0 2.8 5.0 353 301 A 27 ARG H A 28 ASN H 1.0 2.5 3.5 354 302 A 27 ARG H A 28 ASN HB2 1.0 3.0 6.5 355 303 A 27 ARG H A 28 ASN HB3 1.0 3.0 6.5 356 304 A 27 ARG HA A 28 ASN H 1.0 1.8 3.2 357 305 A 28 ASN H A 27 ARG HB3 1.0 2.8 5.0 358 306 A 28 ASN H A 27 ARG HB2 1.0 2.8 5.0 359 307 A 28 ASN H A 27 ARG HG3 1.0 2.8 5.5 360 307 A 28 ASN H A 27 ARG HG2 1.0 2.8 5.5 361 308 A 27 ARG H A 28 ASN HD2y 1.0 3.0 6.5 362 309 A 27 ARG H A 28 ASN HD2x 1.0 3.0 6.5 363 310 A 27 ARG HA A 29 ALA H 1.0 2.8 5.5 364 311 A 27 ARG HA A 30 ASN H 1.0 3.0 6.5 365 312 A 28 ASN H A 28 ASN HB2 1.0 2.5 3.5 366 313 A 28 ASN H A 28 ASN HB3 1.0 2.5 3.5 367 314 A 28 ASN HB2 A 28 ASN HD2y 1.0 2.5 3.5 368 315 A 28 ASN HB3 A 28 ASN HD2y 1.0 2.5 3.5 369 316 A 28 ASN HA A 28 ASN HD2y 1.0 2.8 5.0 370 317 A 28 ASN HA A 28 ASN HD2x 1.0 2.8 5.0 371 318 A 28 ASN HB3 A 28 ASN HD2x 1.0 2.5 3.5 372 319 A 28 ASN HB2 A 28 ASN HD2x 1.0 2.5 3.5 373 320 A 28 ASN H A 29 ALA H 1.0 3.0 6.5 374 321 A 28 ASN HB2 A 29 ALA H 1.0 3.0 6.5 375 322 A 28 ASN HB3 A 29 ALA H 1.0 3.0 6.5 376 323 A 28 ASN HA A 29 ALA H 1.0 2.5 3.5 377 324 A 28 ASN H A 29 ALA HA 1.0 3.0 6.5 378 325 A 28 ASN H A 30 ASN H 1.0 2.8 5.0 379 326 A 28 ASN HD2y A 30 ASN HB2 1.0 3.0 6.5 380 327 A 28 ASN HD2y A 30 ASN H 1.0 3.0 6.5 381 328 A 28 ASN HD2x A 30 ASN H 1.0 3.0 6.5 382 329 A 28 ASN HD2x A 30 ASN HB2 1.0 3.0 6.5 383 330 A 28 ASN HA A 31 CYS H 1.0 3.0 4.7 384 331 A 28 ASN H A 31 CYS H 1.0 3.0 6.5 385 332 A 28 ASN HD2y A 31 CYS HA 1.0 2.3 4.3 386 333 A 28 ASN HD2x A 31 CYS HA 1.0 2.8 5.0 387 334 A 28 ASN H A 40 LYS HE3 1.0 3.0 6.5 388 334 A 28 ASN H A 40 LYS HE2 1.0 3.0 6.5 389 335 A 29 ALA H A 29 ALA HB% 1.0 2.5 4.0 390 336 A 29 ALA H A 30 ASN HB2 1.0 3.0 6.5 391 337 A 29 ALA H A 30 ASN H 1.0 2.5 3.5 392 338 A 30 ASN H A 29 ALA HB% 1.0 2.5 4.0 393 339 A 30 ASN H A 29 ALA HA 1.0 2.5 3.5 394 340 A 29 ALA HB% A 30 ASN HD2x 1.0 3.0 7.0 395 341 A 29 ALA HB% A 30 ASN HD2y 1.0 3.0 7.0 396 342 A 29 ALA H A 31 CYS H 1.0 3.0 6.5 397 343 A 31 CYS H A 29 ALA HB% 1.0 2.8 5.5 398 344 A 30 ASN H A 30 ASN HB2 1.0 2.5 3.5 399 345 A 30 ASN H A 30 ASN HB3 1.0 2.5 3.5 400 346 A 30 ASN H A 30 ASN HD2y 1.0 2.8 5.0 401 347 A 30 ASN HD2x A 30 ASN HA 1.0 2.3 4.3 402 348 A 30 ASN HD2x A 30 ASN HB3 1.0 2.8 5.0 403 349 A 30 ASN HB2 A 30 ASN HD2x 1.0 2.5 3.5 404 350 A 30 ASN HB2 A 30 ASN HD2y 1.0 2.5 3.5 405 351 A 30 ASN HD2y A 30 ASN HB3 1.0 3.0 6.5 406 352 A 30 ASN H A 30 ASN HD2x 1.0 3.0 6.5 407 353 A 30 ASN H A 31 CYS H 1.0 2.5 3.5 408 354 A 30 ASN HA A 32 SER H 1.0 2.8 6.0 409 355 A 31 CYS H A 31 CYS HB3 1.0 2.5 3.5 410 356 A 31 CYS H A 31 CYS HB2 1.0 2.5 3.5 411 357 A 31 CYS H A 32 SER H 1.0 2.8 5.0 412 358 A 32 SER H A 31 CYS HB3 1.0 2.3 4.1 413 359 A 32 SER H A 31 CYS HB2 1.0 2.3 4.1 414 360 A 31 CYS H A 32 SER HA 1.0 3.0 5.2 415 361 A 31 CYS HB3 A 33 LEU H 1.0 2.8 5.0 416 362 A 31 CYS HB3 A 36 CYS H 1.0 2.3 4.7 417 363 A 31 CYS HB3 A 37 GLN H 1.0 2.8 5.0 418 364 A 32 SER H A 32 SER HB3 1.0 2.5 3.5 419 365 A 32 SER H A 32 SER HB2 1.0 2.3 4.1 420 366 A 32 SER H A 33 LEU H 1.0 2.3 4.1 421 367 A 33 LEU H A 32 SER HB3 1.0 2.8 5.0 422 368 A 33 LEU H A 32 SER HB2 1.0 2.8 5.0 423 369 A 32 SER HA A 33 LEU H 1.0 2.8 5.0 424 370 A 32 SER H A 33 LEU HB2 1.0 3.0 6.5 425 371 A 32 SER H A 33 LEU HG 1.0 2.3 6.5 426 372 A 33 LEU HD1% A 32 SER H 1.0 3.0 7.0 427 373 A 32 SER H A 33 LEU HA 1.0 2.8 5.5 428 374 A 32 SER HA A 36 CYS H 1.0 2.8 6.0 429 375 A 32 SER H A 36 CYS HB3 1.0 3.0 6.5 430 376 A 32 SER H A 37 GLN HG3 1.0 3.0 6.5 431 377 A 33 LEU H A 33 LEU HB2 1.0 2.5 3.5 432 378 A 33 LEU H A 33 LEU HB3 1.0 2.5 3.5 433 379 A 33 LEU H A 33 LEU HG 1.0 2.5 3.7 434 380 A 33 LEU H A 33 LEU HD2% 1.0 2.8 5.5 435 381 A 33 LEU HD1% A 33 LEU H 1.0 2.8 5.5 436 382 A 33 LEU H A 34 PRO HGx 1.0 3.0 6.5 437 383 A 33 LEU H A 34 PRO HD2 1.0 2.8 5.0 438 384 A 33 LEU HB2 A 35 SER H 1.0 3.0 6.5 439 385 A 33 LEU HA A 35 SER H 1.0 3.0 6.5 440 386 A 33 LEU H A 35 SER H 1.0 3.0 6.5 441 387 A 33 LEU HD2% A 35 SER H 1.0 3.0 7.0 442 388 A 33 LEU HB3 A 35 SER H 1.0 3.0 6.5 443 389 A 33 LEU H A 36 CYS H 1.0 3.0 6.5 444 390 A 33 LEU H A 36 CYS HB2 1.0 2.8 5.0 445 391 A 33 LEU H A 36 CYS HB3 1.0 2.8 5.0 446 392 A 33 LEU H A 36 CYS HA 1.0 3.3 6.5 447 393 A 36 CYS H A 33 LEU HB2 1.0 2.3 4.1 448 394 A 36 CYS H A 33 LEU HA 1.0 3.0 6.5 449 395 A 36 CYS H A 33 LEU HB3 1.0 2.2 3.5 450 396 A 36 CYS H A 33 LEU HD2% 1.0 2.8 5.5 451 397 A 33 LEU HD1% A 36 CYS H 1.0 2.8 5.5 452 398 A 33 LEU H A 37 GLN HG3 1.0 3.0 6.5 453 399 A 37 GLN H A 33 LEU HB3 1.0 3.0 6.5 454 400 A 37 GLN H A 33 LEU HB2 1.0 3.0 6.5 455 401 A 33 LEU HD1% A 37 GLN H 1.0 3.0 7.0 456 402 A 35 SER H A 34 PRO HGx 1.0 3.0 7.0 457 402 A 35 SER H A 34 PRO HGy 1.0 3.0 7.0 458 403 A 35 SER H A 34 PRO HA 1.0 2.5 3.5 459 404 A 35 SER H A 34 PRO HB2 1.0 2.8 5.0 460 405 A 35 SER H A 34 PRO HB3 1.0 3.0 6.5 461 406 A 36 CYS H A 34 PRO HD2 1.0 3.0 7.0 462 406 A 36 CYS H A 34 PRO HD3 1.0 3.0 7.0 463 407 A 36 CYS H A 34 PRO HB2 1.0 3.0 6.5 464 408 A 37 GLN H A 34 PRO HD2 1.0 3.0 7.0 465 408 A 37 GLN H A 34 PRO HD3 1.0 3.0 7.0 466 409 A 37 GLN H A 34 PRO HA 1.0 2.5 3.5 467 410 A 34 PRO HB3 A 38 LYS H 1.0 3.0 6.5 468 411 A 35 SER H A 35 SER HB2 1.0 2.8 5.5 469 411 A 35 SER H A 35 SER HB3 1.0 2.8 5.5 470 412 A 36 CYS H A 35 SER H 1.0 2.8 5.0 471 413 A 36 CYS H A 35 SER HB2 1.0 2.8 5.5 472 413 A 36 CYS H A 35 SER HB3 1.0 2.8 5.5 473 414 A 36 CYS H A 36 CYS HB2 1.0 2.5 3.5 474 415 A 36 CYS H A 36 CYS HB3 1.0 2.5 3.5 475 416 A 36 CYS H A 37 GLN HBx 1.0 2.8 5.0 476 416 A 36 CYS H A 37 GLN HBy 1.0 2.8 5.0 477 417 A 36 CYS H A 37 GLN H 1.0 2.5 3.5 478 418 A 36 CYS H A 37 GLN HG3 1.0 3.0 6.5 479 419 A 37 GLN H A 36 CYS HB3 1.0 2.5 3.5 480 420 A 37 GLN H A 36 CYS HB2 1.0 2.5 3.5 481 421 A 37 GLN H A 36 CYS HA 1.0 2.3 4.1 482 422 A 36 CYS H A 38 LYS H 1.0 2.8 5.0 483 423 A 36 CYS HB3 A 38 LYS H 1.0 3.0 6.5 484 424 A 36 CYS HB2 A 38 LYS H 1.0 3.0 6.5 485 425 A 39 MET H A 36 CYS HA 1.0 2.8 5.0 486 426 A 39 MET H A 36 CYS HB3 1.0 3.0 6.5 487 427 A 36 CYS HA A 40 LYS H 1.0 3.0 6.5 488 428 A 37 GLN H A 37 GLN HBx 1.0 2.5 3.5 489 428 A 37 GLN H A 37 GLN HBy 1.0 2.5 3.5 490 429 A 37 GLN H A 37 GLN HG3 1.0 2.5 3.5 491 430 A 37 GLN HE2x A 37 GLN HG3 1.0 2.3 4.8 492 430 A 37 GLN HG2 A 37 GLN HE2x 1.0 2.3 4.8 493 431 A 37 GLN HE2x A 37 GLN HBx 1.0 3.0 7.0 494 431 A 37 GLN HBy A 37 GLN HE2x 1.0 3.0 7.0 495 432 A 38 LYS H A 37 GLN HBx 1.0 2.5 3.5 496 432 A 38 LYS H A 37 GLN HBy 1.0 2.5 3.5 497 433 A 37 GLN H A 38 LYS H 1.0 2.5 3.5 498 434 A 38 LYS H A 37 GLN HG3 1.0 2.8 5.0 499 435 A 38 LYS H A 37 GLN HG2 1.0 3.0 6.5 500 436 A 39 MET H A 37 GLN H 1.0 2.8 5.0 501 437 A 40 LYS H A 37 GLN HA 1.0 3.0 6.5 502 438 A 37 GLN H A 40 LYS H 1.0 3.0 6.5 503 439 A 38 LYS H A 38 LYS HDx 1.0 3.0 4.7 504 439 A 38 LYS HDy A 38 LYS H 1.0 3.0 4.7 505 440 A 38 LYS H A 38 LYS HG3 1.0 2.3 4.1 506 440 A 38 LYS H A 38 LYS HG2 1.0 2.3 4.1 507 441 A 38 LYS H A 38 LYS HB3 1.0 2.0 3.0 508 442 A 38 LYS H A 38 LYS HB2 1.0 2.5 3.5 509 443 A 39 MET H A 38 LYS H 1.0 2.5 3.5 510 444 A 39 MET H A 38 LYS HA 1.0 2.3 4.1 511 445 A 39 MET H A 38 LYS HB3 1.0 2.5 3.5 512 446 A 39 MET H A 38 LYS HB2 1.0 2.5 3.5 513 447 A 39 MET H A 38 LYS HDx 1.0 3.0 4.7 514 447 A 38 LYS HDy A 39 MET H 1.0 3.0 4.7 515 448 A 39 MET H A 38 LYS HG3 1.0 2.0 5.5 516 448 A 39 MET H A 38 LYS HG2 1.0 2.0 5.5 517 449 A 38 LYS H A 39 MET HA 1.0 3.0 6.5 518 450 A 38 LYS H A 40 LYS H 1.0 3.0 6.5 519 451 A 38 LYS H A 41 ARG H 1.0 3.0 6.5 520 452 A 38 LYS HA A 41 ARG H 1.0 2.3 4.1 521 453 A 42 VAL H A 38 LYS HA 1.0 3.0 6.5 522 454 A 42 VAL H A 38 LYS HG3 1.0 3.0 7.0 523 454 A 42 VAL H A 38 LYS HG2 1.0 3.0 7.0 524 455 A 42 VAL H A 38 LYS H 1.0 3.0 6.5 525 456 A 39 MET H A 39 MET HG3 1.0 3.0 4.0 526 457 A 39 MET H A 39 MET HG2 1.0 2.3 4.1 527 458 A 39 MET HB2 A 39 MET H 1.0 2.5 3.5 528 459 A 39 MET HB3 A 39 MET H 1.0 2.5 3.5 529 460 A 39 MET H A 40 LYS H 1.0 2.5 3.5 530 461 A 39 MET H A 40 LYS HA 1.0 3.0 6.5 531 462 A 39 MET H A 40 LYS HB3 1.0 2.3 4.7 532 463 A 39 MET HA A 41 ARG H 1.0 2.8 5.0 533 464 A 39 MET H A 41 ARG H 1.0 3.0 6.5 534 465 A 42 VAL H A 39 MET HA 1.0 2.3 4.1 535 466 A 42 VAL H A 39 MET HG2 1.0 3.0 6.5 536 467 A 39 MET H A 42 VAL HG2% 1.0 3.0 7.0 537 468 A 42 VAL HG1% A 39 MET H 1.0 3.0 7.0 538 469 A 39 MET HA A 43 VAL H 1.0 3.0 6.5 539 470 A 40 LYS H A 40 LYS HB2 1.0 2.0 6.0 540 471 A 40 LYS H A 40 LYS HB3 1.0 2.8 5.0 541 472 A 40 LYS H A 40 LYS HGx 1.0 3.0 6.5 542 472 A 40 LYS H A 40 LYS HGy 1.0 3.0 6.5 543 473 A 40 LYS H A 40 LYS HDx 1.0 3.0 6.5 544 473 A 40 LYS H A 40 LYS HDy 1.0 3.0 6.5 545 474 A 40 LYS H A 41 ARG H 1.0 2.5 3.5 546 475 A 41 ARG H A 40 LYS HA 1.0 2.3 4.1 547 476 A 41 ARG H A 40 LYS HGx 1.0 3.0 6.5 548 476 A 41 ARG H A 40 LYS HGy 1.0 3.0 6.5 549 477 A 42 VAL H A 40 LYS H 1.0 3.0 6.5 550 478 A 40 LYS HA A 43 VAL H 1.0 2.8 5.0 551 479 A 40 LYS HB2 A 44 GLN H 1.0 3.0 6.5 552 480 A 40 LYS HA A 44 GLN H 1.0 3.0 6.5 553 481 A 41 ARG H A 41 ARG HD2 1.0 2.8 5.5 554 481 A 41 ARG HD3 A 41 ARG H 1.0 2.8 5.5 555 482 A 41 ARG H A 41 ARG HB3 1.0 2.5 3.5 556 483 A 41 ARG H A 41 ARG HB2 1.0 2.0 3.0 557 484 A 41 ARG H A 41 ARG HG3 1.0 2.5 4.0 558 484 A 41 ARG H A 41 ARG HG2 1.0 2.5 4.0 559 485 A 42 VAL H A 41 ARG HA 1.0 2.8 5.0 560 486 A 42 VAL H A 41 ARG H 1.0 2.5 3.5 561 487 A 42 VAL H A 41 ARG HB3 1.0 2.5 3.5 562 488 A 42 VAL H A 41 ARG HB2 1.0 2.3 4.1 563 489 A 42 VAL H A 41 ARG HG3 1.0 3.0 7.0 564 489 A 42 VAL H A 41 ARG HG2 1.0 3.0 7.0 565 490 A 41 ARG H A 42 VAL HG2% 1.0 2.8 5.5 566 491 A 41 ARG H A 42 VAL HB 1.0 2.8 5.0 567 492 A 42 VAL HG1% A 41 ARG H 1.0 2.8 5.5 568 493 A 41 ARG H A 43 VAL H 1.0 2.8 5.0 569 494 A 44 GLN H A 41 ARG HG3 1.0 3.0 7.0 570 494 A 44 GLN H A 41 ARG HG2 1.0 3.0 7.0 571 495 A 44 GLN H A 41 ARG HA 1.0 3.0 6.5 572 496 A 41 ARG H A 45 HIS H 1.0 3.0 6.5 573 497 A 42 VAL H A 42 VAL HG2% 1.0 2.5 4.0 574 498 A 42 VAL HG1% A 42 VAL H 1.0 2.5 4.0 575 499 A 42 VAL H A 42 VAL HB 1.0 2.5 3.5 576 500 A 42 VAL H A 43 VAL HA 1.0 3.0 6.5 577 501 A 42 VAL H A 43 VAL H 1.0 2.5 3.5 578 502 A 43 VAL H A 42 VAL HB 1.0 2.3 4.1 579 503 A 42 VAL H A 45 HIS HBx 1.0 3.0 6.5 580 503 A 42 VAL H A 45 HIS HBy 1.0 3.0 6.5 581 504 A 42 VAL H A 45 HIS H 1.0 3.0 6.5 582 505 A 45 HIS H A 42 VAL HA 1.0 2.3 4.1 583 506 A 42 VAL HG1% A 45 HIS H 1.0 2.3 4.6 584 507 A 43 VAL H A 43 VAL HB 1.0 2.5 3.5 585 508 A 43 VAL HG1% A 43 VAL H 1.0 2.5 4.0 586 509 A 43 VAL HG1% A 44 GLN H 1.0 2.3 4.6 587 510 A 44 GLN H A 43 VAL HA 1.0 3.0 6.5 588 511 A 43 VAL H A 45 HIS H 1.0 2.8 5.0 589 512 A 43 VAL HG1% A 45 HIS H 1.0 2.8 5.5 590 513 A 43 VAL H A 46 THR H 1.0 3.0 6.5 591 514 A 43 VAL HG1% A 47 LYS H 1.0 3.0 7.0 592 515 A 44 GLN H A 44 GLN HBx 1.0 2.5 3.5 593 515 A 44 GLN H A 44 GLN HBy 1.0 2.5 3.5 594 516 A 44 GLN H A 44 GLN HGx 1.0 2.3 4.5 595 516 A 44 GLN H A 44 GLN HGy 1.0 2.3 4.5 596 517 A 44 GLN H A 45 HIS H 1.0 2.5 3.5 597 518 A 45 HIS H A 44 GLN HA 1.0 2.5 3.5 598 519 A 45 HIS H A 44 GLN HGx 1.0 2.8 5.5 599 519 A 45 HIS H A 44 GLN HGy 1.0 2.8 5.5 600 520 A 45 HIS H A 44 GLN HBx 1.0 2.5 4.0 601 520 A 45 HIS H A 44 GLN HBy 1.0 2.5 4.0 602 521 A 47 LYS H A 44 GLN HA 1.0 3.0 6.5 603 522 A 45 HIS H A 45 HIS HBx 1.0 2.0 3.0 604 522 A 45 HIS H A 45 HIS HBy 1.0 2.0 3.0 605 523 A 45 HIS H A 46 THR H 1.0 2.5 6.0 606 524 A 45 HIS H A 47 LYS H 1.0 3.0 6.5 607 525 A 45 HIS H A 48 GLY H 1.0 3.0 6.5 608 526 A 49 CYS H A 45 HIS HBx 1.0 3.0 6.5 609 526 A 45 HIS HBy A 49 CYS H 1.0 3.0 6.5 610 527 A 45 HIS H A 49 CYS H 1.0 2.8 6.0 611 528 A 49 CYS H A 45 HIS HA 1.0 2.8 5.0 612 529 A 46 THR H A 46 THR HB 1.0 2.5 6.0 613 530 A 46 THR H A 46 THR HG2% 1.0 3.0 7.0 614 531 A 46 THR H A 47 LYS H 1.0 3.0 6.5 615 532 A 47 LYS H A 46 THR HB 1.0 3.0 6.5 616 533 A 48 GLY H A 46 THR HA 1.0 3.0 6.5 617 534 A 47 LYS H A 47 LYS HGy 1.0 2.3 6.5 618 534 A 47 LYS H A 47 LYS HGx 1.0 2.3 6.5 619 535 A 47 LYS H A 47 LYS HD2 1.0 2.8 5.5 620 535 A 47 LYS H A 47 LYS HD3 1.0 2.8 5.5 621 536 A 47 LYS H A 47 LYS HBx 1.0 2.5 3.5 622 536 A 47 LYS H A 47 LYS HBy 1.0 2.5 3.5 623 537 A 47 LYS H A 48 GLY H 1.0 2.5 3.5 624 538 A 48 GLY H A 47 LYS HBx 1.0 2.5 3.5 625 538 A 48 GLY H A 47 LYS HBy 1.0 2.5 3.5 626 539 A 48 GLY H A 47 LYS HD2 1.0 2.8 5.5 627 539 A 48 GLY H A 47 LYS HD3 1.0 2.8 5.5 628 540 A 48 GLY H A 47 LYS HA 1.0 2.3 4.1 629 541 A 48 GLY H A 47 LYS HGy 1.0 3.0 6.5 630 541 A 48 GLY H A 47 LYS HGx 1.0 3.0 6.5 631 542 A 47 LYS H A 49 CYS H 1.0 3.0 6.5 632 543 A 49 CYS H A 47 LYS HBx 1.0 2.3 4.1 633 543 A 49 CYS H A 47 LYS HBy 1.0 2.3 4.1 634 544 A 49 CYS H A 47 LYS HA 1.0 2.5 3.5 635 545 A 49 CYS H A 48 GLY HA2 1.0 2.3 4.1 636 546 A 48 GLY H A 49 CYS H 1.0 2.5 3.5 637 547 A 49 CYS H A 48 GLY HA3 1.0 2.5 3.5 638 548 A 48 GLY H A 49 CYS HB2 1.0 3.0 6.5 639 549 A 48 GLY H A 49 CYS HB3 1.0 3.0 6.5 640 550 A 49 CYS H A 49 CYS HB2 1.0 2.5 3.5 641 551 A 49 CYS H A 49 CYS HB3 1.0 2.5 3.5 642 552 A 49 CYS H A 50 LYS H 1.0 3.0 6.5 643 553 A 50 LYS H A 49 CYS HB3 1.0 3.0 6.5 644 554 A 50 LYS H A 49 CYS HA 1.0 2.5 3.5 645 555 A 49 CYS H A 50 LYS HD2 1.0 3.3 6.5 646 555 A 49 CYS H A 50 LYS HD3 1.0 3.3 6.5 647 556 A 49 CYS H A 50 LYS HE3 1.0 3.0 6.5 648 557 A 49 CYS H A 50 LYS HE2 1.0 3.0 6.5 649 558 A 49 CYS HA A 51 ARG H 1.0 2.8 5.0 650 559 A 51 ARG H A 49 CYS HB3 1.0 2.8 5.0 651 560 A 51 ARG H A 49 CYS HB2 1.0 2.8 5.0 652 561 A 49 CYS H A 52 LYS HG3 1.0 3.0 6.5 653 562 A 50 LYS H A 50 LYS HB2 1.0 2.5 3.5 654 563 A 50 LYS H A 50 LYS HB3 1.0 2.3 4.1 655 564 A 50 LYS H A 50 LYS HD2 1.0 2.8 5.5 656 564 A 50 LYS H A 50 LYS HD3 1.0 2.8 5.5 657 565 A 50 LYS H A 50 LYS HG2 1.0 2.8 5.0 658 566 A 50 LYS H A 50 LYS HG3 1.0 2.8 5.0 659 567 A 50 LYS H A 51 ARG H 1.0 2.3 4.1 660 568 A 51 ARG H A 50 LYS HB3 1.0 2.8 5.0 661 569 A 51 ARG H A 51 ARG HD2 1.0 3.0 7.0 662 569 A 51 ARG H A 51 ARG HD3 1.0 3.0 7.0 663 570 A 51 ARG H A 51 ARG HB3 1.0 2.5 3.5 664 570 A 51 ARG H A 51 ARG HB2 1.0 2.5 3.5 665 571 A 51 ARG H A 51 ARG HG3 1.0 2.5 4.0 666 571 A 51 ARG H A 51 ARG HG2 1.0 2.5 4.0 667 572 A 51 ARG H A 52 LYS H 1.0 2.5 3.5 668 573 A 51 ARG H A 52 LYS HG3 1.0 3.0 6.5 669 574 A 53 THR H A 51 ARG HB3 1.0 3.0 6.5 670 574 A 51 ARG HB2 A 53 THR H 1.0 3.0 6.5 671 575 A 51 ARG HA A 54 ASN H 1.0 3.0 6.5 672 576 A 51 ARG HA A 54 ASN HD2y 1.0 3.0 6.5 673 577 A 51 ARG HA A 54 ASN HD2x 1.0 2.8 5.0 674 578 A 55 GLY H A 51 ARG HB3 1.0 3.0 6.5 675 578 A 51 ARG HB2 A 55 GLY H 1.0 3.0 6.5 676 579 A 51 ARG HA A 55 GLY H 1.0 2.8 5.0 677 580 A 56 GLY H A 51 ARG HB3 1.0 3.0 6.5 678 580 A 51 ARG HB2 A 56 GLY H 1.0 3.0 6.5 679 581 A 56 GLY H A 51 ARG HG3 1.0 3.0 7.0 680 581 A 51 ARG HG2 A 56 GLY H 1.0 3.0 7.0 681 582 A 57 CYS H A 51 ARG HB3 1.0 2.3 4.6 682 582 A 51 ARG HB2 A 57 CYS H 1.0 2.3 4.6 683 583 A 57 CYS H A 51 ARG HD2 1.0 3.0 7.0 684 583 A 51 ARG HD3 A 57 CYS H 1.0 3.0 7.0 685 584 A 52 LYS H A 52 LYS HB3 1.0 3.0 6.5 686 585 A 52 LYS H A 52 LYS HD3 1.0 3.0 7.0 687 585 A 52 LYS H A 52 LYS HD2 1.0 3.0 7.0 688 586 A 53 THR H A 52 LYS HB2 1.0 2.3 4.1 689 587 A 52 LYS H A 53 THR H 1.0 2.8 5.0 690 588 A 53 THR H A 52 LYS HB3 1.0 2.5 3.5 691 589 A 53 THR H A 52 LYS HG3 1.0 2.0 4.5 692 590 A 53 THR H A 52 LYS HA 1.0 2.5 3.5 693 591 A 53 THR H A 52 LYS HD3 1.0 2.5 6.5 694 591 A 53 THR H A 52 LYS HD2 1.0 2.5 6.5 695 592 A 54 ASN H A 52 LYS HG3 1.0 3.0 6.5 696 593 A 52 LYS H A 56 GLY H 1.0 3.0 6.5 697 594 A 56 GLY H A 52 LYS HB2 1.0 3.0 6.5 698 595 A 56 GLY H A 52 LYS HA 1.0 3.0 6.5 699 596 A 52 LYS H A 57 CYS H 1.0 3.0 6.5 700 597 A 57 CYS H A 52 LYS HB3 1.0 3.0 6.5 701 598 A 57 CYS H A 52 LYS HB2 1.0 3.0 6.5 702 599 A 57 CYS H A 52 LYS HG3 1.0 3.0 7.0 703 599 A 57 CYS H A 52 LYS HG2 1.0 3.0 7.0 704 600 A 53 THR H A 53 THR HG2% 1.0 2.5 4.0 705 601 A 54 ASN H A 53 THR HA 1.0 3.0 6.5 706 602 A 53 THR H A 54 ASN H 1.0 2.5 6.0 707 603 A 53 THR H A 54 ASN HA 1.0 2.3 4.7 708 604 A 53 THR H A 54 ASN HBx 1.0 3.0 6.5 709 604 A 53 THR H A 54 ASN HBy 1.0 3.0 6.5 710 605 A 53 THR H A 55 GLY H 1.0 3.0 6.5 711 606 A 55 GLY H A 53 THR HA 1.0 2.8 5.0 712 607 A 53 THR H A 56 GLY H 1.0 3.0 6.5 713 608 A 56 GLY H A 53 THR HG2% 1.0 3.0 7.0 714 609 A 56 GLY H A 53 THR HA 1.0 2.8 5.0 715 610 A 57 CYS H A 53 THR HA 1.0 3.0 6.5 716 611 A 53 THR H A 60 CYS HB2 1.0 3.0 6.5 717 612 A 53 THR H A 61 LYS HA 1.0 3.0 6.5 718 613 A 54 ASN H A 54 ASN HBx 1.0 2.5 6.0 719 613 A 54 ASN H A 54 ASN HBy 1.0 2.5 6.0 720 614 A 54 ASN HD2y A 54 ASN HBx 1.0 2.5 4.0 721 614 A 54 ASN HD2y A 54 ASN HBy 1.0 2.5 4.0 722 615 A 54 ASN HD2y A 54 ASN HA 1.0 3.0 6.5 723 616 A 54 ASN HD2x A 54 ASN HBx 1.0 2.5 4.0 724 616 A 54 ASN HD2x A 54 ASN HBy 1.0 2.5 4.0 725 617 A 54 ASN HD2x A 54 ASN HA 1.0 2.8 5.0 726 618 A 55 GLY H A 54 ASN HA 1.0 2.5 3.5 727 619 A 54 ASN H A 55 GLY H 1.0 2.3 6.5 728 620 A 55 GLY H A 54 ASN HBx 1.0 2.8 5.0 729 620 A 55 GLY H A 54 ASN HBy 1.0 2.8 5.0 730 621 A 54 ASN H A 56 GLY H 1.0 3.0 6.5 731 622 A 56 GLY H A 54 ASN HA 1.0 2.8 5.0 732 623 A 56 GLY H A 54 ASN HBx 1.0 2.8 5.0 733 623 A 56 GLY H A 54 ASN HBy 1.0 2.8 5.0 734 624 A 54 ASN H A 57 CYS H 1.0 3.0 6.5 735 625 A 57 CYS H A 54 ASN HA 1.0 2.3 6.5 736 626 A 55 GLY H A 56 GLY H 1.0 2.5 3.5 737 627 A 57 CYS H A 55 GLY HA2 1.0 2.3 4.6 738 627 A 57 CYS H A 55 GLY HA3 1.0 2.3 4.6 739 628 A 55 GLY H A 57 CYS H 1.0 2.5 3.5 740 629 A 56 GLY H A 57 CYS H 1.0 2.5 3.5 741 630 A 57 CYS H A 56 GLY HA2 1.0 2.5 4.0 742 630 A 57 CYS H A 56 GLY HA3 1.0 2.5 4.0 743 631 A 56 GLY H A 57 CYS HB2 1.0 3.0 6.5 744 632 A 56 GLY H A 57 CYS HA 1.0 2.8 5.0 745 633 A 56 GLY H A 57 CYS HB3 1.0 2.8 5.0 746 634 A 57 CYS H A 57 CYS HB3 1.0 2.5 3.5 747 635 A 57 CYS HB3 A 59 ILE H 1.0 3.0 6.5 748 636 A 57 CYS H A 60 CYS H 1.0 3.0 6.5 749 637 A 57 CYS H A 60 CYS HB2 1.0 3.0 4.7 750 638 A 57 CYS H A 61 LYS HA 1.0 3.0 6.5 751 639 A 59 ILE H A 58 PRO HB3 1.0 3.0 6.5 752 640 A 59 ILE H A 58 PRO HA 1.0 3.0 6.5 753 641 A 59 ILE H A 58 PRO HB2 1.0 2.3 4.1 754 642 A 60 CYS H A 58 PRO HB2 1.0 3.0 6.5 755 643 A 58 PRO HA A 61 LYS H 1.0 2.8 5.0 756 644 A 58 PRO HB3 A 61 LYS H 1.0 3.0 6.5 757 645 A 61 LYS H A 58 PRO HG3 1.0 3.0 6.5 758 646 A 59 ILE H A 59 ILE HD1% 1.0 2.8 5.5 759 647 A 59 ILE HB A 59 ILE H 1.0 2.5 3.5 760 648 A 59 ILE H A 59 ILE HG13 1.0 3.0 4.7 761 649 A 59 ILE HG2% A 59 ILE H 1.0 2.3 4.6 762 650 A 59 ILE HG12 A 59 ILE H 1.0 2.3 4.1 763 651 A 59 ILE HG12 A 60 CYS H 1.0 3.0 6.5 764 652 A 59 ILE HG2% A 60 CYS H 1.0 2.8 5.5 765 653 A 59 ILE HB A 60 CYS H 1.0 2.5 3.5 766 654 A 59 ILE H A 60 CYS H 1.0 2.5 3.5 767 655 A 60 CYS H A 59 ILE HD1% 1.0 3.0 7.0 768 656 A 60 CYS H A 59 ILE HA 1.0 3.0 6.5 769 657 A 60 CYS HB2 A 59 ILE H 1.0 3.0 6.5 770 658 A 59 ILE H A 60 CYS HA 1.0 3.0 4.7 771 659 A 59 ILE H A 61 LYS H 1.0 2.8 5.0 772 660 A 59 ILE HG2% A 61 LYS H 1.0 3.0 7.0 773 661 A 59 ILE H A 62 GLN H 1.0 3.0 6.5 774 662 A 59 ILE HG12 A 62 GLN H 1.0 3.0 6.5 775 663 A 59 ILE HA A 62 GLN H 1.0 2.8 5.0 776 664 A 62 GLN HE2y A 59 ILE HA 1.0 3.0 6.5 777 665 A 59 ILE HA A 63 LEU H 1.0 3.0 6.5 778 666 A 60 CYS HB2 A 60 CYS H 1.0 2.8 5.0 779 667 A 60 CYS H A 60 CYS HB3 1.0 2.8 5.0 780 668 A 60 CYS H A 61 LYS H 1.0 2.3 4.1 781 669 A 60 CYS H A 61 LYS HB3 1.0 3.0 6.5 782 670 A 60 CYS H A 61 LYS HB2 1.0 3.0 6.5 783 671 A 61 LYS H A 60 CYS HA 1.0 2.3 4.1 784 672 A 61 LYS H A 60 CYS HB3 1.0 2.3 4.1 785 673 A 60 CYS HB2 A 61 LYS H 1.0 2.3 4.1 786 674 A 60 CYS H A 62 GLN H 1.0 3.0 6.5 787 675 A 63 LEU H A 60 CYS HB3 1.0 3.0 6.5 788 676 A 61 LYS H A 61 LYS HDx 1.0 3.0 4.7 789 676 A 61 LYS H A 61 LYS HDy 1.0 3.0 4.7 790 677 A 61 LYS H A 61 LYS HEx 1.0 3.0 6.5 791 677 A 61 LYS H A 61 LYS HEy 1.0 3.0 6.5 792 678 A 61 LYS H A 61 LYS HB3 1.0 2.5 3.5 793 679 A 61 LYS H A 61 LYS HB2 1.0 2.5 3.5 794 680 A 61 LYS H A 61 LYS HG3 1.0 3.0 7.0 795 680 A 61 LYS H A 61 LYS HG2 1.0 3.0 7.0 796 681 A 61 LYS H A 62 GLN H 1.0 2.5 3.5 797 682 A 61 LYS HA A 62 GLN H 1.0 2.8 5.0 798 683 A 62 GLN H A 61 LYS HEx 1.0 3.0 6.5 799 683 A 62 GLN H A 61 LYS HEy 1.0 3.0 6.5 800 684 A 62 GLN H A 61 LYS HB3 1.0 2.5 3.5 801 685 A 62 GLN H A 61 LYS HB2 1.0 2.5 3.5 802 686 A 62 GLN H A 61 LYS HDx 1.0 2.8 5.0 803 686 A 62 GLN H A 61 LYS HDy 1.0 2.8 5.0 804 687 A 61 LYS H A 62 GLN HB2 1.0 3.0 6.5 805 688 A 62 GLN HE2y A 61 LYS HDx 1.0 3.0 7.0 806 688 A 62 GLN HE2y A 61 LYS HDy 1.0 3.0 7.0 807 689 A 61 LYS HA A 64 ILE H 1.0 2.8 5.0 808 690 A 61 LYS H A 64 ILE H 1.0 3.0 6.5 809 691 A 61 LYS H A 64 ILE HD1% 1.0 3.0 7.0 810 692 A 62 GLN H A 62 GLN HB2 1.0 2.5 3.5 811 693 A 62 GLN H A 62 GLN HB3 1.0 2.5 4.0 812 693 A 62 GLN H A 62 GLN HB2 1.0 2.5 4.0 813 694 A 62 GLN H A 62 GLN HG3 1.0 2.5 4.0 814 694 A 62 GLN H A 62 GLN HG2 1.0 2.5 4.0 815 695 A 62 GLN HE2x A 62 GLN H 1.0 3.0 6.5 816 696 A 62 GLN HE2y A 62 GLN HG3 1.0 3.0 7.0 817 696 A 62 GLN HE2y A 62 GLN HG2 1.0 3.0 7.0 818 697 A 62 GLN HE2y A 62 GLN HB3 1.0 3.0 6.5 819 698 A 62 GLN HE2y A 62 GLN HB2 1.0 3.0 6.5 820 699 A 62 GLN HE2x A 62 GLN HB2 1.0 3.0 6.5 821 700 A 62 GLN HE2x A 62 GLN HB3 1.0 3.0 6.5 822 701 A 62 GLN HE2x A 62 GLN HG3 1.0 2.5 6.5 823 701 A 62 GLN HE2x A 62 GLN HG2 1.0 2.5 6.5 824 702 A 63 LEU H A 62 GLN HG3 1.0 3.0 7.0 825 702 A 63 LEU H A 62 GLN HG2 1.0 3.0 7.0 826 703 A 63 LEU H A 62 GLN HB3 1.0 2.8 5.5 827 703 A 63 LEU H A 62 GLN HB2 1.0 2.8 5.5 828 704 A 62 GLN H A 63 LEU H 1.0 2.5 3.5 829 705 A 62 GLN H A 64 ILE H 1.0 3.0 6.5 830 706 A 62 GLN H A 65 ALA H 1.0 2.8 5.0 831 707 A 63 LEU H A 63 LEU HD2% 1.0 2.8 5.5 832 708 A 63 LEU HD1% A 63 LEU H 1.0 2.8 5.5 833 709 A 63 LEU H A 63 LEU HG 1.0 3.0 4.7 834 710 A 63 LEU H A 63 LEU HBx 1.0 2.5 3.5 835 710 A 63 LEU H A 63 LEU HBy 1.0 2.5 3.5 836 711 A 63 LEU H A 64 ILE H 1.0 3.0 6.5 837 712 A 64 ILE H A 63 LEU HA 1.0 2.8 5.0 838 713 A 63 LEU H A 67 ALA H 1.0 3.0 6.5 839 714 A 64 ILE H A 64 ILE HG12 1.0 2.5 3.5 840 715 A 64 ILE H A 64 ILE HB 1.0 2.3 4.1 841 716 A 64 ILE H A 64 ILE HG13 1.0 2.3 4.1 842 717 A 64 ILE H A 64 ILE HG2% 1.0 2.8 5.5 843 718 A 64 ILE H A 64 ILE HD1% 1.0 3.0 7.0 844 719 A 65 ALA H A 64 ILE HA 1.0 3.0 6.5 845 720 A 64 ILE H A 65 ALA H 1.0 2.8 5.0 846 721 A 65 ALA H A 65 ALA HB% 1.0 2.5 4.0 847 722 A 67 ALA H A 66 LEU HB3 1.0 3.0 6.5 848 723 A 66 LEU HD2% A 68 ALA H 1.0 3.0 7.0 849 724 A 67 ALA H A 67 ALA HB% 1.0 2.3 4.0 850 725 A 67 ALA H A 68 ALA H 1.0 3.0 6.5 851 726 A 68 ALA HB% A 68 ALA H 1.0 2.3 4.6 852 727 A 68 ALA H A 69 TYR H 1.0 3.0 6.5 853 728 A 68 ALA HA A 72 LYS H 1.0 3.0 6.5 854 729 A 69 TYR HA A 70 HIS H 1.0 2.8 5.0 855 730 A 70 HIS H A 70 HIS HBy 1.0 3.0 6.5 856 731 A 70 HIS H A 70 HIS HBx 1.0 2.8 5.0 857 732 A 70 HIS H A 72 LYS HB2 1.0 3.0 6.5 858 733 A 72 LYS HB3 A 72 LYS H 1.0 2.5 3.5 859 734 A 72 LYS H A 72 LYS HB2 1.0 2.3 4.1 860 735 A 72 LYS H A 72 LYS HD2 1.0 2.8 5.5 861 735 A 72 LYS H A 72 LYS HD3 1.0 2.8 5.5 862 736 A 72 LYS H A 72 LYS HG3 1.0 2.8 5.5 863 736 A 72 LYS H A 72 LYS HG2 1.0 2.8 5.5 864 737 A 72 LYS H A 73 HIS H 1.0 2.8 5.0 865 738 A 73 HIS H A 72 LYS HA 1.0 3.0 6.5 866 739 A 72 LYS HB3 A 73 HIS H 1.0 3.0 6.5 867 740 A 72 LYS HB2 A 73 HIS H 1.0 3.0 6.5 868 741 A 73 HIS H A 73 HIS HB3 1.0 3.0 6.5 869 742 A 73 HIS H A 73 HIS HB2 1.0 3.0 6.5 870 743 A 73 HIS H A 74 CYS H 1.0 2.8 5.0 871 744 A 74 CYS H A 74 CYS HB3 1.0 3.0 6.5 872 745 A 74 CYS HA A 75 GLN H 1.0 2.8 5.0 873 746 A 74 CYS HA A 75 GLN HE2x 1.0 3.0 6.5 874 747 A 75 GLN H A 75 GLN HG2 1.0 3.0 7.0 875 747 A 75 GLN H A 75 GLN HG3 1.0 3.0 7.0 876 748 A 75 GLN H A 75 GLN HBx 1.0 3.0 6.5 877 749 A 75 GLN H A 75 GLN HBy 1.0 3.0 6.5 878 750 A 75 GLN HE2x A 75 GLN HBy 1.0 3.0 7.0 879 750 A 75 GLN HE2x A 75 GLN HBx 1.0 3.0 7.0 880 751 A 75 GLN HE2x A 75 GLN HG2 1.0 2.8 5.5 881 751 A 75 GLN HE2x A 75 GLN HG3 1.0 2.8 5.5 882 752 A 75 GLN HE2y A 75 GLN HG2 1.0 2.8 5.5 883 752 A 75 GLN HG3 A 75 GLN HE2y 1.0 2.8 5.5 884 753 A 75 GLN HE2y A 75 GLN HBy 1.0 3.0 7.0 885 753 A 75 GLN HBx A 75 GLN HE2y 1.0 3.0 7.0 886 754 A 75 GLN H A 76 GLU HA 1.0 3.0 6.5 887 755 A 75 GLN H A 76 GLU H 1.0 3.0 6.5 888 756 A 76 GLU H A 75 GLN HA 1.0 2.5 3.5 889 757 A 75 GLN HE2x A 88 LYS HA 1.0 3.0 6.5 890 758 A 76 GLU H A 76 GLU HB2 1.0 3.0 6.5 891 759 A 76 GLU H A 76 GLU HB3 1.0 3.0 6.5 892 760 A 76 GLU HA A 77 ASN H 1.0 2.3 4.5 893 761 A 77 ASN H A 77 ASN HBy 1.0 2.8 5.0 894 762 A 77 ASN H A 77 ASN HBx 1.0 2.8 5.0 895 763 A 77 ASN HD2y A 77 ASN HBy 1.0 2.3 4.8 896 763 A 77 ASN HBx A 77 ASN HD2y 1.0 2.3 4.8 897 764 A 77 ASN HD2x A 77 ASN HBy 1.0 2.5 4.0 898 764 A 77 ASN HBx A 77 ASN HD2x 1.0 2.5 4.0 899 765 A 77 ASN H A 78 LYS HA 1.0 2.8 5.0 900 766 A 77 ASN HA A 78 LYS H 1.0 2.8 5.0 901 767 A 78 LYS H A 78 LYS HB3 1.0 3.0 6.5 902 768 A 83 PHE HA A 85 LEU H 1.0 3.0 6.5 903 769 A 83 PHE HA A 86 ASN H 1.0 3.0 6.5 904 770 A 86 ASN H A 83 PHE HBy 1.0 3.0 6.5 905 771 A 85 LEU H A 84 CYS H 1.0 3.0 6.5 906 772 A 85 LEU H A 85 LEU HB2 1.0 3.0 6.5 907 773 A 85 LEU H A 85 LEU HG 1.0 3.0 6.5 908 774 A 85 LEU H A 85 LEU HB3 1.0 2.0 3.5 909 775 A 85 LEU H A 85 LEU HD1% 1.0 3.0 7.0 910 776 A 85 LEU H A 85 LEU HD2% 1.0 2.5 6.5 911 777 A 85 LEU H A 86 ASN H 1.0 2.5 3.5 912 778 A 86 ASN H A 85 LEU HB2 1.0 2.8 5.0 913 779 A 86 ASN H A 85 LEU HB3 1.0 3.0 6.5 914 780 A 86 ASN H A 85 LEU HG 1.0 3.0 6.5 915 781 A 86 ASN H A 85 LEU HD1% 1.0 3.0 7.0 916 782 A 86 ASN H A 86 ASN HB2 1.0 2.8 5.0 917 783 A 86 ASN H A 86 ASN HB3 1.0 2.3 4.1 918 784 A 86 ASN HB3 A 86 ASN HD2y 1.0 3.0 6.5 919 785 A 86 ASN H A 87 ILE HB 1.0 2.8 5.0 920 786 A 86 ASN H A 90 LYS H 1.0 2.5 5.5 921 787 A 87 ILE H A 87 ILE HG13 1.0 2.8 5.5 922 787 A 87 ILE HG12 A 87 ILE H 1.0 2.8 5.5 923 788 A 90 LYS H A 89 GLN HA 1.0 2.5 6.5 924 789 A 90 LYS H A 89 GLN H 1.0 3.0 4.0 925 790 A 90 LYS H A 90 LYS HB2 1.0 3.0 7.0 926 790 A 90 LYS H A 90 LYS HB3 1.0 3.0 7.0 927 791 B 2 PRO HA B 3 SER H 1.0 1.8 3.0 928 792 B 3 SER H B 2 PRO HBy 1.0 2.3 6.5 929 793 B 3 SER H B 2 PRO HBx 1.0 1.8 5.0 930 794 B 3 SER H B 3 SER HA 1.0 1.8 3.0 931 795 B 3 SER H B 3 SER HBx 1.0 2.3 4.6 932 795 B 3 SER H B 3 SER HBy 1.0 2.3 4.6 933 796 B 4 GLN H B 3 SER HBx 1.0 2.3 7.0 934 796 B 3 SER HBy B 4 GLN H 1.0 2.3 7.0 935 797 B 4 GLN H B 4 GLN HA 1.0 1.8 3.0 936 798 B 4 GLN H B 4 GLN HGx 1.0 1.8 5.5 937 798 B 4 GLN H B 4 GLN HGy 1.0 1.8 5.5 938 799 B 4 GLN H B 4 GLN HBy 1.0 2.3 6.5 939 800 B 4 GLN H B 4 GLN HBx 1.0 2.3 4.1 940 801 B 4 GLN HE2y B 4 GLN HGx 1.0 2.3 7.0 941 801 B 4 GLN HGy B 4 GLN HE2y 1.0 2.3 7.0 942 802 B 5 ALA H B 4 GLN HGx 1.0 2.3 7.0 943 802 B 5 ALA H B 4 GLN HGy 1.0 2.3 7.0 944 803 B 5 ALA H B 4 GLN HBy 1.0 1.8 5.0 945 804 B 5 ALA H B 4 GLN HBx 1.0 1.8 5.0 946 805 B 5 ALA H B 5 ALA HA 1.0 1.8 3.0 947 806 B 5 ALA H B 5 ALA HB% 1.0 1.8 3.5 948 807 B 5 ALA HA B 6 MET H 1.0 1.8 3.0 949 808 B 5 ALA HB% B 6 MET H 1.0 1.8 3.5 950 809 B 5 ALA H B 7 ASP HBx 1.0 2.3 7.0 951 809 B 5 ALA H B 7 ASP HBy 1.0 2.3 7.0 952 810 B 5 ALA HB% B 7 ASP H 1.0 2.3 7.0 953 811 B 6 MET H B 6 MET HA 1.0 1.8 3.0 954 812 B 6 MET H B 6 MET HGx 1.0 2.3 4.6 955 812 B 6 MET H B 6 MET HGy 1.0 2.3 4.6 956 813 B 6 MET H B 6 MET HBx 1.0 1.8 3.5 957 813 B 6 MET H B 6 MET HBy 1.0 1.8 3.5 958 814 B 7 ASP H B 6 MET HBx 1.0 1.8 3.5 959 814 B 7 ASP H B 6 MET HBy 1.0 1.8 3.5 960 815 B 8 ASP H B 6 MET HBx 1.0 1.8 5.5 961 815 B 6 MET HBy B 8 ASP H 1.0 1.8 5.5 962 816 B 7 ASP H B 7 ASP HA 1.0 1.8 3.0 963 817 B 7 ASP H B 7 ASP HBx 1.0 1.8 3.5 964 817 B 7 ASP HBy B 7 ASP H 1.0 1.8 3.5 965 818 B 8 ASP H B 8 ASP HA 1.0 1.8 3.0 966 819 B 8 ASP H B 8 ASP HBx 1.0 1.8 3.5 967 819 B 8 ASP H B 8 ASP HBy 1.0 1.8 3.5 968 820 B 8 ASP H B 9 LEU H 1.0 1.8 3.0 969 821 B 8 ASP HA B 9 LEU H 1.0 1.8 3.2 970 822 B 9 LEU H B 8 ASP HBx 1.0 1.8 3.5 971 822 B 8 ASP HBy B 9 LEU H 1.0 1.8 3.5 972 823 B 9 LEU HA B 8 ASP H 1.0 2.3 6.5 973 824 B 8 ASP H B 9 LEU HG 1.0 1.8 5.0 974 825 B 8 ASP H B 9 LEU HDy% 1.0 1.8 5.5 975 826 B 8 ASP H B 10 MET HBy 1.0 1.8 5.5 976 826 B 8 ASP H B 10 MET HBx 1.0 1.8 5.5 977 827 B 9 LEU HA B 9 LEU H 1.0 1.8 3.0 978 828 B 9 LEU H B 9 LEU HBx 1.0 1.8 3.5 979 828 B 9 LEU HBy B 9 LEU H 1.0 1.8 3.5 980 829 B 9 LEU H B 9 LEU HG 1.0 1.8 3.0 981 830 B 9 LEU H B 9 LEU HDy% 1.0 1.8 3.5 982 831 B 9 LEU H B 10 MET HBy 1.0 1.8 5.5 983 831 B 9 LEU H B 10 MET HBx 1.0 1.8 5.5 984 832 B 9 LEU HA B 10 MET H 1.0 1.8 3.2 985 833 B 9 LEU HG B 10 MET H 1.0 2.8 4.7 986 834 B 9 LEU HDy% B 10 MET H 1.0 2.3 4.6 987 835 B 9 LEU HA B 11 LEU H 1.0 2.3 6.5 988 836 B 10 MET H B 10 MET HA 1.0 1.8 3.0 989 837 B 10 MET H B 10 MET HGy 1.0 1.8 5.0 990 838 B 10 MET H B 10 MET HGx 1.0 2.3 4.1 991 839 B 10 MET H B 10 MET HBy 1.0 1.8 3.5 992 839 B 10 MET HBx B 10 MET H 1.0 1.8 3.5 993 840 B 11 LEU H B 10 MET HGy 1.0 2.3 7.0 994 840 B 11 LEU H B 10 MET HGx 1.0 2.3 7.0 995 841 B 11 LEU H B 10 MET HBy 1.0 2.8 4.5 996 841 B 11 LEU H B 10 MET HBx 1.0 2.8 4.5 997 842 B 11 LEU H B 10 MET H 1.0 2.8 4.7 998 843 B 11 LEU H B 11 LEU HA 1.0 1.8 3.0 999 844 B 11 LEU H B 11 LEU HBx 1.0 1.8 3.5 1000 844 B 11 LEU H B 11 LEU HBy 1.0 1.8 3.5 1001 845 B 11 LEU HG B 11 LEU H 1.0 2.8 4.2 1002 846 B 11 LEU HDx% B 11 LEU H 1.0 2.8 4.5 1003 847 B 11 LEU H B 11 LEU HDy% 1.0 2.8 4.5 1004 848 B 11 LEU H B 12 SER H 1.0 2.3 6.5 1005 849 B 11 LEU HA B 12 SER H 1.0 1.8 3.0 1006 850 B 12 SER H B 11 LEU HBx 1.0 2.3 4.6 1007 850 B 11 LEU HBy B 12 SER H 1.0 2.3 4.6 1008 851 B 11 LEU HDx% B 12 SER H 1.0 2.3 4.6 1009 852 B 12 SER H B 12 SER HA 1.0 1.8 3.0 1010 853 B 12 SER H B 12 SER HBy 1.0 1.8 5.0 1011 854 B 12 SER H B 12 SER HBx 1.0 2.3 4.1 1012 855 B 12 SER H B 14 ASP HBy 1.0 2.3 6.5 1013 856 B 12 SER HA B 14 ASP H 1.0 1.8 5.0 1014 857 B 12 SER HBy B 14 ASP H 1.0 1.8 5.0 1015 858 B 12 SER HBx B 14 ASP H 1.0 1.8 3.0 1016 859 B 13 PRO HA B 14 ASP H 1.0 1.8 3.2 1017 860 B 14 ASP H B 13 PRO HBy 1.0 2.3 4.1 1018 861 B 14 ASP H B 13 PRO HBx 1.0 1.8 3.0 1019 862 B 14 ASP H B 14 ASP HA 1.0 1.8 3.0 1020 863 B 14 ASP HBy B 14 ASP H 1.0 1.8 3.0 1021 864 B 14 ASP H B 14 ASP HBx 1.0 1.8 3.0 1022 865 B 14 ASP H B 15 ASP H 1.0 1.8 3.0 1023 866 B 15 ASP H B 15 ASP HA 1.0 1.8 3.0 1024 867 B 15 ASP H B 15 ASP HBx 1.0 1.8 3.5 1025 867 B 15 ASP H B 15 ASP HBy 1.0 1.8 3.5 1026 868 B 16 ILE H B 15 ASP H 1.0 1.8 3.0 1027 869 B 16 ILE HD1% B 15 ASP H 1.0 1.8 5.5 1028 870 B 16 ILE H B 15 ASP HA 1.0 2.3 3.7 1029 871 B 16 ILE H B 15 ASP HBx 1.0 1.8 5.5 1030 871 B 16 ILE H B 15 ASP HBy 1.0 1.8 5.5 1031 872 B 17 GLU H B 15 ASP HA 1.0 2.3 4.1 1032 873 B 15 ASP H B 17 GLU HA 1.0 2.3 7.0 1033 874 B 16 ILE H B 16 ILE HA 1.0 1.8 3.0 1034 875 B 16 ILE H B 16 ILE HB 1.0 2.3 3.5 1035 876 B 16 ILE H B 16 ILE HG1x 1.0 2.3 4.1 1036 877 B 16 ILE H B 16 ILE HG1y 1.0 1.8 3.6 1037 878 B 16 ILE H B 16 ILE HG2% 1.0 1.8 3.5 1038 879 B 16 ILE H B 17 GLU H 1.0 1.8 3.0 1039 880 B 17 GLU H B 16 ILE HA 1.0 2.3 4.1 1040 881 B 17 GLU H B 16 ILE HB 1.0 2.3 4.1 1041 882 B 17 GLU H B 16 ILE HG1x 1.0 1.8 5.0 1042 883 B 17 GLU H B 16 ILE HG1y 1.0 2.3 6.5 1043 884 B 16 ILE HG2% B 17 GLU H 1.0 2.8 4.5 1044 885 B 16 ILE HD1% B 17 GLU H 1.0 2.8 4.5 1045 886 B 16 ILE H B 17 GLU HBx 1.0 1.8 5.5 1046 886 B 16 ILE H B 17 GLU HBy 1.0 1.8 5.5 1047 887 B 16 ILE H B 18 GLN H 1.0 1.8 5.0 1048 888 B 18 GLN H B 16 ILE HA 1.0 2.3 6.5 1049 889 B 16 ILE HD1% B 18 GLN H 1.0 2.3 7.0 1050 890 B 17 GLU H B 17 GLU HA 1.0 1.8 3.0 1051 891 B 17 GLU H B 17 GLU HGx 1.0 1.8 3.5 1052 891 B 17 GLU H B 17 GLU HGy 1.0 1.8 3.5 1053 892 B 17 GLU H B 17 GLU HBx 1.0 1.8 3.5 1054 892 B 17 GLU H B 17 GLU HBy 1.0 1.8 3.5 1055 893 B 17 GLU H B 18 GLN H 1.0 1.8 3.0 1056 894 B 18 GLN H B 17 GLU HA 1.0 2.3 4.1 1057 895 B 19 TRP H B 17 GLU HA 1.0 2.3 6.5 1058 896 B 19 TRP H B 17 GLU HBx 1.0 2.8 5.0 1059 896 B 19 TRP H B 17 GLU HBy 1.0 2.8 5.0 1060 897 B 18 GLN H B 18 GLN HA 1.0 1.8 3.0 1061 898 B 18 GLN H B 18 GLN HGx 1.0 1.8 3.5 1062 898 B 18 GLN H B 18 GLN HGy 1.0 1.8 3.5 1063 899 B 18 GLN H B 18 GLN HBx 1.0 1.8 3.5 1064 899 B 18 GLN H B 18 GLN HBy 1.0 1.8 3.5 1065 900 B 18 GLN HE2y B 18 GLN HGx 1.0 2.3 4.6 1066 900 B 18 GLN HGy B 18 GLN HE2y 1.0 2.3 4.6 1067 901 B 18 GLN HE2y B 18 GLN HBx 1.0 2.3 7.0 1068 901 B 18 GLN HBy B 18 GLN HE2y 1.0 2.3 7.0 1069 902 B 19 TRP H B 18 GLN HA 1.0 2.3 4.1 1070 903 B 19 TRP H B 18 GLN HGx 1.0 2.3 4.6 1071 903 B 19 TRP H B 18 GLN HGy 1.0 2.3 4.6 1072 904 B 18 GLN H B 19 TRP HA 1.0 1.8 5.0 1073 905 B 19 TRP HE1 B 18 GLN HA 1.0 2.3 6.5 1074 906 B 19 TRP HE1 B 18 GLN HGx 1.0 1.8 5.5 1075 906 B 19 TRP HE1 B 18 GLN HGy 1.0 1.8 5.5 1076 907 B 19 TRP HE1 B 18 GLN HBx 1.0 1.8 5.5 1077 907 B 19 TRP HE1 B 18 GLN HBy 1.0 1.8 5.5 1078 908 B 19 TRP H B 19 TRP HA 1.0 1.8 3.0 1079 909 B 19 TRP HD1 B 19 TRP H 1.0 2.3 4.1 1080 910 B 19 TRP H B 19 TRP HBy 1.0 2.3 3.7 1081 911 B 19 TRP H B 19 TRP HBx 1.0 1.8 3.2 1082 912 B 19 TRP HE1 B 19 TRP H 1.0 1.8 6.0 1083 913 B 19 TRP HE1 B 19 TRP HA 1.0 2.3 4.5 1084 914 B 19 TRP HE1 B 19 TRP HBy 1.0 2.3 6.5 1085 915 B 20 PHE HD% B 19 TRP H 1.0 2.3 4.6 1086 916 B 19 TRP HD1 B 19 TRP HE1 1.0 1.3 3.1 1087 917 B 19 TRP HZ2 B 19 TRP HE1 1.0 1.3 3.1 1088 918 B 19 TRP HBx B 20 PHE H 1.0 1.8 5.0 1089 919 B 19 TRP HA B 20 PHE H 1.0 2.8 5.0 1090 920 B 20 PHE H B 20 PHE HA 1.0 1.8 3.0 1091 921 B 20 PHE HD% B 20 PHE H 1.0 2.3 4.6 1092 922 B 20 PHE H B 20 PHE HE% 1.0 2.3 7.0 1093 923 B 20 PHE H B 20 PHE HBy 1.0 2.3 4.1 1094 924 B 20 PHE H B 20 PHE HBx 1.0 1.8 3.0 1095 925 B 21 THR H B 20 PHE H 1.0 1.8 3.0 1096 926 B 21 THR H B 20 PHE H 1.0 1.8 5.5 1097 927 B 21 THR H B 20 PHE HBy 1.0 1.8 5.0 1098 928 B 21 THR H B 20 PHE HBx 1.0 2.3 6.5 1099 929 B 21 THR H B 21 THR HA 1.0 1.8 3.0 1100 930 B 21 THR H B 21 THR HB 1.0 2.3 3.6 1101 931 B 21 THR H B 21 THR HG2% 1.0 1.8 3.5 1102 932 B 21 THR H B 22 GLU H 1.0 2.3 4.1 1103 933 B 21 THR HA B 22 GLU H 1.0 1.8 3.0 1104 934 B 21 THR HB B 22 GLU H 1.0 2.8 4.5 1105 935 B 21 THR HG2% B 22 GLU H 1.0 2.3 4.6 1106 936 B 21 THR H B 22 GLU HA 1.0 2.3 4.5 1107 937 B 21 THR H B 22 GLU HGx 1.0 2.3 7.0 1108 937 B 21 THR H B 22 GLU HGy 1.0 2.3 7.0 1109 938 B 21 THR H B 22 GLU HBy 1.0 2.3 6.5 1110 939 B 22 GLU HBx B 21 THR H 1.0 2.3 6.5 1111 940 B 21 THR HG2% B 23 ASP H 1.0 2.3 7.0 1112 941 B 22 GLU H B 22 GLU HA 1.0 1.8 3.0 1113 942 B 22 GLU HA B 23 ASP H 1.0 1.8 3.0 1114 943 B 23 ASP H B 22 GLU HGx 1.0 2.3 4.6 1115 943 B 22 GLU HGy B 23 ASP H 1.0 2.3 4.6 1116 944 B 22 GLU HBy B 23 ASP H 1.0 2.3 4.1 1117 945 B 22 GLU HBx B 23 ASP H 1.0 2.3 4.1 1118 946 B 22 GLU H B 22 GLU HGx 1.0 1.8 3.5 1119 946 B 22 GLU H B 22 GLU HGy 1.0 1.8 3.5 1120 947 B 22 GLU H B 22 GLU HBy 1.0 2.3 3.7 1121 948 B 22 GLU HBx B 22 GLU H 1.0 2.3 3.7 1122 949 B 23 ASP H B 23 ASP HA 1.0 1.8 3.0 1123 950 B 23 ASP H B 23 ASP HBy 1.0 1.8 3.0 1124 951 B 23 ASP H B 23 ASP HBx 1.0 1.8 3.0 1125 952 B 23 ASP H B 24 PRO HDx 1.0 2.3 4.6 1126 952 B 24 PRO HDy B 23 ASP H 1.0 2.3 4.6 1127 953 B 23 ASP HA B 25 GLY H 1.0 2.3 6.5 1128 954 B 23 ASP HBy B 25 GLY H 1.0 2.3 6.5 1129 955 B 25 GLY H B 24 PRO HA 1.0 1.8 3.0 1130 956 B 25 GLY H B 24 PRO HBy 1.0 1.8 5.0 1131 957 B 25 GLY H B 24 PRO HBx 1.0 2.3 4.1 1132 958 B 25 GLY H B 24 PRO HGx 1.0 2.3 4.6 1133 958 B 25 GLY H B 24 PRO HGy 1.0 2.3 4.6 1134 959 B 25 GLY H B 25 GLY HAx 1.0 1.8 3.0 1135 959 B 25 GLY H B 25 GLY HAy 1.0 1.8 3.0 1136 960 A 2 THR HG2% A 2 THR HA 1.0 2.2 3.9 1137 961 A 3 GLN HA A 2 THR HA 1.0 2.5 4.7 1138 962 A 2 THR HB A 3 GLN HA 1.0 2.0 4.2 1139 963 A 2 THR HB A 3 GLN HGy 1.0 2.2 3.4 1140 963 A 2 THR HB A 3 GLN HGx 1.0 2.2 3.4 1141 964 A 3 GLN HA A 3 GLN HGy 1.0 2.2 3.4 1142 964 A 3 GLN HGx A 3 GLN HA 1.0 2.2 3.4 1143 965 A 4 SER HA A 3 GLN HGy 1.0 2.5 6.5 1144 966 A 3 GLN HGx A 4 SER HA 1.0 3.0 6.5 1145 967 A 4 SER HA A 3 GLN HB3 1.0 2.5 6.5 1146 968 A 3 GLN HA A 7 ASP HBy 1.0 2.2 3.4 1147 968 A 3 GLN HA A 7 ASP HBx 1.0 2.2 3.4 1148 969 A 3 GLN HA A 7 ASP HA 1.0 3.0 5.2 1149 970 A 3 GLN HGy A 7 ASP HBy 1.0 2.5 4.2 1150 970 A 3 GLN HGx A 7 ASP HBy 1.0 2.5 4.2 1151 970 A 7 ASP HBx A 3 GLN HGy 1.0 2.5 4.2 1152 970 A 3 GLN HGx A 7 ASP HBx 1.0 2.5 4.2 1153 971 A 3 GLN HB3 A 7 ASP HBy 1.0 2.5 4.2 1154 971 A 3 GLN HB3 A 7 ASP HBx 1.0 2.5 4.2 1155 972 A 3 GLN HB3 A 8 SER HA 1.0 2.5 6.5 1156 973 A 11 LEU HD1% A 3 GLN HGy 1.0 2.2 3.9 1157 973 A 3 GLN HGx A 11 LEU HD1% 1.0 2.2 3.9 1158 974 A 4 SER HA A 5 PRO HD2 1.0 2.2 3.4 1159 975 A 4 SER HA A 5 PRO HD3 1.0 2.2 3.4 1160 976 A 4 SER HA A 5 PRO HG2 1.0 2.5 6.5 1161 977 A 4 SER HA A 5 PRO HG3 1.0 2.5 5.5 1162 978 A 5 PRO HA A 4 SER HBx 1.0 2.5 4.7 1163 978 A 5 PRO HA A 4 SER HBy 1.0 2.5 4.7 1164 979 A 5 PRO HB2 A 4 SER HBx 1.0 2.5 4.7 1165 979 A 5 PRO HB2 A 4 SER HBy 1.0 2.5 4.7 1166 980 A 4 SER HA A 7 ASP HBy 1.0 2.5 4.2 1167 981 A 4 SER HA A 7 ASP HBx 1.0 2.5 4.2 1168 982 A 4 SER HBy A 7 ASP HBy 1.0 2.5 6.5 1169 982 A 7 ASP HBx A 4 SER HBx 1.0 2.5 6.5 1170 982 A 7 ASP HBx A 4 SER HBy 1.0 2.5 6.5 1171 982 A 4 SER HBx A 7 ASP HBy 1.0 2.5 6.5 1172 983 A 5 PRO HA A 5 PRO HD2 1.0 2.2 3.4 1173 984 A 5 PRO HA A 5 PRO HD3 1.0 2.2 3.4 1174 985 A 5 PRO HB2 A 5 PRO HD2 1.0 2.2 3.4 1175 986 A 5 PRO HB2 A 5 PRO HD3 1.0 2.5 4.7 1176 987 A 5 PRO HA A 5 PRO HD2 1.0 2.5 7.0 1177 987 A 5 PRO HA A 5 PRO HD3 1.0 2.5 7.0 1178 988 A 5 PRO HA A 5 PRO HG2 1.0 2.2 3.9 1179 988 A 5 PRO HA A 5 PRO HG3 1.0 2.2 3.9 1180 989 A 5 PRO HA A 5 PRO HG3 1.0 2.5 6.5 1181 990 A 5 PRO HA A 5 PRO HG2 1.0 2.5 6.5 1182 991 A 6 GLY HAy A 5 PRO HD2 1.0 3.0 4.7 1183 991 A 5 PRO HD2 A 6 GLY HAx 1.0 3.0 4.7 1184 992 A 5 PRO HA A 8 SER HA 1.0 2.5 4.7 1185 993 A 5 PRO HB3 A 9 ARG HG2 1.0 2.5 7.0 1186 993 A 5 PRO HB3 A 9 ARG HG3 1.0 2.5 7.0 1187 994 A 5 PRO HB2 A 9 ARG HD2 1.0 2.5 7.0 1188 994 A 5 PRO HB2 A 9 ARG HD3 1.0 2.5 7.0 1189 995 A 5 PRO HB2 A 9 ARG HG2 1.0 3.0 4.7 1190 995 A 5 PRO HB2 A 9 ARG HG3 1.0 3.0 4.7 1191 996 A 5 PRO HB3 A 9 ARG HBx 1.0 2.5 4.2 1192 997 A 5 PRO HA A 9 ARG HBx 1.0 2.5 6.5 1193 998 A 5 PRO HB2 A 9 ARG HBx 1.0 2.2 3.4 1194 999 A 6 GLY HAx A 7 ASP HBy 1.0 2.5 4.2 1195 999 A 6 GLY HAy A 7 ASP HBy 1.0 2.5 4.2 1196 999 A 7 ASP HBx A 6 GLY HAx 1.0 2.5 4.2 1197 999 A 7 ASP HBx A 6 GLY HAy 1.0 2.5 4.2 1198 1000 A 7 ASP HA A 8 SER HA 1.0 3.0 4.7 1199 1001 A 8 SER HA A 7 ASP HBy 1.0 2.2 3.4 1200 1001 A 7 ASP HBx A 8 SER HA 1.0 2.2 3.4 1201 1002 A 7 ASP HA A 10 ARG HG2 1.0 2.5 6.0 1202 1002 A 7 ASP HA A 10 ARG HG3 1.0 2.5 6.0 1203 1003 A 7 ASP HA A 10 ARG HD2 1.0 2.2 3.9 1204 1003 A 7 ASP HA A 10 ARG HD3 1.0 2.2 3.9 1205 1004 A 7 ASP HA A 10 ARG HB3 1.0 2.5 5.5 1206 1005 A 7 ASP HBy A 10 ARG HD2 1.0 2.5 6.0 1207 1005 A 7 ASP HBx A 10 ARG HD2 1.0 2.5 6.0 1208 1005 A 10 ARG HD3 A 7 ASP HBy 1.0 2.5 6.0 1209 1005 A 7 ASP HBx A 10 ARG HD3 1.0 2.5 6.0 1210 1006 A 7 ASP HBy A 10 ARG HB3 1.0 2.5 6.0 1211 1006 A 7 ASP HBx A 10 ARG HB3 1.0 2.5 6.0 1212 1006 A 10 ARG HB2 A 7 ASP HBy 1.0 2.5 6.0 1213 1006 A 7 ASP HBx A 10 ARG HB2 1.0 2.5 6.0 1214 1007 A 11 LEU HD1% A 7 ASP HBy 1.0 2.5 7.0 1215 1007 A 7 ASP HBx A 11 LEU HD1% 1.0 2.5 7.0 1216 1008 A 7 ASP HA A 11 LEU HG 1.0 2.5 4.2 1217 1009 A 7 ASP HA A 11 LEU HD1% 1.0 2.2 3.9 1218 1010 A 11 LEU HA A 8 SER HA 1.0 3.0 5.2 1219 1011 A 11 LEU HG A 8 SER HA 1.0 2.5 6.5 1220 1012 A 8 SER HA A 11 LEU HD2% 1.0 2.5 7.0 1221 1013 A 11 LEU HD1% A 8 SER HA 1.0 2.5 6.0 1222 1014 A 11 LEU HD1% A 8 SER HBx 1.0 2.5 6.5 1223 1014 A 8 SER HBy A 11 LEU HD1% 1.0 2.5 6.5 1224 1015 A 12 SER HB2 A 8 SER HA 1.0 3.0 4.7 1225 1016 A 9 ARG HA A 9 ARG HD2 1.0 2.2 3.9 1226 1016 A 9 ARG HD3 A 9 ARG HA 1.0 2.2 3.9 1227 1017 A 9 ARG HA A 9 ARG HG2 1.0 2.2 3.9 1228 1017 A 9 ARG HG3 A 9 ARG HA 1.0 2.2 3.9 1229 1018 A 12 SER HB3 A 9 ARG HA 1.0 2.5 6.5 1230 1019 A 12 SER HB2 A 9 ARG HA 1.0 2.5 5.5 1231 1020 A 12 SER HB2 A 9 ARG HBy 1.0 3.0 7.0 1232 1021 A 12 SER HB3 A 9 ARG HBy 1.0 2.5 5.5 1233 1022 A 13 ILE HG13 A 9 ARG HG2 1.0 3.0 5.2 1234 1022 A 9 ARG HG3 A 13 ILE HG13 1.0 3.0 5.2 1235 1023 A 10 ARG HA A 10 ARG HG2 1.0 2.5 6.0 1236 1023 A 10 ARG HG3 A 10 ARG HA 1.0 2.5 6.0 1237 1024 A 10 ARG HA A 10 ARG HD2 1.0 2.2 3.9 1238 1024 A 10 ARG HD3 A 10 ARG HA 1.0 2.2 3.9 1239 1025 A 10 ARG HA A 11 LEU HA 1.0 2.5 6.5 1240 1026 A 11 LEU HB2 A 10 ARG HB3 1.0 2.5 7.0 1241 1026 A 10 ARG HB2 A 11 LEU HB2 1.0 2.5 7.0 1242 1027 A 11 LEU HG A 10 ARG HA 1.0 2.5 6.5 1243 1028 A 11 LEU HD2% A 10 ARG HB3 1.0 2.5 7.5 1244 1028 A 10 ARG HB2 A 11 LEU HD2% 1.0 2.5 7.5 1245 1029 A 11 LEU HD1% A 10 ARG HB3 1.0 2.5 7.5 1246 1029 A 11 LEU HD1% A 10 ARG HB2 1.0 2.5 7.5 1247 1030 A 10 ARG HA A 13 ILE HD1% 1.0 2.2 3.9 1248 1031 A 10 ARG HA A 13 ILE HG12 1.0 2.2 3.4 1249 1032 A 10 ARG HA A 13 ILE HB 1.0 2.5 4.7 1250 1033 A 13 ILE HB A 10 ARG HG2 1.0 2.5 7.0 1251 1033 A 10 ARG HG3 A 13 ILE HB 1.0 2.5 7.0 1252 1034 A 13 ILE HD1% A 10 ARG HG2 1.0 2.5 7.5 1253 1034 A 10 ARG HG3 A 13 ILE HD1% 1.0 2.5 7.5 1254 1035 A 11 LEU HA A 11 LEU HD2% 1.0 2.2 3.9 1255 1036 A 11 LEU HD1% A 11 LEU HA 1.0 2.2 3.9 1256 1037 A 11 LEU HG A 11 LEU HA 1.0 2.2 3.4 1257 1038 A 11 LEU HB3 A 11 LEU HD2% 1.0 2.5 4.7 1258 1039 A 11 LEU HB2 A 11 LEU HD2% 1.0 2.2 3.9 1259 1040 A 11 LEU HD1% A 11 LEU HB3 1.0 2.2 3.9 1260 1041 A 11 LEU HD1% A 11 LEU HB2 1.0 2.2 3.9 1261 1042 A 11 LEU HB3 A 12 SER HA 1.0 2.5 4.2 1262 1043 A 11 LEU HB2 A 12 SER HA 1.0 2.5 4.2 1263 1044 A 11 LEU HA A 12 SER HA 1.0 2.5 6.5 1264 1045 A 11 LEU HB2 A 12 SER HB2 1.0 2.5 6.5 1265 1046 A 11 LEU HB2 A 12 SER HB3 1.0 2.5 6.5 1266 1047 A 11 LEU HA A 14 GLN HBy 1.0 2.2 3.4 1267 1048 A 14 GLN HBx A 11 LEU HA 1.0 2.2 3.4 1268 1049 A 11 LEU HA A 14 GLN HGy 1.0 2.5 4.2 1269 1049 A 11 LEU HA A 14 GLN HGx 1.0 2.5 4.2 1270 1050 A 11 LEU HA A 14 GLN HA 1.0 2.5 6.5 1271 1051 A 11 LEU HD2% A 14 GLN HBy 1.0 2.5 7.5 1272 1051 A 14 GLN HBx A 11 LEU HD2% 1.0 2.5 7.5 1273 1052 A 11 LEU HB2 A 15 ARG HD2 1.0 2.5 7.0 1274 1052 A 11 LEU HB2 A 15 ARG HD3 1.0 2.5 7.0 1275 1053 A 11 LEU HB3 A 15 ARG HBx 1.0 2.5 5.5 1276 1054 A 11 LEU HB3 A 15 ARG HD2 1.0 2.5 7.0 1277 1054 A 11 LEU HB3 A 15 ARG HD3 1.0 2.5 7.0 1278 1055 A 11 LEU HB3 A 15 ARG HG2 1.0 2.2 3.9 1279 1055 A 11 LEU HB3 A 15 ARG HG3 1.0 2.2 3.9 1280 1056 A 11 LEU HA A 15 ARG HG2 1.0 2.2 3.9 1281 1056 A 11 LEU HA A 15 ARG HG3 1.0 2.2 3.9 1282 1057 A 12 SER HB2 A 13 ILE HG12 1.0 2.5 6.5 1283 1058 A 12 SER HA A 14 GLN HBy 1.0 2.5 5.5 1284 1058 A 14 GLN HBx A 12 SER HA 1.0 2.5 5.5 1285 1059 A 12 SER HA A 15 ARG HBx 1.0 2.2 3.4 1286 1060 A 12 SER HA A 15 ARG HG2 1.0 2.2 3.9 1287 1060 A 12 SER HA A 15 ARG HG3 1.0 2.2 3.9 1288 1061 A 16 ALA HB% A 12 SER HA 1.0 2.5 7.0 1289 1062 A 13 ILE HG13 A 13 ILE HA 1.0 2.2 3.4 1290 1063 A 13 ILE HG12 A 13 ILE HA 1.0 2.2 3.4 1291 1064 A 13 ILE HG2% A 13 ILE HA 1.0 2.2 3.9 1292 1065 A 13 ILE HD1% A 14 GLN HA 1.0 2.5 6.0 1293 1066 A 13 ILE HA A 15 ARG HBx 1.0 2.5 5.5 1294 1067 A 16 ALA HB% A 13 ILE HG13 1.0 2.5 7.0 1295 1068 A 16 ALA HB% A 13 ILE HG2% 1.0 2.5 6.5 1296 1069 A 16 ALA HB% A 13 ILE HA 1.0 2.2 3.9 1297 1070 A 16 ALA HB% A 13 ILE HG12 1.0 3.0 4.7 1298 1071 A 13 ILE HG2% A 17 ILE HG12 1.0 2.5 6.0 1299 1072 A 13 ILE HG2% A 17 ILE HG13 1.0 2.5 7.0 1300 1073 A 13 ILE HG2% A 17 ILE HB 1.0 2.5 7.0 1301 1074 A 13 ILE HG12 A 10 ARG HG2 1.0 2.5 6.5 1302 1074 A 10 ARG HG3 A 13 ILE HG12 1.0 2.5 6.5 1303 1075 A 13 ILE HG12 A 66 LEU HD1% 1.0 2.5 7.0 1304 1076 A 13 ILE HG13 A 66 LEU HD1% 1.0 2.5 6.0 1305 1077 A 13 ILE HG2% A 66 LEU HG 1.0 2.5 7.0 1306 1078 A 13 ILE HG2% A 66 LEU HD1% 1.0 2.5 7.5 1307 1079 A 13 ILE HD1% A 69 TYR HB3 1.0 2.5 7.0 1308 1080 A 69 TYR HD% A 13 ILE HD1% 1.0 2.5 7.0 1309 1081 A 14 GLN HA A 14 GLN HGy 1.0 2.2 3.4 1310 1081 A 14 GLN HGx A 14 GLN HA 1.0 2.2 3.4 1311 1082 A 14 GLN HBy A 15 ARG HG2 1.0 2.5 6.0 1312 1082 A 15 ARG HG3 A 14 GLN HBy 1.0 2.5 6.0 1313 1082 A 14 GLN HBx A 15 ARG HG3 1.0 2.5 6.0 1314 1082 A 14 GLN HBx A 15 ARG HG2 1.0 2.5 6.0 1315 1083 A 14 GLN HA A 17 ILE HG2% 1.0 2.5 4.7 1316 1084 A 14 GLN HA A 17 ILE HD1% 1.0 2.2 3.9 1317 1085 A 14 GLN HA A 17 ILE HG12 1.0 2.5 5.5 1318 1086 A 14 GLN HA A 17 ILE HG13 1.0 2.5 5.5 1319 1087 A 17 ILE HB A 14 GLN HBy 1.0 2.5 6.5 1320 1087 A 14 GLN HBx A 17 ILE HB 1.0 2.5 6.5 1321 1088 A 14 GLN HA A 66 LEU HD1% 1.0 3.0 6.0 1322 1089 A 15 ARG HA A 15 ARG HD2 1.0 2.2 3.9 1323 1089 A 15 ARG HD3 A 15 ARG HA 1.0 2.2 3.9 1324 1090 A 15 ARG HA A 15 ARG HG2 1.0 2.2 3.9 1325 1090 A 15 ARG HG3 A 15 ARG HA 1.0 2.2 3.9 1326 1091 A 16 ALA HA A 15 ARG HA 1.0 2.5 4.7 1327 1092 A 16 ALA HB% A 15 ARG HBx 1.0 2.2 3.9 1328 1093 A 15 ARG HG2 A 18 GLN HG3 1.0 2.5 7.0 1329 1093 A 15 ARG HG3 A 18 GLN HG3 1.0 2.5 7.0 1330 1094 A 18 GLN HB2 A 15 ARG HG2 1.0 2.2 3.9 1331 1094 A 15 ARG HG3 A 18 GLN HB2 1.0 2.2 3.9 1332 1095 A 16 ALA HB% A 16 ALA H 1.0 2.5 7.0 1333 1096 A 16 ALA HB% A 17 ILE HG13 1.0 2.2 3.9 1334 1097 A 16 ALA HB% A 17 ILE HG12 1.0 2.2 3.9 1335 1098 A 16 ALA HA A 18 GLN HB2 1.0 2.5 6.5 1336 1099 A 16 ALA HB% A 20 LEU HB2 1.0 2.5 7.0 1337 1100 A 16 ALA HA A 66 LEU HD1% 1.0 2.5 7.0 1338 1101 A 16 ALA HB% A 66 LEU HB2 1.0 2.5 7.0 1339 1102 A 16 ALA HB% A 66 LEU HD1% 1.0 2.2 4.4 1340 1103 A 16 ALA HB% A 66 LEU HD2% 1.0 2.2 4.4 1341 1104 A 16 ALA HA A 66 LEU HD2% 1.0 2.2 3.9 1342 1105 A 17 ILE HG12 A 17 ILE HA 1.0 2.5 5.5 1343 1106 A 17 ILE HG2% A 17 ILE HA 1.0 2.5 4.7 1344 1107 A 17 ILE HG13 A 17 ILE HA 1.0 2.2 3.4 1345 1108 A 17 ILE HD1% A 17 ILE HA 1.0 2.2 3.9 1346 1109 A 17 ILE HG2% A 18 GLN HA 1.0 2.5 7.0 1347 1110 A 17 ILE HB A 18 GLN HB2 1.0 2.5 4.7 1348 1111 A 17 ILE HA A 20 LEU HA 1.0 2.5 6.5 1349 1112 A 17 ILE HB A 20 LEU HB3 1.0 3.0 4.7 1350 1113 A 20 LEU HD2% A 17 ILE HG12 1.0 2.5 6.0 1351 1114 A 17 ILE HG12 A 20 LEU HG 1.0 2.5 6.5 1352 1115 A 17 ILE HG2% A 20 LEU HB2 1.0 2.5 7.0 1353 1116 A 17 ILE HG2% A 20 LEU HG 1.0 2.5 6.0 1354 1117 A 17 ILE HA A 20 LEU HB2 1.0 2.5 4.2 1355 1118 A 17 ILE HA A 20 LEU HG 1.0 2.5 5.5 1356 1119 A 20 LEU HD2% A 17 ILE HG2% 1.0 2.5 5.2 1357 1120 A 20 LEU HD1% A 17 ILE HA 1.0 2.5 6.0 1358 1121 A 17 ILE HB A 21 VAL HG2% 1.0 3.0 4.7 1359 1122 A 17 ILE HG12 A 21 VAL HG2% 1.0 2.5 4.7 1360 1123 A 17 ILE HG2% A 21 VAL HG2% 1.0 2.2 4.4 1361 1124 A 66 LEU HB2 A 17 ILE HG12 1.0 2.5 6.5 1362 1125 A 17 ILE HB A 66 LEU HD1% 1.0 2.2 3.9 1363 1126 A 17 ILE HG12 A 66 LEU HD1% 1.0 2.2 3.9 1364 1127 A 17 ILE HG13 A 66 LEU HD1% 1.0 2.2 3.9 1365 1128 A 17 ILE HG12 A 66 LEU HD2% 1.0 2.5 4.7 1366 1129 A 17 ILE HG13 A 66 LEU HD2% 1.0 2.2 3.9 1367 1130 A 17 ILE HG2% A 66 LEU HG 1.0 2.5 7.0 1368 1131 A 69 TYR HA A 17 ILE HD1% 1.0 2.5 7.0 1369 1132 A 17 ILE HD1% A 69 TYR HB3 1.0 2.5 7.0 1370 1133 A 17 ILE HG2% A 70 HIS HBy 1.0 2.5 7.0 1371 1134 A 17 ILE HD1% A 70 HIS HBy 1.0 2.5 7.0 1372 1135 A 17 ILE HD1% A 70 HIS HBx 1.0 2.5 6.0 1373 1136 A 17 ILE HG2% A 70 HIS HBx 1.0 2.5 7.0 1374 1137 A 17 ILE HG13 A 70 HIS HBx 1.0 2.5 6.5 1375 1138 A 17 ILE HG2% A 74 CYS HB2 1.0 2.5 7.0 1376 1139 A 17 ILE HG2% A 81 VAL HG2% 1.0 2.5 6.5 1377 1140 A 18 GLN HA A 18 GLN HG3 1.0 2.5 5.5 1378 1141 A 18 GLN HG2 A 18 GLN HA 1.0 2.5 4.2 1379 1142 A 18 GLN HB3 A 19 SER HA 1.0 2.5 6.5 1380 1143 A 18 GLN HB2 A 19 SER HA 1.0 2.5 4.2 1381 1144 A 18 GLN HA A 21 VAL HG1% 1.0 2.2 3.9 1382 1145 A 18 GLN HB3 A 21 VAL HB 1.0 2.5 6.5 1383 1146 A 18 GLN HA A 21 VAL HG2% 1.0 2.2 3.9 1384 1147 A 18 GLN HB2 A 22 HIS HBx 1.0 2.8 6.0 1385 1148 A 19 SER HA A 22 HIS HA 1.0 2.5 5.5 1386 1149 A 19 SER HA A 22 HIS HBx 1.0 2.5 4.2 1387 1150 A 19 SER HA A 22 HIS HBy 1.0 2.5 5.5 1388 1151 A 19 SER HA A 22 HIS HBx 1.0 2.2 3.9 1389 1151 A 19 SER HA A 22 HIS HBy 1.0 2.2 3.9 1390 1152 A 19 SER HA A 23 ALA HB% 1.0 2.5 4.2 1391 1153 A 23 ALA HB% A 19 SER HB2 1.0 2.2 4.4 1392 1153 A 19 SER HB3 A 23 ALA HB% 1.0 2.2 4.4 1393 1154 A 19 SER HA A 39 MET HG2 1.0 2.5 7.0 1394 1155 A 39 MET HG2 A 19 SER HB2 1.0 2.5 5.5 1395 1156 A 19 SER HA A 39 MET HB2 1.0 2.5 6.5 1396 1157 A 20 LEU HG A 20 LEU HA 1.0 2.2 3.4 1397 1158 A 20 LEU HD1% A 20 LEU HA 1.0 2.2 3.9 1398 1159 A 20 LEU HD2% A 20 LEU HA 1.0 2.2 3.9 1399 1160 A 20 LEU HD2% A 20 LEU HB2 1.0 2.2 3.9 1400 1161 A 20 LEU HD2% A 20 LEU HB3 1.0 2.2 3.9 1401 1162 A 20 LEU HB3 A 21 VAL HG2% 1.0 2.2 3.9 1402 1163 A 20 LEU HG A 21 VAL HG2% 1.0 2.5 6.0 1403 1164 A 20 LEU HG A 21 VAL HA 1.0 2.5 6.5 1404 1165 A 20 LEU HA A 22 HIS HBy 1.0 2.5 4.7 1405 1166 A 20 LEU HB2 A 23 ALA HB% 1.0 2.5 7.0 1406 1167 A 20 LEU HG A 23 ALA HB% 1.0 2.2 3.9 1407 1168 A 20 LEU HD1% A 23 ALA HB% 1.0 2.5 7.5 1408 1169 A 20 LEU HA A 23 ALA HB% 1.0 3.0 4.7 1409 1170 A 20 LEU HB3 A 23 ALA HB% 1.0 3.0 4.7 1410 1171 A 20 LEU HA A 24 ALA HB% 1.0 2.5 6.0 1411 1172 A 20 LEU HA A 39 MET HG3 1.0 2.5 4.2 1412 1173 A 39 MET HB3 A 20 LEU HA 1.0 2.5 6.5 1413 1174 A 20 LEU HA A 39 MET HB2 1.0 2.5 4.2 1414 1175 A 20 LEU HA A 39 MET HG2 1.0 2.5 5.5 1415 1176 A 20 LEU HB2 A 39 MET HB2 1.0 2.5 6.5 1416 1177 A 20 LEU HB2 A 39 MET HG3 1.0 2.5 6.5 1417 1178 A 20 LEU HB2 A 39 MET HG2 1.0 2.5 6.5 1418 1179 A 39 MET HE1 A 20 LEU HA 1.0 2.2 3.9 1419 1180 A 39 MET HE1 A 20 LEU HB2 1.0 2.2 3.9 1420 1181 A 39 MET HE1 A 20 LEU HG 1.0 2.5 4.2 1421 1182 A 39 MET HE1 A 20 LEU HD1% 1.0 2.2 4.4 1422 1183 A 20 LEU HB2 A 43 VAL HG2% 1.0 2.5 4.7 1423 1184 A 20 LEU HA A 43 VAL HG2% 1.0 2.2 3.9 1424 1185 A 20 LEU HD2% A 63 LEU HD1% 1.0 2.2 4.4 1425 1186 A 63 LEU HD1% A 20 LEU HB2 1.0 2.2 3.9 1426 1187 A 20 LEU HB2 A 66 LEU HG 1.0 3.0 4.7 1427 1188 A 20 LEU HD2% A 66 LEU HG 1.0 2.5 6.0 1428 1189 A 20 LEU HD2% A 66 LEU HD1% 1.0 2.2 4.4 1429 1190 A 20 LEU HB2 A 66 LEU HD1% 1.0 2.2 3.9 1430 1191 A 20 LEU HB3 A 66 LEU HD2% 1.0 2.2 3.9 1431 1192 A 20 LEU HG A 66 LEU HD2% 1.0 2.2 3.9 1432 1193 A 20 LEU HD2% A 66 LEU HD2% 1.0 2.2 4.4 1433 1194 A 20 LEU HB2 A 66 LEU HD2% 1.0 2.2 3.9 1434 1195 A 20 LEU HD2% A 67 ALA HA 1.0 2.2 3.9 1435 1196 A 20 LEU HD2% A 67 ALA HB% 1.0 2.2 4.4 1436 1197 A 20 LEU HA A 81 VAL HG2% 1.0 2.5 7.0 1437 1198 A 20 LEU HD2% A 81 VAL HB 1.0 2.5 7.0 1438 1199 A 20 LEU HG A 81 VAL HG1% 1.0 2.5 7.0 1439 1200 A 20 LEU HD2% A 81 VAL HG2% 1.0 2.5 6.5 1440 1201 A 20 LEU HD2% A 81 VAL HG1% 1.0 2.5 7.5 1441 1202 A 20 LEU HB2 A 81 VAL HG1% 1.0 2.5 6.0 1442 1203 A 20 LEU HD1% A 81 VAL HG1% 1.0 2.5 5.2 1443 1204 A 20 LEU HD1% A 82 PRO HG2 1.0 3.0 5.2 1444 1205 A 21 VAL HG1% A 21 VAL HA 1.0 2.2 3.9 1445 1206 A 21 VAL HG1% A 22 HIS HA 1.0 2.5 7.0 1446 1207 A 21 VAL HG1% A 22 HIS HBx 1.0 2.2 3.9 1447 1208 A 21 VAL HB A 22 HIS HBx 1.0 2.5 6.5 1448 1209 A 21 VAL HA A 24 ALA HB% 1.0 2.5 6.0 1449 1210 A 21 VAL HG1% A 24 ALA HB% 1.0 2.2 4.4 1450 1211 A 21 VAL HG1% A 25 GLN HG2 1.0 2.5 7.0 1451 1212 A 21 VAL HG1% A 25 GLN HG3 1.0 2.5 7.0 1452 1213 A 21 VAL HG1% A 25 GLN HB2 1.0 2.2 3.9 1453 1214 A 21 VAL HG2% A 74 CYS HB2 1.0 2.5 4.7 1454 1215 A 21 VAL HG1% A 80 PRO HG3 1.0 2.5 4.2 1455 1216 A 21 VAL HG1% A 80 PRO HD2 1.0 3.0 5.2 1456 1217 A 21 VAL HA A 81 VAL HB 1.0 2.5 6.5 1457 1218 A 21 VAL HA A 81 VAL HG2% 1.0 2.0 6.5 1458 1219 A 21 VAL HG1% A 81 VAL HG2% 1.0 2.5 6.5 1459 1220 A 21 VAL HG2% A 81 VAL HG1% 1.0 2.2 4.4 1460 1221 A 21 VAL HA A 81 VAL HG1% 1.0 2.2 3.9 1461 1222 A 81 VAL HG2% A 21 VAL HG2% 1.0 2.2 4.4 1462 1223 A 22 HIS HD2 A 22 HIS HA 1.0 2.5 5.5 1463 1224 A 23 ALA HA A 22 HIS HBy 1.0 2.5 4.2 1464 1225 A 22 HIS HD2 A 23 ALA HB% 1.0 2.5 4.7 1465 1226 A 23 ALA HB% A 22 HIS HBx 1.0 2.5 6.5 1466 1226 A 23 ALA HB% A 22 HIS HBy 1.0 2.5 6.5 1467 1227 A 25 GLN HB2 A 22 HIS HBx 1.0 2.5 6.5 1468 1228 A 22 HIS HA A 26 CYS HB3 1.0 2.5 4.2 1469 1229 A 26 CYS HB3 A 22 HIS HBy 1.0 2.5 5.5 1470 1230 A 26 CYS HB3 A 22 HIS HBx 1.0 2.5 5.5 1471 1231 A 22 HIS HD2 A 33 LEU HD2% 1.0 2.5 7.0 1472 1232 A 45 HIS HBy A 45 HIS HA 1.0 2.5 5.5 1473 1233 A 23 ALA HB% A 24 ALA HB% 1.0 2.2 4.4 1474 1234 A 23 ALA HA A 26 CYS HA 1.0 3.0 5.5 1475 1235 A 23 ALA HA A 26 CYS HB2 1.0 2.2 3.4 1476 1236 A 23 ALA HA A 26 CYS HB3 1.0 2.2 3.4 1477 1237 A 23 ALA HB% A 26 CYS HB3 1.0 2.5 7.0 1478 1238 A 23 ALA HA A 36 CYS HB2 1.0 2.5 6.5 1479 1239 A 23 ALA HA A 36 CYS HB3 1.0 2.5 6.5 1480 1240 A 23 ALA HB% A 36 CYS HB2 1.0 2.5 7.0 1481 1241 A 23 ALA HB% A 36 CYS HA 1.0 2.5 4.2 1482 1242 A 23 ALA HB% A 36 CYS HB3 1.0 2.0 6.5 1483 1243 A 23 ALA HA A 39 MET HB2 1.0 2.5 4.7 1484 1244 A 23 ALA HB% A 39 MET HG3 1.0 2.5 6.0 1485 1245 A 23 ALA HB% A 39 MET HB2 1.0 3.0 4.7 1486 1246 A 39 MET HB3 A 23 ALA HB% 1.0 2.5 6.0 1487 1247 A 23 ALA HB% A 39 MET HA 1.0 2.5 7.0 1488 1248 A 23 ALA HB% A 39 MET HG2 1.0 2.5 4.7 1489 1249 A 23 ALA HA A 40 LYS HE3 1.0 2.5 4.2 1490 1250 A 23 ALA HA A 40 LYS HE2 1.0 2.5 6.5 1491 1251 A 23 ALA HB% A 40 LYS HB2 1.0 2.5 7.0 1492 1252 A 23 ALA HB% A 40 LYS HDx 1.0 2.5 4.7 1493 1252 A 23 ALA HB% A 40 LYS HDy 1.0 2.5 4.7 1494 1253 A 23 ALA HA A 40 LYS HA 1.0 2.2 3.4 1495 1254 A 23 ALA HB% A 40 LYS HA 1.0 2.2 3.9 1496 1255 A 23 ALA HB% A 40 LYS HB3 1.0 2.2 3.9 1497 1256 A 43 VAL HG1% A 23 ALA HB% 1.0 2.2 4.4 1498 1257 A 23 ALA HB% A 43 VAL HG2% 1.0 2.5 6.5 1499 1258 A 24 ALA H A 24 ALA HB% 1.0 2.5 7.0 1500 1259 A 24 ALA HB% A 25 GLN HG3 1.0 2.5 7.0 1501 1260 A 24 ALA HB% A 25 GLN HB2 1.0 2.5 7.0 1502 1261 A 24 ALA HA A 25 GLN HB2 1.0 2.5 6.5 1503 1262 A 24 ALA HB% A 25 GLN HA 1.0 2.2 3.9 1504 1263 A 43 VAL HG1% A 24 ALA HA 1.0 2.2 3.9 1505 1264 A 24 ALA HB% A 43 VAL HG2% 1.0 2.2 4.4 1506 1265 A 24 ALA HB% A 80 PRO HB2 1.0 2.5 6.0 1507 1266 A 24 ALA HB% A 80 PRO HG2 1.0 2.5 6.0 1508 1267 A 24 ALA HB% A 80 PRO HD2 1.0 3.0 4.7 1509 1268 A 24 ALA HB% A 80 PRO HA 1.0 2.2 3.9 1510 1269 A 24 ALA HB% A 81 VAL HG2% 1.0 2.5 7.5 1511 1270 A 24 ALA HB% A 81 VAL HG1% 1.0 2.5 7.5 1512 1271 A 24 ALA HA A 81 VAL HA 1.0 2.5 4.7 1513 1272 A 24 ALA HB% A 81 VAL HA 1.0 2.5 4.7 1514 1273 A 24 ALA HA A 81 VAL HG2% 1.0 2.5 7.0 1515 1274 A 25 GLN HA A 25 GLN HG3 1.0 2.2 3.4 1516 1275 A 25 GLN HA A 25 GLN HG2 1.0 2.2 3.4 1517 1276 A 25 GLN HB2 A 26 CYS HA 1.0 2.5 6.5 1518 1277 A 26 CYS HB3 A 25 GLN HB2 1.0 2.5 6.5 1519 1278 A 25 GLN HA A 27 ARG HB3 1.0 2.5 5.5 1520 1279 A 25 GLN HA A 80 PRO HB3 1.0 2.5 6.5 1521 1280 A 25 GLN HA A 80 PRO HG2 1.0 2.5 4.7 1522 1281 A 25 GLN HG3 A 80 PRO HD3 1.0 2.5 4.7 1523 1282 A 25 GLN HG3 A 80 PRO HG2 1.0 2.5 6.5 1524 1283 A 25 GLN HG2 A 80 PRO HB2 1.0 2.5 6.5 1525 1284 A 25 GLN HB2 A 80 PRO HG3 1.0 2.2 3.4 1526 1285 A 25 GLN HG2 A 80 PRO HG2 1.0 2.5 6.5 1527 1286 A 25 GLN H A 81 VAL HG1% 1.0 2.5 7.0 1528 1287 A 26 CYS HA A 27 ARG HG3 1.0 2.5 6.5 1529 1288 A 26 CYS HB3 A 28 ASN HB3 1.0 2.5 6.5 1530 1289 A 26 CYS HB3 A 36 CYS HB3 1.0 2.5 6.5 1531 1290 A 26 CYS HB3 A 40 LYS HDx 1.0 2.5 6.5 1532 1290 A 26 CYS HB3 A 40 LYS HDy 1.0 2.5 6.5 1533 1291 A 26 CYS HB3 A 40 LYS HE3 1.0 2.5 4.2 1534 1292 A 26 CYS HB3 A 40 LYS HE2 1.0 2.5 5.5 1535 1293 A 27 ARG HA A 27 ARG HD2 1.0 2.5 4.2 1536 1293 A 27 ARG HA A 27 ARG HD3 1.0 2.5 4.2 1537 1294 A 27 ARG HB3 A 27 ARG HD2 1.0 2.2 3.9 1538 1294 A 27 ARG HB3 A 27 ARG HD3 1.0 2.2 3.9 1539 1295 A 27 ARG HB2 A 27 ARG HD2 1.0 2.5 4.7 1540 1295 A 27 ARG HD3 A 27 ARG HB2 1.0 2.5 4.7 1541 1296 A 27 ARG HA A 27 ARG HG2 1.0 2.5 5.5 1542 1297 A 27 ARG HA A 27 ARG HG3 1.0 2.5 5.5 1543 1298 A 27 ARG HA A 28 ASN HB3 1.0 2.5 4.2 1544 1299 A 27 ARG HA A 28 ASN HB2 1.0 2.5 4.7 1545 1300 A 27 ARG HA A 40 LYS HE3 1.0 2.5 4.7 1546 1301 A 28 ASN HB2 A 30 ASN HB2 1.0 2.5 6.5 1547 1302 A 28 ASN HB3 A 31 CYS HB3 1.0 2.2 3.4 1548 1303 A 28 ASN HB3 A 31 CYS HB2 1.0 2.2 3.4 1549 1304 A 28 ASN HB2 A 31 CYS HB3 1.0 2.5 5.5 1550 1305 A 28 ASN HB2 A 31 CYS HB2 1.0 2.5 5.5 1551 1306 A 28 ASN HB2 A 31 CYS HA 1.0 2.5 6.5 1552 1307 A 29 ALA HA A 30 ASN HA 1.0 2.5 4.7 1553 1308 A 29 ALA HB% A 30 ASN HA 1.0 2.5 6.0 1554 1309 A 29 ALA HA A 37 GLN HG2 1.0 2.5 5.5 1555 1310 A 29 ALA HA A 40 LYS HE3 1.0 2.5 6.5 1556 1311 A 29 ALA HB% A 40 LYS HDx 1.0 3.3 5.2 1557 1311 A 29 ALA HB% A 40 LYS HDy 1.0 3.3 5.2 1558 1312 A 30 ASN HA A 31 CYS HB3 1.0 2.5 4.7 1559 1313 A 31 CYS HA A 30 ASN HA 1.0 2.5 5.5 1560 1314 A 30 ASN HA A 34 PRO HGy 1.0 2.5 6.5 1561 1315 A 30 ASN HA A 34 PRO HGx 1.0 2.5 6.5 1562 1316 A 30 ASN HA A 37 GLN HG2 1.0 2.5 6.5 1563 1317 A 31 CYS HB3 A 36 CYS HB2 1.0 2.5 4.2 1564 1318 A 31 CYS HA A 36 CYS HB3 1.0 2.5 6.5 1565 1319 A 31 CYS HB2 A 36 CYS HB2 1.0 2.5 5.5 1566 1320 A 31 CYS HB3 A 37 GLN HA 1.0 2.5 6.5 1567 1321 A 31 CYS HB3 A 37 GLN HG3 1.0 2.2 3.4 1568 1322 A 31 CYS HB2 A 40 LYS HE3 1.0 2.5 6.5 1569 1323 A 32 SER HA A 33 LEU HA 1.0 2.5 6.5 1570 1324 A 32 SER HA A 33 LEU HG 1.0 3.0 6.5 1571 1325 A 32 SER HA A 34 PRO HA 1.0 2.8 6.0 1572 1326 A 32 SER HA A 34 PRO HD2 1.0 2.5 4.2 1573 1326 A 32 SER HA A 34 PRO HD3 1.0 2.5 4.2 1574 1327 A 32 SER HA A 37 GLN HG2 1.0 2.5 6.5 1575 1328 A 32 SER HA A 37 GLN HG3 1.0 2.5 5.5 1576 1329 A 33 LEU HD1% A 33 LEU HA 1.0 2.2 3.9 1577 1330 A 33 LEU HA A 33 LEU HD2% 1.0 2.2 3.9 1578 1331 A 33 LEU HG A 33 LEU HA 1.0 2.2 3.4 1579 1332 A 33 LEU HD1% A 33 LEU HB2 1.0 2.2 3.9 1580 1333 A 33 LEU HB2 A 33 LEU HD2% 1.0 2.2 3.9 1581 1334 A 33 LEU HD1% A 33 LEU HB3 1.0 2.2 3.9 1582 1335 A 33 LEU HB3 A 33 LEU HD2% 1.0 2.2 3.9 1583 1336 A 33 LEU HA A 34 PRO HB3 1.0 2.5 6.5 1584 1337 A 33 LEU HA A 34 PRO HA 1.0 3.0 4.7 1585 1338 A 33 LEU HA A 34 PRO HD2 1.0 2.2 3.9 1586 1338 A 33 LEU HA A 34 PRO HD3 1.0 2.2 3.9 1587 1339 A 33 LEU HB2 A 34 PRO HD2 1.0 2.5 6.0 1588 1339 A 33 LEU HB2 A 34 PRO HD3 1.0 2.5 6.0 1589 1340 A 33 LEU HD2% A 34 PRO HD2 1.0 2.5 7.5 1590 1340 A 33 LEU HD2% A 34 PRO HD3 1.0 2.5 7.5 1591 1341 A 33 LEU HB3 A 34 PRO HD2 1.0 2.5 4.7 1592 1341 A 33 LEU HB3 A 34 PRO HD3 1.0 2.5 4.7 1593 1342 A 33 LEU HA A 34 PRO HB2 1.0 2.5 6.5 1594 1343 A 33 LEU HB3 A 34 PRO HA 1.0 2.8 6.0 1595 1344 A 33 LEU HD2% A 34 PRO HD2 1.0 2.5 6.0 1596 1345 A 33 LEU HB2 A 34 PRO HGy 1.0 2.5 6.5 1597 1346 A 33 LEU HB3 A 35 SER HA 1.0 2.5 6.5 1598 1347 A 33 LEU HA A 36 CYS HA 1.0 3.0 6.0 1599 1348 A 36 CYS HB3 A 33 LEU HB3 1.0 2.5 5.5 1600 1349 A 33 LEU HB2 A 36 CYS HB3 1.0 2.5 6.5 1601 1350 A 33 LEU HB2 A 36 CYS HB2 1.0 2.5 5.5 1602 1351 A 33 LEU HG A 36 CYS HB2 1.0 2.5 5.5 1603 1352 A 33 LEU HD1% A 36 CYS HB3 1.0 2.5 4.7 1604 1353 A 33 LEU HD1% A 36 CYS HB2 1.0 3.0 4.7 1605 1354 A 33 LEU HD2% A 36 CYS HB2 1.0 2.5 7.0 1606 1355 A 33 LEU HB3 A 36 CYS HA 1.0 2.5 4.7 1607 1356 A 33 LEU HD1% A 36 CYS HA 1.0 2.5 4.7 1608 1357 A 33 LEU HD2% A 36 CYS HA 1.0 3.0 4.7 1609 1358 A 36 CYS HB3 A 33 LEU HD2% 1.0 2.5 7.0 1610 1359 A 34 PRO HA A 34 PRO HD2 1.0 2.2 3.9 1611 1359 A 34 PRO HA A 34 PRO HD3 1.0 2.2 3.9 1612 1360 A 34 PRO HB3 A 34 PRO HD2 1.0 2.5 7.0 1613 1360 A 34 PRO HB3 A 34 PRO HD3 1.0 2.5 7.0 1614 1361 A 34 PRO HB2 A 34 PRO HD2 1.0 2.2 3.9 1615 1361 A 34 PRO HB2 A 34 PRO HD3 1.0 2.2 3.9 1616 1362 A 34 PRO HA A 34 PRO HGx 1.0 2.2 3.9 1617 1362 A 34 PRO HGy A 34 PRO HA 1.0 2.2 3.9 1618 1363 A 34 PRO HGy A 34 PRO HA 1.0 2.5 6.5 1619 1364 A 34 PRO HB3 A 35 SER HA 1.0 2.5 5.5 1620 1365 A 34 PRO HB2 A 35 SER HA 1.0 2.5 6.5 1621 1366 A 34 PRO HA A 35 SER HA 1.0 2.5 6.5 1622 1367 A 34 PRO HB2 A 35 SER HB2 1.0 3.0 4.7 1623 1367 A 34 PRO HB2 A 35 SER HB3 1.0 3.0 4.7 1624 1368 A 34 PRO HA A 37 GLN HG3 1.0 2.2 3.4 1625 1369 A 34 PRO HA A 37 GLN HG2 1.0 2.2 3.4 1626 1370 A 34 PRO HGx A 37 GLN HG3 1.0 2.5 5.0 1627 1371 A 34 PRO HD3 A 37 GLN HG3 1.0 2.2 3.9 1628 1371 A 34 PRO HD2 A 37 GLN HG3 1.0 2.2 3.9 1629 1372 A 34 PRO HB3 A 37 GLN HG3 1.0 2.5 4.2 1630 1373 A 34 PRO HB3 A 37 GLN HBx 1.0 2.2 3.4 1631 1373 A 34 PRO HB3 A 37 GLN HBy 1.0 2.2 3.4 1632 1374 A 34 PRO HB2 A 38 LYS HB2 1.0 2.5 5.5 1633 1375 A 34 PRO HA A 38 LYS HB3 1.0 2.5 7.0 1634 1376 A 34 PRO HA A 38 LYS HB2 1.0 3.0 4.7 1635 1377 A 34 PRO HA A 38 LYS HG3 1.0 2.5 7.0 1636 1378 A 34 PRO HA A 38 LYS HG2 1.0 2.5 7.0 1637 1379 A 35 SER HA A 38 LYS HB2 1.0 2.5 6.0 1638 1379 A 35 SER HA A 38 LYS HB3 1.0 2.5 6.0 1639 1380 A 35 SER HA A 38 LYS HDx 1.0 2.5 6.0 1640 1380 A 38 LYS HDy A 35 SER HA 1.0 2.5 6.0 1641 1381 A 38 LYS HA A 35 SER HA 1.0 3.0 4.7 1642 1382 A 35 SER HA A 38 LYS HB3 1.0 2.2 3.4 1643 1383 A 36 CYS HA A 37 GLN HA 1.0 2.5 6.5 1644 1384 A 36 CYS HB2 A 37 GLN HA 1.0 2.5 6.5 1645 1385 A 36 CYS HB2 A 37 GLN HG3 1.0 2.5 6.5 1646 1386 A 36 CYS HB3 A 37 GLN HG3 1.0 3.0 4.7 1647 1387 A 36 CYS HB3 A 37 GLN HA 1.0 2.5 6.5 1648 1388 A 36 CYS HA A 38 LYS HB3 1.0 2.5 6.5 1649 1389 A 36 CYS HA A 39 MET HG2 1.0 2.5 5.5 1650 1390 A 39 MET HB2 A 36 CYS HB3 1.0 3.0 6.0 1651 1391 A 39 MET HB2 A 36 CYS HB2 1.0 2.5 6.5 1652 1392 A 39 MET HB3 A 36 CYS HA 1.0 2.5 5.5 1653 1393 A 36 CYS HB3 A 40 LYS HE3 1.0 2.2 3.4 1654 1394 A 37 GLN HG2 A 37 GLN HA 1.0 2.2 3.4 1655 1395 A 37 GLN HA A 37 GLN HG3 1.0 2.2 3.4 1656 1396 A 37 GLN HA A 38 LYS HB3 1.0 3.0 4.7 1657 1397 A 38 LYS HA A 37 GLN HBx 1.0 2.2 3.4 1658 1397 A 37 GLN HBy A 38 LYS HA 1.0 2.2 3.4 1659 1398 A 38 LYS HB3 A 37 GLN HBx 1.0 2.5 6.5 1660 1398 A 37 GLN HBy A 38 LYS HB3 1.0 2.5 6.5 1661 1399 A 37 GLN HBx A 38 LYS HB2 1.0 2.5 6.5 1662 1399 A 37 GLN HBy A 38 LYS HB2 1.0 2.5 6.5 1663 1400 A 39 MET HB2 A 37 GLN HA 1.0 2.5 5.5 1664 1401 A 37 GLN HA A 40 LYS HB3 1.0 2.2 3.4 1665 1402 A 37 GLN HA A 40 LYS HDx 1.0 2.5 6.5 1666 1402 A 37 GLN HA A 40 LYS HDy 1.0 2.5 6.5 1667 1403 A 40 LYS HDy A 37 GLN HG3 1.0 3.0 4.7 1668 1403 A 37 GLN HG3 A 40 LYS HDx 1.0 3.0 4.7 1669 1404 A 37 GLN HA A 41 ARG HG3 1.0 2.2 3.4 1670 1405 A 37 GLN HA A 41 ARG HB2 1.0 2.5 4.2 1671 1406 A 38 LYS HA A 38 LYS HG3 1.0 2.2 3.4 1672 1407 A 38 LYS HG2 A 38 LYS HA 1.0 2.2 3.4 1673 1408 A 38 LYS HA A 38 LYS HEx 1.0 2.5 6.5 1674 1408 A 38 LYS HEy A 38 LYS HA 1.0 2.5 6.5 1675 1409 A 38 LYS HA A 38 LYS HDx 1.0 2.2 3.4 1676 1409 A 38 LYS HDy A 38 LYS HA 1.0 2.2 3.4 1677 1410 A 38 LYS HEy A 38 LYS HG2 1.0 2.2 3.4 1678 1410 A 38 LYS HG2 A 38 LYS HEx 1.0 2.2 3.4 1679 1411 A 38 LYS HEy A 38 LYS HB3 1.0 2.2 3.4 1680 1411 A 38 LYS HB3 A 38 LYS HEx 1.0 2.2 3.4 1681 1412 A 38 LYS HEx A 38 LYS HG3 1.0 2.2 3.4 1682 1412 A 38 LYS HEy A 38 LYS HG3 1.0 2.2 3.4 1683 1413 A 38 LYS HEy A 38 LYS HB2 1.0 2.2 3.4 1684 1413 A 38 LYS HB2 A 38 LYS HEx 1.0 2.2 3.4 1685 1414 A 38 LYS HDy A 38 LYS HB3 1.0 2.2 3.4 1686 1414 A 38 LYS HB3 A 38 LYS HDx 1.0 2.2 3.4 1687 1415 A 38 LYS HDy A 38 LYS HB2 1.0 2.5 5.5 1688 1415 A 38 LYS HB2 A 38 LYS HDx 1.0 2.5 5.5 1689 1416 A 38 LYS HG2 A 39 MET HA 1.0 2.5 6.5 1690 1417 A 39 MET HA A 38 LYS HDx 1.0 2.5 4.7 1691 1417 A 38 LYS HDy A 39 MET HA 1.0 2.5 4.7 1692 1418 A 39 MET HG2 A 38 LYS HEx 1.0 3.0 4.7 1693 1418 A 38 LYS HEy A 39 MET HG2 1.0 3.0 4.7 1694 1419 A 39 MET HB2 A 38 LYS HB3 1.0 3.0 4.7 1695 1420 A 39 MET HB3 A 38 LYS HG2 1.0 2.5 6.5 1696 1421 A 39 MET HG2 A 38 LYS HG3 1.0 3.0 4.7 1697 1422 A 39 MET HA A 38 LYS HG3 1.0 2.2 3.4 1698 1423 A 39 MET HB2 A 38 LYS HG2 1.0 3.0 4.7 1699 1424 A 38 LYS HA A 41 ARG HD2 1.0 2.2 3.9 1700 1424 A 41 ARG HD3 A 38 LYS HA 1.0 2.2 3.9 1701 1425 A 38 LYS HA A 41 ARG HA 1.0 3.0 5.5 1702 1426 A 38 LYS HA A 41 ARG HB2 1.0 2.5 4.2 1703 1427 A 38 LYS HA A 41 ARG HB3 1.0 2.5 4.2 1704 1428 A 41 ARG HB3 A 38 LYS HG3 1.0 3.0 4.7 1705 1429 A 41 ARG HB2 A 38 LYS HG3 1.0 2.5 6.5 1706 1430 A 41 ARG HB2 A 38 LYS HB3 1.0 3.0 4.7 1707 1431 A 38 LYS HG2 A 41 ARG HB2 1.0 2.5 6.5 1708 1432 A 38 LYS HA A 42 VAL HG2% 1.0 2.5 7.0 1709 1433 A 42 VAL HB A 38 LYS HG3 1.0 2.2 3.4 1710 1434 A 42 VAL HG1% A 38 LYS HG2 1.0 3.0 4.7 1711 1435 A 39 MET HA A 39 MET HG2 1.0 2.5 6.5 1712 1436 A 39 MET HA A 39 MET HG3 1.0 2.5 4.2 1713 1437 A 39 MET HE1 A 39 MET HA 1.0 2.2 3.9 1714 1438 A 39 MET HE1 A 39 MET HG3 1.0 2.2 3.9 1715 1439 A 39 MET HE1 A 39 MET HG2 1.0 2.2 3.9 1716 1440 A 39 MET HE1 A 39 MET HB3 1.0 2.2 3.9 1717 1441 A 39 MET HB2 A 40 LYS HE3 1.0 2.5 6.5 1718 1442 A 39 MET HA A 40 LYS HB2 1.0 2.5 5.5 1719 1443 A 39 MET HB2 A 40 LYS HB2 1.0 2.2 3.4 1720 1444 A 39 MET HB2 A 40 LYS HDx 1.0 2.5 5.5 1721 1444 A 39 MET HB2 A 40 LYS HDy 1.0 2.5 5.5 1722 1445 A 39 MET HB2 A 40 LYS HGx 1.0 3.0 5.0 1723 1445 A 39 MET HB2 A 40 LYS HGy 1.0 3.0 5.0 1724 1446 A 39 MET HA A 41 ARG HB2 1.0 2.5 6.5 1725 1447 A 39 MET HA A 42 VAL HG2% 1.0 2.5 7.0 1726 1448 A 39 MET HA A 42 VAL HB 1.0 2.2 3.4 1727 1449 A 42 VAL HG1% A 39 MET HA 1.0 2.5 4.7 1728 1450 A 39 MET HB3 A 42 VAL HB 1.0 3.0 4.7 1729 1451 A 39 MET HE1 A 42 VAL HA 1.0 2.5 7.0 1730 1452 A 39 MET HE1 A 42 VAL HB 1.0 2.5 6.0 1731 1453 A 39 MET HE1 A 42 VAL HG2% 1.0 3.0 5.5 1732 1454 A 39 MET HA A 43 VAL HG2% 1.0 2.5 7.0 1733 1455 A 39 MET HA A 66 LEU HD2% 1.0 4.0 6.7 1734 1456 A 39 MET HG2 A 66 LEU HD2% 1.0 3.5 6.7 1735 1457 A 39 MET HG3 A 66 LEU HD2% 1.0 3.5 6.7 1736 1458 A 40 LYS HB3 A 40 LYS HDx 1.0 2.5 4.2 1737 1458 A 40 LYS HB3 A 40 LYS HDy 1.0 2.5 4.2 1738 1459 A 40 LYS HB2 A 40 LYS HDx 1.0 2.5 6.5 1739 1459 A 40 LYS HB2 A 40 LYS HDy 1.0 2.5 6.5 1740 1460 A 40 LYS HB2 A 40 LYS HE3 1.0 2.5 6.5 1741 1461 A 40 LYS HE2 A 40 LYS HB2 1.0 2.5 6.5 1742 1462 A 40 LYS HA A 40 LYS HDx 1.0 2.5 6.5 1743 1462 A 40 LYS HA A 40 LYS HDy 1.0 2.5 6.5 1744 1463 A 40 LYS HE2 A 40 LYS HGy 1.0 2.5 5.5 1745 1463 A 40 LYS HE2 A 40 LYS HGx 1.0 2.5 5.5 1746 1464 A 40 LYS HGy A 40 LYS HE3 1.0 2.5 6.5 1747 1464 A 40 LYS HE3 A 40 LYS HGx 1.0 2.5 6.5 1748 1465 A 40 LYS HA A 40 LYS HGx 1.0 2.2 3.9 1749 1465 A 40 LYS HA A 40 LYS HGy 1.0 2.2 3.9 1750 1466 A 40 LYS HB3 A 41 ARG HA 1.0 2.5 6.5 1751 1467 A 40 LYS HB2 A 41 ARG HB2 1.0 2.5 6.5 1752 1468 A 40 LYS HA A 41 ARG HB2 1.0 2.5 5.5 1753 1469 A 40 LYS HB3 A 41 ARG HG3 1.0 2.5 4.2 1754 1470 A 40 LYS HDy A 41 ARG HG3 1.0 2.5 6.5 1755 1470 A 40 LYS HDx A 41 ARG HG3 1.0 2.5 6.5 1756 1471 A 40 LYS HA A 42 VAL HB 1.0 2.5 5.5 1757 1472 A 43 VAL HG1% A 40 LYS HA 1.0 2.5 4.7 1758 1473 A 40 LYS HA A 43 VAL HB 1.0 3.0 4.7 1759 1474 A 40 LYS HA A 43 VAL HG2% 1.0 2.5 6.0 1760 1475 A 40 LYS HGx A 44 GLN HGx 1.0 3.0 4.2 1761 1475 A 44 GLN HGy A 40 LYS HGx 1.0 3.0 4.2 1762 1475 A 40 LYS HGy A 44 GLN HGy 1.0 3.0 4.2 1763 1475 A 40 LYS HGy A 44 GLN HGx 1.0 3.0 4.2 1764 1476 A 40 LYS HDy A 44 GLN HGx 1.0 2.5 5.5 1765 1476 A 40 LYS HDx A 44 GLN HGx 1.0 2.5 5.5 1766 1476 A 44 GLN HGy A 40 LYS HDx 1.0 2.5 5.5 1767 1476 A 40 LYS HDy A 44 GLN HGy 1.0 2.5 5.5 1768 1477 A 40 LYS HB2 A 44 GLN HBx 1.0 2.5 6.5 1769 1477 A 40 LYS HB2 A 44 GLN HBy 1.0 2.5 6.5 1770 1478 A 41 ARG HA A 41 ARG HD2 1.0 2.2 3.9 1771 1478 A 41 ARG HD3 A 41 ARG HA 1.0 2.2 3.9 1772 1479 A 41 ARG HG2 A 41 ARG HA 1.0 2.2 3.4 1773 1480 A 41 ARG HA A 41 ARG HG3 1.0 2.2 3.4 1774 1481 A 41 ARG HB2 A 41 ARG HD2 1.0 2.5 4.7 1775 1481 A 41 ARG HD3 A 41 ARG HB2 1.0 2.5 4.7 1776 1482 A 41 ARG HB3 A 41 ARG HD2 1.0 2.5 6.0 1777 1482 A 41 ARG HD3 A 41 ARG HB3 1.0 2.5 6.0 1778 1483 A 41 ARG HB3 A 42 VAL HB 1.0 3.0 4.7 1779 1484 A 41 ARG HB2 A 42 VAL HA 1.0 2.5 6.5 1780 1485 A 42 VAL HG2% A 41 ARG HA 1.0 2.5 7.0 1781 1486 A 42 VAL HG2% A 41 ARG HB2 1.0 2.5 4.7 1782 1487 A 42 VAL HG1% A 41 ARG HB2 1.0 2.5 7.0 1783 1488 A 41 ARG HA A 44 GLN HA 1.0 2.5 6.5 1784 1489 A 41 ARG HA A 44 GLN HGx 1.0 2.5 4.2 1785 1489 A 41 ARG HA A 44 GLN HGy 1.0 2.5 4.2 1786 1490 A 41 ARG HA A 44 GLN HBx 1.0 2.2 3.4 1787 1490 A 41 ARG HA A 44 GLN HBy 1.0 2.2 3.4 1788 1491 A 41 ARG HB3 A 44 GLN HBx 1.0 3.0 4.7 1789 1491 A 41 ARG HB3 A 44 GLN HBy 1.0 3.0 4.7 1790 1492 A 41 ARG HB2 A 44 GLN HBx 1.0 3.0 4.7 1791 1492 A 41 ARG HB2 A 44 GLN HBy 1.0 3.0 4.7 1792 1493 A 44 GLN HBy A 41 ARG HG3 1.0 2.5 6.5 1793 1493 A 41 ARG HG3 A 44 GLN HBx 1.0 2.5 6.5 1794 1494 A 41 ARG HA A 45 HIS HA 1.0 2.5 4.7 1795 1495 A 41 ARG HB3 A 59 ILE HD1% 1.0 2.5 7.0 1796 1496 A 42 VAL HG2% A 42 VAL HA 1.0 2.2 3.9 1797 1497 A 42 VAL HG1% A 42 VAL HA 1.0 2.5 6.0 1798 1498 A 42 VAL HG1% A 42 VAL H 1.0 2.5 7.0 1799 1499 A 42 VAL HG1% A 45 HIS HBx 1.0 2.5 4.7 1800 1499 A 42 VAL HG1% A 45 HIS HBy 1.0 2.5 4.7 1801 1500 A 42 VAL HA A 45 HIS HBx 1.0 2.5 4.2 1802 1501 A 42 VAL HG1% A 45 HIS HBx 1.0 2.5 7.0 1803 1502 A 42 VAL HG2% A 45 HIS HBx 1.0 2.5 7.0 1804 1503 A 45 HIS HBy A 42 VAL HA 1.0 2.5 5.5 1805 1504 A 42 VAL HA A 45 HIS HA 1.0 2.5 6.5 1806 1505 A 42 VAL HG1% A 46 THR HB 1.0 2.5 4.7 1807 1506 A 42 VAL HG2% A 46 THR HG2% 1.0 2.5 7.5 1808 1507 A 42 VAL HG1% A 46 THR HG2% 1.0 2.5 7.5 1809 1508 A 42 VAL HG1% A 59 ILE HG12 1.0 2.5 7.0 1810 1509 A 42 VAL HG1% A 59 ILE HG13 1.0 2.5 7.0 1811 1510 A 42 VAL HG1% A 59 ILE HA 1.0 3.0 4.7 1812 1511 A 42 VAL HG1% A 59 ILE HD1% 1.0 2.5 6.5 1813 1512 A 59 ILE HG12 A 42 VAL HA 1.0 2.5 6.5 1814 1513 A 59 ILE HG2% A 42 VAL HA 1.0 2.5 6.0 1815 1514 A 59 ILE HG2% A 42 VAL HG2% 1.0 2.5 5.2 1816 1515 A 59 ILE HG2% A 42 VAL HB 1.0 2.5 7.0 1817 1516 A 42 VAL HG2% A 59 ILE HD1% 1.0 2.5 7.5 1818 1517 A 42 VAL HG1% A 59 ILE HG2% 1.0 2.5 6.5 1819 1518 A 42 VAL HG1% A 63 LEU HD1% 1.0 2.2 4.4 1820 1519 A 42 VAL HB A 63 LEU HD2% 1.0 2.5 7.0 1821 1520 A 42 VAL HG1% A 63 LEU HD2% 1.0 2.2 4.4 1822 1521 A 42 VAL HG1% A 63 LEU HBx 1.0 2.2 3.9 1823 1521 A 42 VAL HG1% A 63 LEU HBy 1.0 2.2 3.9 1824 1522 A 42 VAL HG1% A 63 LEU HA 1.0 2.5 6.0 1825 1523 A 42 VAL HG1% A 66 LEU HD2% 1.0 2.0 5.2 1826 1524 A 43 VAL HG1% A 43 VAL HA 1.0 2.5 4.2 1827 1525 A 43 VAL HA A 43 VAL HG2% 1.0 2.5 4.2 1828 1526 A 43 VAL HB A 44 GLN HA 1.0 2.5 3.7 1829 1527 A 43 VAL HG1% A 44 GLN HA 1.0 3.0 4.7 1830 1528 A 43 VAL HG1% A 44 GLN HGx 1.0 2.5 7.5 1831 1528 A 43 VAL HG1% A 44 GLN HGy 1.0 2.5 7.5 1832 1529 A 43 VAL HA A 44 GLN HGx 1.0 3.0 4.7 1833 1529 A 43 VAL HA A 44 GLN HGy 1.0 3.0 4.7 1834 1530 A 43 VAL HA A 45 HIS HBy 1.0 2.5 5.5 1835 1531 A 43 VAL HA A 46 THR HB 1.0 2.5 6.5 1836 1532 A 43 VAL HA A 46 THR HG2% 1.0 2.5 6.0 1837 1533 A 43 VAL HG1% A 46 THR HG2% 1.0 2.5 5.2 1838 1534 A 43 VAL HG1% A 47 LYS HE2 1.0 2.2 4.4 1839 1534 A 43 VAL HG1% A 47 LYS HE3 1.0 2.2 4.4 1840 1535 A 43 VAL HA A 47 LYS HBx 1.0 2.5 6.5 1841 1535 A 43 VAL HA A 47 LYS HBy 1.0 2.5 6.5 1842 1536 A 43 VAL HG1% A 47 LYS HBx 1.0 2.5 6.0 1843 1536 A 43 VAL HG1% A 47 LYS HBy 1.0 2.5 6.0 1844 1537 A 43 VAL HB A 47 LYS HD2 1.0 2.5 6.0 1845 1537 A 43 VAL HB A 47 LYS HD3 1.0 2.5 6.0 1846 1538 A 43 VAL HG1% A 47 LYS HD2 1.0 2.5 5.2 1847 1538 A 43 VAL HG1% A 47 LYS HD3 1.0 2.5 5.2 1848 1539 A 43 VAL HG1% A 47 LYS HGy 1.0 2.5 5.2 1849 1539 A 43 VAL HG1% A 47 LYS HGx 1.0 2.5 5.2 1850 1540 A 43 VAL HB A 63 LEU HD2% 1.0 2.5 6.0 1851 1541 A 43 VAL HA A 63 LEU HD2% 1.0 2.5 7.0 1852 1542 A 63 LEU HD2% A 43 VAL HG2% 1.0 2.2 4.4 1853 1543 A 43 VAL HG2% A 81 VAL HG1% 1.0 2.2 4.4 1854 1544 A 43 VAL HG1% A 82 PRO HB2 1.0 2.5 7.0 1855 1545 A 43 VAL HG1% A 82 PRO HB3 1.0 2.2 3.9 1856 1546 A 44 GLN HA A 44 GLN HGx 1.0 2.2 3.4 1857 1546 A 44 GLN HGy A 44 GLN HA 1.0 2.2 3.4 1858 1547 A 44 GLN HA A 45 HIS HA 1.0 2.5 6.5 1859 1548 A 45 HIS HA A 44 GLN HBx 1.0 2.5 6.5 1860 1548 A 44 GLN HBy A 45 HIS HA 1.0 2.5 6.5 1861 1549 A 44 GLN HA A 47 LYS HA 1.0 3.0 6.0 1862 1550 A 44 GLN HA A 47 LYS HGy 1.0 2.5 6.5 1863 1550 A 44 GLN HA A 47 LYS HGx 1.0 2.5 6.5 1864 1551 A 44 GLN HA A 47 LYS HBx 1.0 2.5 3.7 1865 1551 A 44 GLN HA A 47 LYS HBy 1.0 2.5 3.7 1866 1552 A 44 GLN HA A 47 LYS HE2 1.0 3.0 6.5 1867 1552 A 44 GLN HA A 47 LYS HE3 1.0 3.0 6.5 1868 1553 A 44 GLN HA A 47 LYS HD2 1.0 3.0 4.7 1869 1553 A 44 GLN HA A 47 LYS HD3 1.0 3.0 4.7 1870 1554 A 44 GLN HGy A 47 LYS HD2 1.0 2.5 4.7 1871 1554 A 47 LYS HD3 A 44 GLN HGx 1.0 2.5 4.7 1872 1554 A 44 GLN HGy A 47 LYS HD3 1.0 2.5 4.7 1873 1554 A 44 GLN HGx A 47 LYS HD2 1.0 2.5 4.7 1874 1555 A 44 GLN HBy A 47 LYS HBx 1.0 2.5 6.5 1875 1555 A 44 GLN HBx A 47 LYS HBx 1.0 2.5 6.5 1876 1555 A 47 LYS HBy A 44 GLN HBx 1.0 2.5 6.5 1877 1555 A 44 GLN HBy A 47 LYS HBy 1.0 2.5 6.5 1878 1556 A 45 HIS HA A 46 THR HB 1.0 3.0 5.2 1879 1557 A 45 HIS HA A 49 CYS HB2 1.0 2.5 5.5 1880 1558 A 45 HIS HA A 49 CYS HB3 1.0 2.5 4.7 1881 1558 A 45 HIS HA A 49 CYS HB2 1.0 2.5 4.7 1882 1559 A 59 ILE HG12 A 45 HIS HBx 1.0 2.5 6.5 1883 1559 A 59 ILE HG12 A 45 HIS HBy 1.0 2.5 6.5 1884 1560 A 59 ILE HG2% A 45 HIS HBx 1.0 2.5 7.0 1885 1560 A 59 ILE HG2% A 45 HIS HBy 1.0 2.5 7.0 1886 1561 A 46 THR HG2% A 46 THR HA 1.0 2.5 4.7 1887 1562 A 46 THR HA A 47 LYS HBx 1.0 2.5 6.5 1888 1562 A 46 THR HA A 47 LYS HBy 1.0 2.5 6.5 1889 1563 A 46 THR HB A 47 LYS HGy 1.0 2.5 4.7 1890 1563 A 46 THR HB A 47 LYS HGx 1.0 2.5 4.7 1891 1564 A 46 THR HG2% A 47 LYS HA 1.0 2.5 7.0 1892 1565 A 46 THR HA A 47 LYS HA 1.0 2.5 6.5 1893 1566 A 46 THR HG2% A 47 LYS HBx 1.0 2.5 6.5 1894 1566 A 46 THR HG2% A 47 LYS HBy 1.0 2.5 6.5 1895 1567 A 46 THR HG2% A 49 CYS HB3 1.0 2.5 7.5 1896 1567 A 46 THR HG2% A 49 CYS HB2 1.0 2.5 7.5 1897 1568 A 46 THR HA A 49 CYS HB3 1.0 2.5 4.2 1898 1569 A 46 THR HA A 49 CYS HA 1.0 2.5 6.5 1899 1570 A 46 THR HA A 49 CYS HB2 1.0 2.2 3.4 1900 1571 A 49 CYS H A 46 THR HG2% 1.0 2.5 7.0 1901 1572 A 46 THR HG2% A 52 LYS HE2 1.0 2.5 6.5 1902 1572 A 46 THR HG2% A 52 LYS HE3 1.0 2.5 6.5 1903 1573 A 46 THR HA A 52 LYS HE2 1.0 2.2 3.9 1904 1573 A 46 THR HA A 52 LYS HE3 1.0 2.2 3.9 1905 1574 A 46 THR HB A 52 LYS HE2 1.0 2.2 3.9 1906 1574 A 46 THR HB A 52 LYS HE3 1.0 2.2 3.9 1907 1575 A 46 THR HG2% A 52 LYS HG2 1.0 2.2 3.9 1908 1576 A 46 THR HA A 52 LYS HG3 1.0 2.5 5.5 1909 1577 A 46 THR HG2% A 52 LYS HD2 1.0 2.5 7.0 1910 1578 A 46 THR HG2% A 52 LYS HD3 1.0 2.2 3.9 1911 1579 A 46 THR HG2% A 52 LYS HA 1.0 2.5 7.0 1912 1580 A 46 THR HG2% A 52 LYS HB3 1.0 2.5 7.0 1913 1581 A 46 THR HA A 52 LYS HD3 1.0 2.5 6.5 1914 1582 A 46 THR HA A 52 LYS HD2 1.0 2.5 6.5 1915 1583 A 59 ILE HG12 A 46 THR HB 1.0 2.5 6.5 1916 1584 A 46 THR HG2% A 60 CYS HB3 1.0 2.5 7.0 1917 1585 A 46 THR HG2% A 63 LEU HG 1.0 2.2 3.9 1918 1586 A 46 THR HG2% A 63 LEU HD2% 1.0 2.2 4.4 1919 1587 A 46 THR HG2% A 83 PHE HE% 1.0 2.5 4.7 1920 1588 A 46 THR HG2% A 83 PHE HZ 1.0 2.5 4.7 1921 1589 A 47 LYS HA A 47 LYS HD2 1.0 3.0 4.7 1922 1589 A 47 LYS HD3 A 47 LYS HA 1.0 3.0 4.7 1923 1590 A 47 LYS HA A 47 LYS HGy 1.0 2.2 3.4 1924 1591 A 47 LYS HGx A 47 LYS HA 1.0 2.2 3.4 1925 1592 A 47 LYS HA A 47 LYS HE2 1.0 2.2 3.9 1926 1592 A 47 LYS HA A 47 LYS HE3 1.0 2.2 3.9 1927 1593 A 47 LYS HBy A 47 LYS HE2 1.0 2.5 6.0 1928 1593 A 47 LYS HBx A 47 LYS HE2 1.0 2.5 6.0 1929 1593 A 47 LYS HE3 A 47 LYS HBx 1.0 2.5 6.0 1930 1593 A 47 LYS HBy A 47 LYS HE3 1.0 2.5 6.0 1931 1594 A 47 LYS HBx A 47 LYS HD2 1.0 2.2 3.9 1932 1594 A 47 LYS HBy A 47 LYS HD2 1.0 2.2 3.9 1933 1594 A 47 LYS HD3 A 47 LYS HBx 1.0 2.2 3.9 1934 1594 A 47 LYS HD3 A 47 LYS HBy 1.0 2.2 3.9 1935 1595 A 47 LYS HA A 47 LYS HGy 1.0 2.2 3.4 1936 1595 A 47 LYS HGx A 47 LYS HA 1.0 2.2 3.4 1937 1596 A 47 LYS HE2 A 47 LYS HGy 1.0 2.5 4.7 1938 1596 A 47 LYS HE3 A 47 LYS HGy 1.0 2.5 4.7 1939 1596 A 47 LYS HGx A 47 LYS HE2 1.0 2.5 4.7 1940 1596 A 47 LYS HGx A 47 LYS HE3 1.0 2.5 4.7 1941 1597 A 47 LYS HA A 50 LYS HD2 1.0 2.5 4.7 1942 1597 A 47 LYS HA A 50 LYS HD3 1.0 2.5 4.7 1943 1598 A 47 LYS HA A 52 LYS HD2 1.0 2.2 3.4 1944 1599 A 47 LYS HA A 52 LYS HE2 1.0 2.2 3.9 1945 1599 A 47 LYS HA A 52 LYS HE3 1.0 2.2 3.9 1946 1600 A 47 LYS HBx A 52 LYS HE2 1.0 2.5 7.0 1947 1600 A 47 LYS HBy A 52 LYS HE2 1.0 2.5 7.0 1948 1600 A 52 LYS HE3 A 47 LYS HBx 1.0 2.5 7.0 1949 1600 A 47 LYS HBy A 52 LYS HE3 1.0 2.5 7.0 1950 1601 A 47 LYS HA A 52 LYS HD3 1.0 2.5 4.2 1951 1602 A 47 LYS HGy A 52 LYS HE2 1.0 2.5 7.0 1952 1602 A 47 LYS HGx A 52 LYS HE2 1.0 2.5 7.0 1953 1602 A 52 LYS HE3 A 47 LYS HGy 1.0 2.5 7.0 1954 1602 A 47 LYS HGx A 52 LYS HE3 1.0 2.5 7.0 1955 1603 A 47 LYS HA A 52 LYS HG3 1.0 2.5 5.5 1956 1604 A 63 LEU HD2% A 47 LYS HGy 1.0 2.5 6.0 1957 1604 A 47 LYS HGx A 63 LEU HD2% 1.0 2.5 6.0 1958 1605 A 82 PRO HB3 A 47 LYS HE2 1.0 2.5 7.0 1959 1605 A 47 LYS HE3 A 82 PRO HB3 1.0 2.5 7.0 1960 1606 A 82 PRO HB2 A 47 LYS HE2 1.0 2.5 6.0 1961 1606 A 47 LYS HE3 A 82 PRO HB2 1.0 2.5 6.0 1962 1607 A 82 PRO HB3 A 47 LYS HD2 1.0 2.5 7.0 1963 1607 A 47 LYS HD3 A 82 PRO HB3 1.0 2.5 7.0 1964 1608 A 82 PRO HG3 A 47 LYS HGy 1.0 2.5 6.5 1965 1608 A 47 LYS HGx A 82 PRO HG3 1.0 2.5 6.5 1966 1609 A 82 PRO HG2 A 47 LYS HGy 1.0 2.5 6.5 1967 1609 A 47 LYS HGx A 82 PRO HG2 1.0 2.5 6.5 1968 1610 A 82 PRO HB3 A 47 LYS HGy 1.0 2.2 3.4 1969 1610 A 47 LYS HGx A 82 PRO HB3 1.0 2.2 3.4 1970 1611 A 48 GLY HA3 A 49 CYS HB2 1.0 2.5 5.5 1971 1612 A 49 CYS HA A 50 LYS HB2 1.0 2.5 6.5 1972 1613 A 49 CYS HA A 50 LYS HA 1.0 2.5 6.5 1973 1614 A 51 ARG HA A 49 CYS HB3 1.0 2.5 6.5 1974 1615 A 51 ARG HB2 A 49 CYS HB2 1.0 2.5 6.5 1975 1616 A 52 LYS HA A 49 CYS HB3 1.0 2.5 4.7 1976 1616 A 52 LYS HA A 49 CYS HB2 1.0 2.5 4.7 1977 1617 A 52 LYS HG2 A 49 CYS HB2 1.0 2.2 3.4 1978 1618 A 49 CYS HB3 A 52 LYS HG3 1.0 2.5 7.0 1979 1618 A 49 CYS HB2 A 52 LYS HG3 1.0 2.5 7.0 1980 1619 A 52 LYS HA A 49 CYS HB2 1.0 2.5 6.5 1981 1620 A 49 CYS HA A 52 LYS HG3 1.0 2.5 6.5 1982 1621 A 49 CYS HB3 A 52 LYS HG3 1.0 2.5 6.5 1983 1622 A 57 CYS HB3 A 49 CYS HB3 1.0 3.0 4.7 1984 1622 A 57 CYS HB3 A 49 CYS HB2 1.0 3.0 4.7 1985 1623 A 57 CYS HB3 A 49 CYS HB2 1.0 2.5 4.7 1986 1624 A 57 CYS HB2 A 49 CYS HB3 1.0 3.0 4.7 1987 1624 A 57 CYS HB2 A 49 CYS HB2 1.0 3.0 4.7 1988 1625 A 59 ILE HG2% A 49 CYS HB3 1.0 2.5 7.5 1989 1625 A 59 ILE HG2% A 49 CYS HB2 1.0 2.5 7.5 1990 1626 A 59 ILE HG2% A 49 CYS HB2 1.0 3.0 5.2 1991 1627 A 60 CYS HB2 A 49 CYS HB3 1.0 2.5 7.0 1992 1627 A 60 CYS HB2 A 49 CYS HB2 1.0 2.5 7.0 1993 1628 A 60 CYS HB3 A 49 CYS HB3 1.0 2.5 7.0 1994 1628 A 60 CYS HB3 A 49 CYS HB2 1.0 2.5 7.0 1995 1629 A 50 LYS HA A 50 LYS HE3 1.0 2.5 6.0 1996 1629 A 50 LYS HA A 50 LYS HE2 1.0 2.5 6.0 1997 1630 A 50 LYS HG2 A 50 LYS HA 1.0 2.2 3.4 1998 1631 A 50 LYS HA A 50 LYS HD2 1.0 2.2 3.9 1999 1631 A 50 LYS HD3 A 50 LYS HA 1.0 2.2 3.9 2000 1632 A 50 LYS HG3 A 50 LYS HA 1.0 2.2 3.4 2001 1633 A 50 LYS HG3 A 50 LYS HE3 1.0 2.2 3.9 2002 1633 A 50 LYS HG3 A 50 LYS HE2 1.0 2.2 3.9 2003 1634 A 50 LYS HB3 A 50 LYS HE3 1.0 2.2 3.9 2004 1634 A 50 LYS HB3 A 50 LYS HE2 1.0 2.2 3.9 2005 1635 A 50 LYS HG2 A 50 LYS HE3 1.0 2.2 3.9 2006 1635 A 50 LYS HG2 A 50 LYS HE2 1.0 2.2 3.9 2007 1636 A 50 LYS HB3 A 50 LYS HD2 1.0 3.0 4.7 2008 1636 A 50 LYS HD3 A 50 LYS HB3 1.0 3.0 4.7 2009 1637 A 50 LYS HB2 A 50 LYS HD2 1.0 2.2 3.9 2010 1637 A 50 LYS HD3 A 50 LYS HB2 1.0 2.2 3.9 2011 1638 A 51 ARG HA A 50 LYS HA 1.0 2.5 4.2 2012 1639 A 50 LYS HB3 A 51 ARG HA 1.0 2.5 6.5 2013 1640 A 50 LYS HB2 A 51 ARG HA 1.0 2.5 5.5 2014 1641 A 50 LYS HA A 52 LYS HE2 1.0 2.5 4.7 2015 1641 A 52 LYS HE3 A 50 LYS HA 1.0 2.5 4.7 2016 1642 A 50 LYS HA A 52 LYS HG3 1.0 2.2 3.4 2017 1643 A 50 LYS HB3 A 52 LYS HD2 1.0 3.0 4.7 2018 1644 A 50 LYS HB2 A 52 LYS HG3 1.0 3.0 4.2 2019 1645 A 50 LYS HD3 A 52 LYS HG3 1.0 2.2 3.9 2020 1645 A 50 LYS HD2 A 52 LYS HG3 1.0 2.2 3.9 2021 1646 A 50 LYS HD2 A 52 LYS HE2 1.0 3.0 5.2 2022 1646 A 50 LYS HD3 A 52 LYS HE2 1.0 3.0 5.2 2023 1646 A 52 LYS HE3 A 50 LYS HD2 1.0 3.0 5.2 2024 1646 A 50 LYS HD3 A 52 LYS HE3 1.0 3.0 5.2 2025 1647 A 50 LYS HG2 A 53 THR HA 1.0 2.5 6.0 2026 1648 A 51 ARG HG2 A 51 ARG HA 1.0 2.2 3.4 2027 1649 A 51 ARG HA A 51 ARG HD2 1.0 2.5 4.7 2028 1649 A 51 ARG HD3 A 51 ARG HA 1.0 2.5 4.7 2029 1650 A 51 ARG HD3 A 51 ARG HB3 1.0 2.2 3.9 2030 1650 A 51 ARG HB3 A 51 ARG HD2 1.0 2.2 3.9 2031 1651 A 51 ARG HD3 A 51 ARG HB2 1.0 2.5 4.7 2032 1651 A 51 ARG HB2 A 51 ARG HD2 1.0 2.5 4.7 2033 1652 A 51 ARG HA A 52 LYS HA 1.0 2.5 6.5 2034 1653 A 52 LYS HA A 51 ARG HB3 1.0 2.5 5.5 2035 1654 A 51 ARG HA A 52 LYS HG3 1.0 3.0 4.7 2036 1655 A 51 ARG HA A 54 ASN HBx 1.0 2.5 6.5 2037 1655 A 51 ARG HA A 54 ASN HBy 1.0 2.5 6.5 2038 1656 A 51 ARG HD3 A 54 ASN HBx 1.0 2.2 3.9 2039 1656 A 51 ARG HD2 A 54 ASN HBx 1.0 2.2 3.9 2040 1656 A 54 ASN HBy A 51 ARG HD2 1.0 2.2 3.9 2041 1656 A 51 ARG HD3 A 54 ASN HBy 1.0 2.2 3.9 2042 1657 A 51 ARG HA A 55 GLY HA2 1.0 2.5 7.0 2043 1657 A 51 ARG HA A 55 GLY HA3 1.0 2.5 7.0 2044 1658 A 51 ARG HD2 A 55 GLY HA2 1.0 2.2 4.4 2045 1658 A 51 ARG HD3 A 55 GLY HA2 1.0 2.2 4.4 2046 1658 A 55 GLY HA3 A 51 ARG HD2 1.0 2.2 4.4 2047 1658 A 51 ARG HD3 A 55 GLY HA3 1.0 2.2 4.4 2048 1659 A 52 LYS HA A 52 LYS HG3 1.0 2.5 5.5 2049 1660 A 52 LYS HA A 52 LYS HE2 1.0 2.5 7.0 2050 1660 A 52 LYS HA A 52 LYS HE3 1.0 2.5 7.0 2051 1661 A 52 LYS HD2 A 52 LYS HA 1.0 2.5 5.5 2052 1662 A 52 LYS HA A 52 LYS HD3 1.0 2.5 4.2 2053 1663 A 52 LYS HA A 52 LYS HG2 1.0 2.2 3.4 2054 1664 A 52 LYS HE2 A 52 LYS HG3 1.0 2.2 3.9 2055 1664 A 52 LYS HE3 A 52 LYS HG3 1.0 2.2 3.9 2056 1665 A 52 LYS HB2 A 52 LYS HE2 1.0 2.2 3.9 2057 1665 A 52 LYS HB2 A 52 LYS HE3 1.0 2.2 3.9 2058 1666 A 52 LYS HB3 A 52 LYS HE2 1.0 2.2 3.9 2059 1666 A 52 LYS HB3 A 52 LYS HE3 1.0 2.2 3.9 2060 1667 A 52 LYS HB3 A 52 LYS HD3 1.0 2.5 5.5 2061 1668 A 52 LYS HD2 A 52 LYS HB2 1.0 2.2 3.4 2062 1669 A 52 LYS HB3 A 52 LYS HD2 1.0 3.0 4.2 2063 1670 A 52 LYS HG2 A 52 LYS HE2 1.0 2.5 7.0 2064 1670 A 52 LYS HG2 A 52 LYS HE3 1.0 2.5 7.0 2065 1671 A 52 LYS HA A 53 THR HA 1.0 2.5 6.5 2066 1672 A 52 LYS HB3 A 53 THR HG2% 1.0 2.5 4.7 2067 1673 A 52 LYS HB2 A 53 THR HG2% 1.0 2.5 4.7 2068 1674 A 53 THR HA A 52 LYS HG3 1.0 2.5 6.5 2069 1675 A 52 LYS HG2 A 53 THR HA 1.0 2.5 6.5 2070 1676 A 52 LYS HB2 A 54 ASN HBx 1.0 2.5 6.5 2071 1676 A 52 LYS HB2 A 54 ASN HBy 1.0 2.5 6.5 2072 1677 A 52 LYS HA A 57 CYS HB3 1.0 2.2 3.4 2073 1678 A 52 LYS HA A 60 CYS HB3 1.0 2.2 3.4 2074 1679 A 52 LYS HA A 60 CYS HB2 1.0 2.5 6.5 2075 1680 A 60 CYS HB3 A 52 LYS HE2 1.0 2.2 3.9 2076 1680 A 60 CYS HB3 A 52 LYS HE3 1.0 2.2 3.9 2077 1681 A 60 CYS HB2 A 52 LYS HD3 1.0 3.0 4.7 2078 1682 A 60 CYS HB3 A 52 LYS HG3 1.0 2.5 6.5 2079 1683 A 60 CYS HB3 A 52 LYS HD3 1.0 2.5 6.5 2080 1684 A 52 LYS HG2 A 60 CYS HB3 1.0 2.5 6.5 2081 1685 A 60 CYS HB2 A 52 LYS HG3 1.0 2.5 6.5 2082 1686 A 64 ILE HD1% A 52 LYS HG3 1.0 2.5 7.0 2083 1687 A 53 THR HG2% A 53 THR HA 1.0 2.2 3.9 2084 1688 A 53 THR HA A 54 ASN HBx 1.0 2.5 7.0 2085 1688 A 53 THR HA A 54 ASN HBy 1.0 2.5 7.0 2086 1689 A 53 THR HA A 56 GLY HA2 1.0 2.2 3.9 2087 1689 A 53 THR HA A 56 GLY HA3 1.0 2.2 3.9 2088 1690 A 53 THR HA A 60 CYS HB3 1.0 3.0 4.7 2089 1691 A 53 THR HG2% A 60 CYS HB3 1.0 2.2 3.9 2090 1692 A 53 THR HG2% A 61 LYS HA 1.0 2.5 6.0 2091 1693 A 53 THR HG2% A 61 LYS HEx 1.0 2.2 3.9 2092 1693 A 53 THR HG2% A 61 LYS HEy 1.0 2.2 3.9 2093 1694 A 53 THR HA A 61 LYS HEx 1.0 2.2 3.4 2094 1694 A 53 THR HA A 61 LYS HEy 1.0 2.2 3.4 2095 1695 A 53 THR HG2% A 61 LYS HB3 1.0 2.5 7.0 2096 1696 A 53 THR HG2% A 61 LYS HG2 1.0 2.5 7.0 2097 1697 A 53 THR HG2% A 61 LYS HG3 1.0 2.5 6.0 2098 1698 A 53 THR HG2% A 61 LYS HDx 1.0 3.0 4.7 2099 1698 A 53 THR HG2% A 61 LYS HDy 1.0 3.0 4.7 2100 1699 A 53 THR HG2% A 64 ILE HG13 1.0 2.2 3.9 2101 1700 A 53 THR HG2% A 64 ILE HD1% 1.0 2.2 4.4 2102 1701 A 53 THR HG2% A 64 ILE HG2% 1.0 2.2 4.4 2103 1702 A 54 ASN HBx A 55 GLY HA2 1.0 2.5 6.0 2104 1702 A 54 ASN HBy A 55 GLY HA2 1.0 2.5 6.0 2105 1702 A 55 GLY HA3 A 54 ASN HBx 1.0 2.5 6.0 2106 1702 A 54 ASN HBy A 55 GLY HA3 1.0 2.5 6.0 2107 1703 A 57 CYS HA A 56 GLY HA2 1.0 2.2 3.9 2108 1703 A 56 GLY HA3 A 57 CYS HA 1.0 2.2 3.9 2109 1704 A 56 GLY HA3 A 61 LYS HEx 1.0 2.2 3.9 2110 1704 A 56 GLY HA2 A 61 LYS HEx 1.0 2.2 3.9 2111 1704 A 61 LYS HEy A 56 GLY HA2 1.0 2.2 3.9 2112 1704 A 56 GLY HA3 A 61 LYS HEy 1.0 2.2 3.9 2113 1705 A 56 GLY HA2 A 61 LYS HG3 1.0 2.5 7.0 2114 1705 A 56 GLY HA3 A 61 LYS HG3 1.0 2.5 7.0 2115 1706 A 57 CYS HA A 58 PRO HG3 1.0 2.5 5.5 2116 1707 A 57 CYS HA A 58 PRO HA 1.0 2.5 6.5 2117 1708 A 59 ILE HG2% A 57 CYS HA 1.0 2.5 7.0 2118 1709 A 57 CYS HA A 61 LYS HEx 1.0 2.5 5.0 2119 1709 A 57 CYS HA A 61 LYS HEy 1.0 2.5 5.0 2120 1710 A 58 PRO HB2 A 58 PRO HD2 1.0 3.0 4.2 2121 1711 A 58 PRO HB3 A 58 PRO HD2 1.0 2.5 4.2 2122 1712 A 58 PRO HA A 58 PRO HD3 1.0 2.5 6.5 2123 1713 A 58 PRO HA A 58 PRO HG3 1.0 3.0 4.2 2124 1714 A 58 PRO HA A 58 PRO HG2 1.0 2.2 3.4 2125 1715 A 59 ILE HG2% A 58 PRO HD2 1.0 2.2 3.9 2126 1716 A 59 ILE HG2% A 58 PRO HG2 1.0 2.2 3.9 2127 1717 A 58 PRO HA A 59 ILE HA 1.0 2.5 5.5 2128 1718 A 58 PRO HB3 A 59 ILE HA 1.0 2.5 6.5 2129 1719 A 58 PRO HG3 A 59 ILE HA 1.0 3.0 5.2 2130 1720 A 59 ILE HA A 58 PRO HG2 1.0 2.5 5.5 2131 1721 A 58 PRO HB3 A 61 LYS HEx 1.0 2.2 3.4 2132 1721 A 58 PRO HB3 A 61 LYS HEy 1.0 2.2 3.4 2133 1722 A 58 PRO HB2 A 61 LYS HB3 1.0 3.0 4.2 2134 1723 A 58 PRO HB3 A 61 LYS HB3 1.0 2.5 4.2 2135 1724 A 58 PRO HB2 A 61 LYS HDx 1.0 2.5 6.5 2136 1724 A 58 PRO HB2 A 61 LYS HDy 1.0 2.5 6.5 2137 1725 A 58 PRO HA A 61 LYS HG2 1.0 2.5 6.5 2138 1726 A 58 PRO HA A 62 GLN HG3 1.0 2.5 5.5 2139 1727 A 58 PRO HB3 A 62 GLN HG3 1.0 2.2 3.4 2140 1728 A 58 PRO HB2 A 62 GLN HG2 1.0 2.2 3.4 2141 1729 A 58 PRO HB2 A 62 GLN HB3 1.0 2.5 6.0 2142 1729 A 58 PRO HB2 A 62 GLN HB2 1.0 2.5 6.0 2143 1730 A 58 PRO HA A 62 GLN HA 1.0 2.5 5.5 2144 1731 A 59 ILE HB A 59 ILE HD1% 1.0 2.5 4.7 2145 1732 A 59 ILE HG13 A 59 ILE HA 1.0 2.2 3.4 2146 1733 A 59 ILE HG12 A 59 ILE HA 1.0 2.2 3.4 2147 1734 A 59 ILE HG2% A 59 ILE HA 1.0 2.2 3.9 2148 1735 A 59 ILE HD1% A 59 ILE HA 1.0 2.5 4.7 2149 1736 A 59 ILE HG2% A 60 CYS HA 1.0 2.5 7.0 2150 1737 A 59 ILE HB A 60 CYS HA 1.0 2.5 6.5 2151 1738 A 59 ILE HG2% A 60 CYS H 1.0 2.5 7.0 2152 1739 A 59 ILE HA A 61 LYS HB3 1.0 3.0 5.5 2153 1740 A 59 ILE HG2% A 62 GLN H 1.0 2.5 7.0 2154 1741 A 59 ILE HG2% A 63 LEU HD2% 1.0 2.5 5.2 2155 1742 A 61 LYS HA A 60 CYS HA 1.0 2.5 6.5 2156 1743 A 60 CYS HB3 A 61 LYS HB2 1.0 3.0 4.7 2157 1744 A 60 CYS HA A 63 LEU HD2% 1.0 2.5 7.0 2158 1745 A 60 CYS HA A 63 LEU HBy 1.0 2.2 3.4 2159 1746 A 60 CYS HA A 63 LEU HG 1.0 2.5 5.5 2160 1747 A 63 LEU HD1% A 60 CYS HA 1.0 2.5 4.7 2161 1748 A 61 LYS HA A 61 LYS HDx 1.0 2.5 4.2 2162 1748 A 61 LYS HA A 61 LYS HDy 1.0 2.5 4.2 2163 1749 A 61 LYS HA A 61 LYS HG3 1.0 2.2 3.4 2164 1750 A 61 LYS HA A 61 LYS HEx 1.0 2.5 6.5 2165 1750 A 61 LYS HA A 61 LYS HEy 1.0 2.5 6.5 2166 1751 A 61 LYS HA A 61 LYS HG2 1.0 2.5 4.2 2167 1752 A 61 LYS HEy A 61 LYS HG3 1.0 2.5 6.5 2168 1752 A 61 LYS HEx A 61 LYS HG3 1.0 2.5 6.5 2169 1753 A 61 LYS HB2 A 61 LYS HEx 1.0 2.5 6.5 2170 1753 A 61 LYS HB2 A 61 LYS HEy 1.0 2.5 6.5 2171 1754 A 61 LYS HB2 A 61 LYS HDx 1.0 2.5 5.5 2172 1754 A 61 LYS HB2 A 61 LYS HDy 1.0 2.5 5.5 2173 1755 A 61 LYS HG2 A 62 GLN HA 1.0 2.5 5.5 2174 1756 A 61 LYS HEx A 62 GLN HG3 1.0 3.0 4.7 2175 1756 A 61 LYS HEy A 62 GLN HG3 1.0 3.0 4.7 2176 1757 A 61 LYS HG2 A 62 GLN HG3 1.0 2.5 6.5 2177 1758 A 61 LYS HDx A 62 GLN HG3 1.0 2.5 6.5 2178 1758 A 61 LYS HDy A 62 GLN HG3 1.0 2.5 6.5 2179 1759 A 61 LYS HB2 A 62 GLN HA 1.0 2.5 6.5 2180 1760 A 61 LYS HB3 A 62 GLN HA 1.0 2.5 6.5 2181 1761 A 62 GLN HA A 61 LYS HDx 1.0 2.5 6.5 2182 1761 A 61 LYS HDy A 62 GLN HA 1.0 2.5 6.5 2183 1762 A 61 LYS HA A 64 ILE HB 1.0 2.5 6.5 2184 1763 A 61 LYS HA A 64 ILE HG2% 1.0 2.5 7.0 2185 1764 A 61 LYS HA A 64 ILE HG13 1.0 2.5 5.5 2186 1765 A 61 LYS HA A 64 ILE HD1% 1.0 2.5 4.7 2187 1766 A 61 LYS HG2 A 64 ILE HB 1.0 3.0 4.2 2188 1767 A 61 LYS HG2 A 65 ALA HB% 1.0 2.2 3.9 2189 1768 A 61 LYS HA A 65 ALA HB% 1.0 3.0 4.7 2190 1769 A 62 GLN HA A 62 GLN HG3 1.0 2.2 3.9 2191 1769 A 62 GLN HG2 A 62 GLN HA 1.0 2.2 3.9 2192 1770 A 62 GLN HG2 A 62 GLN HA 1.0 2.5 5.5 2193 1771 A 62 GLN HA A 62 GLN HG3 1.0 2.2 3.4 2194 1772 A 62 GLN HA A 63 LEU HBx 1.0 2.5 6.5 2195 1772 A 63 LEU HBy A 62 GLN HA 1.0 2.5 6.5 2196 1773 A 65 ALA HB% A 62 GLN HA 1.0 2.2 3.9 2197 1774 A 62 GLN HG2 A 65 ALA HB% 1.0 2.2 3.9 2198 1775 A 63 LEU HD2% A 63 LEU HA 1.0 2.2 3.9 2199 1776 A 63 LEU HD1% A 63 LEU HA 1.0 2.2 3.9 2200 1777 A 63 LEU HD1% A 63 LEU HBx 1.0 2.2 3.9 2201 1777 A 63 LEU HD1% A 63 LEU HBy 1.0 2.2 3.9 2202 1778 A 63 LEU HD2% A 63 LEU HBx 1.0 2.5 6.0 2203 1778 A 63 LEU HD2% A 63 LEU HBy 1.0 2.5 6.0 2204 1779 A 63 LEU HD1% A 63 LEU HBy 1.0 2.2 3.9 2205 1780 A 63 LEU HD1% A 63 LEU HBx 1.0 2.2 3.9 2206 1781 A 63 LEU HD2% A 63 LEU HBy 1.0 2.2 3.9 2207 1782 A 63 LEU HD2% A 63 LEU HBx 1.0 2.2 3.9 2208 1783 A 63 LEU HG A 64 ILE HB 1.0 2.5 5.5 2209 1784 A 63 LEU HD1% A 64 ILE HA 1.0 2.5 4.7 2210 1785 A 63 LEU HD2% A 64 ILE HA 1.0 2.5 6.0 2211 1786 A 66 LEU HB2 A 63 LEU HG 1.0 2.5 6.5 2212 1787 A 66 LEU HB2 A 63 LEU HD1% 1.0 2.5 7.0 2213 1788 A 63 LEU HA A 66 LEU HD1% 1.0 2.5 4.7 2214 1789 A 63 LEU HD1% A 66 LEU HG 1.0 2.2 3.9 2215 1790 A 63 LEU HD1% A 66 LEU HB3 1.0 2.2 3.9 2216 1791 A 66 LEU HD2% A 63 LEU HBx 1.0 2.2 3.9 2217 1791 A 63 LEU HBy A 66 LEU HD2% 1.0 2.2 3.9 2218 1792 A 63 LEU HD1% A 66 LEU HD2% 1.0 2.2 4.4 2219 1793 A 63 LEU HG A 67 ALA HA 1.0 2.5 6.5 2220 1794 A 63 LEU HD1% A 67 ALA HA 1.0 2.5 6.0 2221 1795 A 63 LEU HG A 67 ALA HB% 1.0 2.5 7.0 2222 1796 A 63 LEU HD1% A 67 ALA HB% 1.0 2.5 6.5 2223 1797 A 63 LEU HG A 81 VAL HG1% 1.0 2.5 7.0 2224 1798 A 63 LEU HD1% A 81 VAL HG1% 1.0 2.5 7.5 2225 1799 A 63 LEU HD2% A 82 PRO HG2 1.0 2.2 3.9 2226 1800 A 64 ILE HG13 A 64 ILE HA 1.0 2.5 5.5 2227 1801 A 64 ILE HG2% A 64 ILE HA 1.0 2.5 4.2 2228 1802 A 64 ILE HG12 A 64 ILE HA 1.0 2.5 4.2 2229 1803 A 64 ILE HD1% A 64 ILE HA 1.0 2.5 4.7 2230 1804 A 65 ALA HA A 64 ILE HA 1.0 2.5 6.5 2231 1805 A 65 ALA HA A 64 ILE HG2% 1.0 2.5 7.0 2232 1806 A 64 ILE HG2% A 65 ALA HB% 1.0 2.5 4.7 2233 1807 A 64 ILE HA A 67 ALA HA 1.0 2.5 5.0 2234 1808 A 64 ILE HG2% A 67 ALA HB% 1.0 2.5 7.5 2235 1809 A 64 ILE HA A 67 ALA HB% 1.0 2.5 4.2 2236 1810 A 68 ALA HB% A 64 ILE HA 1.0 2.5 4.2 2237 1811 A 68 ALA HB% A 64 ILE HG2% 1.0 2.2 4.4 2238 1812 A 64 ILE HG2% A 83 PHE HBx 1.0 2.5 6.0 2239 1813 A 64 ILE HD1% A 83 PHE HBx 1.0 2.5 7.0 2240 1814 A 65 ALA H A 65 ALA HB% 1.0 2.5 7.0 2241 1815 A 66 LEU HB2 A 65 ALA HB% 1.0 2.2 3.9 2242 1816 A 65 ALA HB% A 66 LEU HA 1.0 2.2 3.9 2243 1817 A 65 ALA HB% A 69 TYR HB3 1.0 3.0 6.0 2244 1818 A 69 TYR HD% A 65 ALA HB% 1.0 2.5 7.5 2245 1819 A 69 TYR HE% A 65 ALA HB% 1.0 2.5 7.5 2246 1820 A 66 LEU HD1% A 66 LEU HA 1.0 2.2 3.9 2247 1821 A 66 LEU HB2 A 66 LEU HD1% 1.0 2.2 3.9 2248 1822 A 66 LEU HD2% A 66 LEU HA 1.0 2.2 3.9 2249 1823 A 66 LEU HB2 A 66 LEU HD2% 1.0 2.2 3.9 2250 1824 A 66 LEU HB3 A 66 LEU HD1% 1.0 2.2 3.9 2251 1825 A 66 LEU HD1% A 67 ALA HA 1.0 2.5 6.0 2252 1826 A 66 LEU HB2 A 67 ALA HA 1.0 2.5 5.5 2253 1827 A 67 ALA HB% A 66 LEU HG 1.0 2.5 6.0 2254 1828 A 68 ALA HA A 66 LEU HD1% 1.0 3.0 6.0 2255 1829 A 69 TYR HB3 A 66 LEU HA 1.0 2.5 6.5 2256 1830 A 66 LEU HD1% A 69 TYR HB2 1.0 2.5 7.0 2257 1831 A 66 LEU HD1% A 69 TYR HB3 1.0 2.5 7.0 2258 1832 A 70 HIS HA A 66 LEU HD1% 1.0 2.5 7.0 2259 1833 A 68 ALA HB% A 67 ALA HB% 1.0 2.5 7.5 2260 1834 A 67 ALA HA A 70 HIS HBx 1.0 2.2 3.9 2261 1834 A 67 ALA HA A 70 HIS HBy 1.0 2.2 3.9 2262 1835 A 67 ALA HA A 70 HIS HBy 1.0 2.5 5.5 2263 1836 A 67 ALA HB% A 70 HIS HBy 1.0 2.5 7.0 2264 1837 A 67 ALA HB% A 70 HIS HBx 1.0 2.5 6.0 2265 1838 A 67 ALA HA A 70 HIS HBx 1.0 2.5 4.2 2266 1839 A 67 ALA HA A 81 VAL HG1% 1.0 2.5 6.0 2267 1840 A 67 ALA HB% A 81 VAL HG1% 1.0 2.5 7.5 2268 1841 A 67 ALA HB% A 82 PRO HG3 1.0 2.5 4.7 2269 1842 A 67 ALA HB% A 83 PHE HBx 1.0 2.5 6.0 2270 1843 A 67 ALA HB% A 83 PHE HBy 1.0 2.5 7.0 2271 1844 A 67 ALA HB% A 84 CYS HA 1.0 2.5 7.0 2272 1845 A 68 ALA HA A 71 ALA HA 1.0 2.5 5.5 2273 1846 A 68 ALA HB% A 71 ALA HB% 1.0 2.2 4.4 2274 1847 A 68 ALA HA A 71 ALA HB% 1.0 2.2 3.9 2275 1848 A 68 ALA HB% A 87 ILE HB 1.0 2.2 3.9 2276 1849 A 68 ALA HB% A 69 TYR HB3 1.0 3.0 7.2 2277 1850 A 68 ALA HB% A 69 TYR HB2 1.0 3.0 7.2 2278 1851 A 69 TYR HA A 70 HIS HA 1.0 3.0 4.7 2279 1852 A 69 TYR HA A 72 LYS HA 1.0 3.0 4.7 2280 1853 A 69 TYR HA A 72 LYS HE2 1.0 2.2 3.9 2281 1853 A 69 TYR HA A 72 LYS HE3 1.0 2.2 3.9 2282 1854 A 69 TYR HB3 A 72 LYS HD2 1.0 2.2 3.9 2283 1854 A 72 LYS HD3 A 69 TYR HB3 1.0 2.2 3.9 2284 1855 A 72 LYS HB2 A 69 TYR HB3 1.0 3.0 4.2 2285 1856 A 72 LYS HB2 A 69 TYR HB2 1.0 2.5 6.5 2286 1857 A 70 HIS HBy A 71 ALA HB% 1.0 2.2 3.9 2287 1858 A 72 LYS HA A 71 ALA HA 1.0 3.0 5.2 2288 1859 A 72 LYS HB2 A 71 ALA HB% 1.0 2.2 3.9 2289 1860 A 72 LYS HA A 71 ALA HB% 1.0 2.2 3.9 2290 1861 A 74 CYS HB3 A 71 ALA HA 1.0 2.5 4.2 2291 1862 A 74 CYS HB2 A 71 ALA HA 1.0 2.5 6.5 2292 1863 A 74 CYS HB3 A 71 ALA HB% 1.0 2.5 7.0 2293 1864 A 71 ALA HB% A 84 CYS HB3 1.0 2.5 7.0 2294 1865 A 87 ILE HB A 71 ALA HB% 1.0 2.2 3.9 2295 1866 A 71 ALA HB% A 87 ILE HG2% 1.0 2.2 4.4 2296 1867 A 71 ALA HA A 88 LYS HE2 1.0 2.2 3.9 2297 1867 A 71 ALA HA A 88 LYS HE3 1.0 2.2 3.9 2298 1868 A 71 ALA HB% A 88 LYS HE2 1.0 2.2 4.4 2299 1868 A 71 ALA HB% A 88 LYS HE3 1.0 2.2 4.4 2300 1869 A 71 ALA HB% A 88 LYS HG3 1.0 2.2 3.9 2301 1870 A 71 ALA HB% A 88 LYS HD2 1.0 2.2 4.4 2302 1870 A 71 ALA HB% A 88 LYS HD3 1.0 2.2 4.4 2303 1871 A 72 LYS HA A 72 LYS HD2 1.0 2.2 3.9 2304 1871 A 72 LYS HD3 A 72 LYS HA 1.0 2.2 3.9 2305 1872 A 72 LYS HG2 A 72 LYS HA 1.0 2.2 3.4 2306 1873 A 72 LYS HB3 A 72 LYS HD2 1.0 2.2 3.9 2307 1873 A 72 LYS HB3 A 72 LYS HD3 1.0 2.2 3.9 2308 1874 A 72 LYS HB2 A 72 LYS HD2 1.0 2.2 3.9 2309 1874 A 72 LYS HB2 A 72 LYS HD3 1.0 2.2 3.9 2310 1875 A 72 LYS HB3 A 72 LYS HE2 1.0 2.5 7.0 2311 1875 A 72 LYS HB3 A 72 LYS HE3 1.0 2.5 7.0 2312 1876 A 72 LYS HG2 A 72 LYS HE3 1.0 2.5 6.0 2313 1876 A 72 LYS HG2 A 72 LYS HE2 1.0 2.5 6.0 2314 1877 A 87 ILE HG2% A 72 LYS HG3 1.0 2.2 4.4 2315 1877 A 72 LYS HG2 A 87 ILE HG2% 1.0 2.2 4.4 2316 1878 A 72 LYS HA A 87 ILE HG2% 1.0 2.2 3.9 2317 1879 A 72 LYS HA A 88 LYS HE2 1.0 2.2 3.9 2318 1879 A 72 LYS HA A 88 LYS HE3 1.0 2.2 3.9 2319 1880 A 73 HIS HA A 75 GLN HG2 1.0 2.5 7.0 2320 1880 A 75 GLN HG3 A 73 HIS HA 1.0 2.5 7.0 2321 1881 A 74 CYS HA A 75 GLN HG2 1.0 2.5 6.0 2322 1881 A 74 CYS HA A 75 GLN HG3 1.0 2.5 6.0 2323 1882 A 74 CYS HA A 75 GLN HA 1.0 2.5 6.5 2324 1883 A 74 CYS HA A 76 GLU HB3 1.0 2.5 7.0 2325 1884 A 74 CYS HB3 A 76 GLU HB3 1.0 2.2 3.4 2326 1885 A 74 CYS HB3 A 77 ASN HA 1.0 2.5 7.0 2327 1886 A 74 CYS HB2 A 84 CYS HB2 1.0 2.5 7.0 2328 1887 A 74 CYS HB3 A 84 CYS HB3 1.0 2.5 7.0 2329 1888 A 74 CYS HB3 A 84 CYS HB2 1.0 2.5 5.5 2330 1889 A 75 GLN HA A 75 GLN HG2 1.0 2.2 3.9 2331 1889 A 75 GLN HG3 A 75 GLN HA 1.0 2.2 3.9 2332 1890 A 76 GLU HA A 75 GLN HA 1.0 3.0 4.7 2333 1891 A 75 GLN HA A 76 GLU HB2 1.0 2.5 5.5 2334 1892 A 75 GLN HA A 88 LYS HE2 1.0 2.5 4.7 2335 1892 A 75 GLN HA A 88 LYS HE3 1.0 2.5 4.7 2336 1893 A 76 GLU HA A 76 GLU HG2 1.0 2.5 7.0 2337 1893 A 76 GLU HA A 76 GLU HG3 1.0 2.5 7.0 2338 1894 A 76 GLU HA A 77 ASN HBx 1.0 2.5 3.7 2339 1895 A 76 GLU HA A 77 ASN HBy 1.0 3.0 4.7 2340 1896 A 76 GLU HA A 77 ASN HA 1.0 3.0 4.7 2341 1897 A 77 ASN HA A 76 GLU HG2 1.0 2.2 3.9 2342 1897 A 77 ASN HA A 76 GLU HG3 1.0 2.2 3.9 2343 1898 A 76 GLU HA A 78 LYS HB2 1.0 2.5 6.5 2344 1899 A 78 LYS HA A 76 GLU HG2 1.0 2.5 7.0 2345 1899 A 78 LYS HA A 76 GLU HG3 1.0 2.5 7.0 2346 1900 A 76 GLU HG3 A 78 LYS HE2 1.0 2.2 4.4 2347 1900 A 78 LYS HE3 A 76 GLU HG2 1.0 2.2 4.4 2348 1900 A 76 GLU HG3 A 78 LYS HE3 1.0 2.2 4.4 2349 1900 A 76 GLU HG2 A 78 LYS HE2 1.0 2.2 4.4 2350 1901 A 76 GLU HG2 A 78 LYS HD2 1.0 2.5 7.5 2351 1901 A 76 GLU HG3 A 78 LYS HD2 1.0 2.5 7.5 2352 1901 A 78 LYS HD3 A 76 GLU HG2 1.0 2.5 7.5 2353 1901 A 76 GLU HG3 A 78 LYS HD3 1.0 2.5 7.5 2354 1902 A 76 GLU HB2 A 78 LYS HB2 1.0 2.5 6.5 2355 1903 A 78 LYS HB3 A 76 GLU HG2 1.0 2.2 3.9 2356 1903 A 78 LYS HB3 A 76 GLU HG3 1.0 2.2 3.9 2357 1904 A 78 LYS HA A 77 ASN HA 1.0 3.0 5.2 2358 1905 A 78 LYS HA A 77 ASN HBy 1.0 2.5 5.5 2359 1906 A 77 ASN HA A 85 LEU HD2% 1.0 2.5 7.0 2360 1907 A 77 ASN HBx A 85 LEU HA 1.0 2.5 6.5 2361 1908 A 77 ASN HA A 88 LYS HE2 1.0 2.5 6.0 2362 1908 A 77 ASN HA A 88 LYS HE3 1.0 2.5 6.0 2363 1909 A 77 ASN HA A 88 LYS HB2 1.0 2.5 7.0 2364 1909 A 77 ASN HA A 88 LYS HB3 1.0 2.5 7.0 2365 1910 A 77 ASN HBx A 88 LYS HE3 1.0 2.5 6.0 2366 1910 A 77 ASN HBx A 88 LYS HE2 1.0 2.5 6.0 2367 1911 A 78 LYS HA A 78 LYS HD2 1.0 2.2 3.9 2368 1911 A 78 LYS HA A 78 LYS HD3 1.0 2.2 3.9 2369 1912 A 78 LYS HA A 78 LYS HG3 1.0 2.2 3.4 2370 1913 A 78 LYS HA A 78 LYS HG2 1.0 2.2 3.4 2371 1914 A 78 LYS HA A 78 LYS HE2 1.0 2.5 7.0 2372 1914 A 78 LYS HA A 78 LYS HE3 1.0 2.5 7.0 2373 1915 A 78 LYS HB3 A 78 LYS HE2 1.0 2.2 3.9 2374 1915 A 78 LYS HB3 A 78 LYS HE3 1.0 2.2 3.9 2375 1916 A 78 LYS HB2 A 78 LYS HD2 1.0 2.2 3.9 2376 1916 A 78 LYS HB2 A 78 LYS HD3 1.0 2.2 3.9 2377 1917 A 78 LYS HB3 A 78 LYS HD2 1.0 2.2 3.9 2378 1917 A 78 LYS HB3 A 78 LYS HD3 1.0 2.2 3.9 2379 1918 A 78 LYS HG2 A 78 LYS HE2 1.0 2.5 7.0 2380 1918 A 78 LYS HE3 A 78 LYS HG2 1.0 2.5 7.0 2381 1919 A 78 LYS HA A 85 LEU HD1% 1.0 2.5 6.0 2382 1920 A 78 LYS HA A 85 LEU HD2% 1.0 2.5 6.0 2383 1921 A 80 PRO HD2 A 80 PRO HA 1.0 2.5 6.5 2384 1922 A 80 PRO HB3 A 80 PRO HD3 1.0 3.0 4.7 2385 1923 A 80 PRO HD2 A 80 PRO HB2 1.0 2.5 6.5 2386 1924 A 80 PRO HD2 A 80 PRO HB3 1.0 2.5 6.5 2387 1925 A 81 VAL HB A 80 PRO HD2 1.0 2.5 5.5 2388 1926 A 81 VAL HG2% A 80 PRO HG2 1.0 2.5 7.0 2389 1927 A 85 LEU HD1% A 80 PRO HA 1.0 2.5 4.7 2390 1928 A 81 VAL HG2% A 80 PRO HB3 1.0 2.5 4.7 2391 1929 A 81 VAL HG2% A 80 PRO HD2 1.0 2.5 6.0 2392 1930 A 81 VAL HG1% A 81 VAL HA 1.0 2.5 7.0 2393 1931 A 81 VAL HG2% A 81 VAL HA 1.0 2.2 3.9 2394 1932 A 82 PRO HD3 A 81 VAL HA 1.0 2.5 6.5 2395 1933 A 81 VAL HA A 82 PRO HB2 1.0 2.5 5.5 2396 1934 A 81 VAL HG1% A 82 PRO HB2 1.0 2.5 7.0 2397 1935 A 81 VAL HG2% A 82 PRO HD2 1.0 2.5 6.0 2398 1936 A 83 PHE HBy A 81 VAL HG1% 1.0 2.5 7.0 2399 1937 A 81 VAL HG1% A 83 PHE HBx 1.0 2.5 7.0 2400 1938 A 81 VAL HG1% A 84 CYS HB3 1.0 2.5 7.0 2401 1939 A 83 PHE HA A 82 PRO HD2 1.0 2.8 6.0 2402 1940 A 83 PHE HA A 82 PRO HB2 1.0 3.0 4.7 2403 1941 A 85 LEU HD1% A 82 PRO HA 1.0 2.5 6.0 2404 1942 A 82 PRO HD3 A 85 LEU HD2% 1.0 3.0 5.2 2405 1943 A 83 PHE HBx A 83 PHE HD% 1.0 2.5 6.0 2406 1944 A 83 PHE HBy A 83 PHE HD% 1.0 2.5 7.0 2407 1945 A 83 PHE HBy A 86 ASN HB2 1.0 2.5 6.5 2408 1946 A 83 PHE HA A 87 ILE HG12 1.0 2.5 5.5 2409 1947 A 83 PHE HA A 87 ILE HD1% 1.0 2.5 6.0 2410 1948 A 85 LEU HG A 85 LEU HA 1.0 2.5 6.5 2411 1949 A 85 LEU HB2 A 85 LEU HD2% 1.0 2.2 3.9 2412 1950 A 85 LEU HB3 A 85 LEU HD2% 1.0 2.2 3.9 2413 1951 A 85 LEU HD2% A 85 LEU HA 1.0 2.2 3.9 2414 1952 A 85 LEU HD1% A 85 LEU HA 1.0 2.2 3.9 2415 1953 A 85 LEU HB3 A 85 LEU HD1% 1.0 2.2 3.9 2416 1954 A 85 LEU HD2% A 88 LYS HG3 1.0 2.5 6.0 2417 1955 A 85 LEU HD2% A 89 GLN HGx 1.0 2.5 6.0 2418 1956 A 87 ILE HG2% A 87 ILE HA 1.0 2.2 3.9 2419 1957 A 89 GLN HA A 88 LYS HB2 1.0 3.0 4.7 2420 1957 A 89 GLN HA A 88 LYS HB3 1.0 3.0 4.7 2421 1958 A 88 LYS HA A 89 GLN HGx 1.0 2.5 6.5 2422 1959 A 88 LYS HA A 89 GLN HA 1.0 3.0 4.2 2423 1960 A 89 GLN HA A 90 LYS HA 1.0 3.0 4.7 2424 1961 A 89 GLN HA A 90 LYS HB2 1.0 2.5 6.5 2425 1962 A 90 LYS HA A 89 GLN HB3 1.0 2.5 4.2 2426 1963 A 90 LYS HB3 A 89 GLN HB3 1.0 2.5 6.5 2427 1964 A 90 LYS HA A 90 LYS HG2 1.0 2.2 3.9 2428 1964 A 90 LYS HA A 90 LYS HG3 1.0 2.2 3.9 2429 1965 A 90 LYS HA A 90 LYS HD2 1.0 2.2 3.9 2430 1965 A 90 LYS HA A 90 LYS HD3 1.0 2.2 3.9 2431 1966 A 90 LYS HE2 A 90 LYS HG2 1.0 2.2 4.4 2432 1966 A 90 LYS HE3 A 90 LYS HG2 1.0 2.2 4.4 2433 1966 A 90 LYS HG3 A 90 LYS HE2 1.0 2.2 4.4 2434 1966 A 90 LYS HG3 A 90 LYS HE3 1.0 2.2 4.4 2435 1967 A 90 LYS HA A 90 LYS HE2 1.0 2.2 3.9 2436 1967 A 90 LYS HA A 90 LYS HE3 1.0 2.2 3.9 2437 1968 A 90 LYS HB3 A 90 LYS HE3 1.0 2.2 3.9 2438 1968 A 90 LYS HB3 A 90 LYS HE2 1.0 2.2 3.9 2439 1969 A 90 LYS HE3 A 90 LYS HB2 1.0 2.2 3.9 2440 1969 A 90 LYS HB2 A 90 LYS HE2 1.0 2.2 3.9 2441 1970 A 90 LYS HD3 A 90 LYS HB2 1.0 2.2 3.9 2442 1970 A 90 LYS HB2 A 90 LYS HD2 1.0 2.2 3.9 2443 1971 A 90 LYS HB3 A 90 LYS HD3 1.0 2.2 3.9 2444 1971 A 90 LYS HB3 A 90 LYS HD2 1.0 2.2 3.9 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin 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 B 1 LEU HG B 1 LEU HA 1.0 2.3 6.5 2 2 B 5 ALA HB% B 6 MET HBx 1.0 1.8 6.0 3 2 B 5 ALA HB% B 6 MET HBy 1.0 1.8 6.0 4 3 B 6 MET HA B 6 MET HGx 1.0 2.3 7.0 5 3 B 6 MET HA B 6 MET HGy 1.0 2.3 7.0 6 4 B 9 LEU HA B 9 LEU HDy% 1.0 1.8 3.4 7 5 B 9 LEU HDx% B 9 LEU HBx 1.0 2.3 5.0 8 5 B 9 LEU HBy B 9 LEU HDx% 1.0 2.3 5.0 9 6 B 9 LEU HDy% B 9 LEU HBx 1.0 2.3 5.0 10 6 B 9 LEU HBy B 9 LEU HDy% 1.0 2.3 5.0 11 7 B 9 LEU HA B 9 LEU HG 1.0 2.3 6.5 12 8 B 10 MET HA B 10 MET HGy 1.0 2.3 7.0 13 8 B 10 MET HA B 10 MET HGx 1.0 2.3 7.0 14 9 B 11 LEU HDx% B 11 LEU HA 1.0 2.3 4.5 15 10 B 11 LEU HDx% B 11 LEU HBx 1.0 1.8 3.9 16 10 B 11 LEU HDx% B 11 LEU HBy 1.0 1.8 3.9 17 11 B 11 LEU HG B 11 LEU HA 1.0 2.3 6.5 18 12 B 13 PRO HBy B 13 PRO HDx 1.0 1.8 5.5 19 12 B 13 PRO HBy B 13 PRO HDy 1.0 1.8 5.5 20 13 B 16 ILE HG2% B 16 ILE HA 1.0 1.8 5.5 21 14 B 16 ILE HD1% B 16 ILE HA 1.0 1.8 5.5 22 15 B 16 ILE HD1% B 16 ILE HB 1.0 1.8 3.4 23 16 B 17 GLU HA B 17 GLU HGx 1.0 2.3 4.5 24 16 B 17 GLU HA B 17 GLU HGy 1.0 2.3 4.5 25 17 B 17 GLU HA B 18 GLN HA 1.0 2.3 4.5 26 18 B 18 GLN HA B 18 GLN HGx 1.0 1.8 3.4 27 18 B 18 GLN HA B 18 GLN HGy 1.0 1.8 3.4 28 19 B 21 THR HA B 21 THR HG2% 1.0 1.8 3.4 29 20 B 22 GLU HA B 22 GLU HGx 1.0 2.3 4.5 30 20 B 22 GLU HA B 22 GLU HGy 1.0 2.3 4.5 31 21 B 23 ASP HA B 24 PRO HDx 1.0 1.8 3.4 32 21 B 24 PRO HDy B 23 ASP HA 1.0 1.8 3.4 33 22 B 24 PRO HBy B 24 PRO HDx 1.0 1.8 5.5 34 22 B 24 PRO HDy B 24 PRO HBy 1.0 1.8 5.5 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 48 GLY H A 44 GLN O 1.0 1.5 2.3 54 54 A 44 GLN O A 48 GLY N 1.0 2.3 3.1 55 55 A 54 ASN H A 50 LYS O 1.0 1.5 2.3 56 56 A 50 LYS O A 54 ASN N 1.0 2.3 3.1 57 57 A 55 GLY H A 51 ARG O 1.0 1.5 2.3 58 58 A 51 ARG O A 55 GLY N 1.0 2.3 3.1 59 59 A 62 GLN H A 58 PRO O 1.0 1.5 2.3 60 60 A 58 PRO O A 62 GLN N 1.0 2.3 3.1 61 61 A 63 LEU H A 59 ILE O 1.0 1.5 2.3 62 62 A 59 ILE O A 63 LEU N 1.0 2.3 3.1 63 63 A 64 ILE H A 60 CYS O 1.0 1.5 2.3 64 64 A 60 CYS O A 64 ILE N 1.0 2.3 3.1 65 65 A 65 ALA H A 61 LYS O 1.0 1.5 2.3 66 66 A 61 LYS O A 65 ALA N 1.0 2.3 3.1 67 67 A 62 GLN O A 66 LEU H 1.0 1.5 2.3 68 68 A 62 GLN O A 66 LEU N 1.0 2.3 3.1 69 69 A 67 ALA H A 63 LEU O 1.0 1.5 2.3 70 70 A 63 LEU O A 67 ALA N 1.0 2.3 3.1 71 71 A 68 ALA H A 64 ILE O 1.0 1.5 2.3 72 72 A 64 ILE O A 68 ALA N 1.0 2.3 3.1 73 73 A 69 TYR H A 65 ALA O 1.0 1.5 2.3 74 74 A 65 ALA O A 69 TYR N 1.0 2.3 3.1 75 75 A 70 HIS H A 66 LEU O 1.0 1.5 2.3 76 76 A 66 LEU O A 70 HIS N 1.0 2.3 3.1 77 77 A 67 ALA O A 71 ALA H 1.0 1.5 2.3 78 78 A 67 ALA O A 71 ALA N 1.0 2.3 3.1 79 79 A 72 LYS H A 68 ALA O 1.0 1.5 2.3 80 80 A 68 ALA O A 72 LYS N 1.0 2.3 3.1 81 81 A 85 LEU H A 81 VAL O 1.0 1.5 2.3 82 82 A 81 VAL O A 85 LEU N 1.0 2.3 3.1 83 83 B 20 PHE H B 16 ILE O 1.0 1.5 2.3 84 84 B 16 ILE O B 20 PHE N 1.0 2.3 3.1 85 85 B 21 THR H B 17 GLU O 1.0 1.5 2.3 86 86 B 17 GLU O B 21 THR N 1.0 2.3 3.1 87 87 B 22 GLU H B 18 GLN O 1.0 1.5 2.3 88 88 B 18 GLN O B 22 GLU N 1.0 2.3 3.1 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _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 4 SER C A 5 PRO N A 5 PRO CA A 5 PRO C 1.0 -82.90 -42.90 PHI 2 2 A 5 PRO N A 5 PRO CA A 5 PRO C A 6 GLY N 1.0 -47.70 2.10 PSI 3 3 A 5 PRO C A 6 GLY N A 6 GLY CA A 6 GLY C 1.0 48.40 132.20 PHI 4 4 A 6 GLY N A 6 GLY CA A 6 GLY C A 7 ASP N 1.0 -35.90 55.30 PSI 5 5 A 6 GLY C A 7 ASP N A 7 ASP CA A 7 ASP C 1.0 -83.60 -43.60 PHI 6 6 A 7 ASP N A 7 ASP CA A 7 ASP C A 8 SER N 1.0 -59.00 -19.00 PSI 7 7 A 7 ASP C A 8 SER N A 8 SER CA A 8 SER C 1.0 -86.70 -46.70 PHI 8 8 A 8 SER N A 8 SER CA A 8 SER C A 9 ARG N 1.0 -52.80 -12.80 PSI 9 9 A 8 SER C A 9 ARG N A 9 ARG CA A 9 ARG C 1.0 -83.90 -43.90 PHI 10 10 A 9 ARG N A 9 ARG CA A 9 ARG C A 10 ARG N 1.0 -60.70 -20.70 PSI 11 11 A 9 ARG C A 10 ARG N A 10 ARG CA A 10 ARG C 1.0 -82.00 -42.00 PHI 12 12 A 10 ARG N A 10 ARG CA A 10 ARG C A 11 LEU N 1.0 -59.40 -18.40 PSI 13 13 A 10 ARG C A 11 LEU N A 11 LEU CA A 11 LEU C 1.0 -85.80 -45.80 PHI 14 14 A 11 LEU N A 11 LEU CA A 11 LEU C A 12 SER N 1.0 -62.10 -17.90 PSI 15 15 A 11 LEU C A 12 SER N A 12 SER CA A 12 SER C 1.0 -87.90 -47.90 PHI 16 16 A 12 SER N A 12 SER CA A 12 SER C A 13 ILE N 1.0 -57.50 -17.50 PSI 17 17 A 12 SER C A 13 ILE N A 13 ILE CA A 13 ILE C 1.0 -87.20 -47.20 PHI 18 18 A 13 ILE N A 13 ILE CA A 13 ILE C A 14 GLN N 1.0 -62.80 -22.80 PSI 19 19 A 13 ILE C A 14 GLN N A 14 GLN CA A 14 GLN C 1.0 -82.00 -42.00 PHI 20 20 A 14 GLN N A 14 GLN CA A 14 GLN C A 15 ARG N 1.0 -61.40 -21.40 PSI 21 21 A 14 GLN C A 15 ARG N A 15 ARG CA A 15 ARG C 1.0 -84.40 -44.40 PHI 22 22 A 15 ARG N A 15 ARG CA A 15 ARG C A 16 ALA N 1.0 -62.10 -22.10 PSI 23 23 A 15 ARG C A 16 ALA N A 16 ALA CA A 16 ALA C 1.0 -86.60 -46.60 PHI 24 24 A 16 ALA N A 16 ALA CA A 16 ALA C A 17 ILE N 1.0 -62.20 -22.20 PSI 25 25 A 16 ALA C A 17 ILE N A 17 ILE CA A 17 ILE C 1.0 -82.90 -42.90 PHI 26 26 A 17 ILE N A 17 ILE CA A 17 ILE C A 18 GLN N 1.0 -64.30 -24.30 PSI 27 27 A 17 ILE C A 18 GLN N A 18 GLN CA A 18 GLN C 1.0 -81.50 -41.50 PHI 28 28 A 18 GLN N A 18 GLN CA A 18 GLN C A 19 SER N 1.0 -58.90 -18.90 PSI 29 29 A 18 GLN C A 19 SER N A 19 SER CA A 19 SER C 1.0 -83.90 -43.90 PHI 30 30 A 19 SER N A 19 SER CA A 19 SER C A 20 LEU N 1.0 -58.70 -18.70 PSI 31 31 A 19 SER C A 20 LEU N A 20 LEU CA A 20 LEU C 1.0 -84.80 -44.80 PHI 32 32 A 20 LEU N A 20 LEU CA A 20 LEU C A 21 VAL N 1.0 -64.30 -24.30 PSI 33 33 A 20 LEU C A 21 VAL N A 21 VAL CA A 21 VAL C 1.0 -82.70 -42.70 PHI 34 34 A 21 VAL N A 21 VAL CA A 21 VAL C A 22 HIS N 1.0 -59.00 -19.00 PSI 35 35 A 21 VAL C A 22 HIS N A 22 HIS CA A 22 HIS C 1.0 -84.20 -44.20 PHI 36 36 A 22 HIS N A 22 HIS CA A 22 HIS C A 23 ALA N 1.0 -60.60 -20.60 PSI 37 37 A 22 HIS C A 23 ALA N A 23 ALA CA A 23 ALA C 1.0 -85.10 -45.10 PHI 38 38 A 23 ALA N A 23 ALA CA A 23 ALA C A 24 ALA N 1.0 -59.60 -19.60 PSI 39 39 A 23 ALA C A 24 ALA N A 24 ALA CA A 24 ALA C 1.0 -90.00 -46.40 PHI 40 40 A 24 ALA N A 24 ALA CA A 24 ALA C A 25 GLN N 1.0 -48.60 -7.80 PSI 41 41 A 24 ALA C A 25 GLN N A 25 GLN CA A 25 GLN C 1.0 -123.30 -82.30 PHI 42 42 A 25 GLN N A 25 GLN CA A 25 GLN C A 26 CYS N 1.0 -24.50 24.10 PSI 43 43 A 25 GLN C A 26 CYS N A 26 CYS CA A 26 CYS C 1.0 -96.00 -42.80 PHI 44 44 A 26 CYS N A 26 CYS CA A 26 CYS C A 27 ARG N 1.0 111.00 151.00 PSI 45 45 A 26 CYS C A 27 ARG N A 27 ARG CA A 27 ARG C 1.0 -151.30 -65.70 PHI 46 46 A 27 ARG N A 27 ARG CA A 27 ARG C A 28 ASN N 1.0 92.60 165.60 PSI 47 47 A 27 ARG C A 28 ASN N A 28 ASN CA A 28 ASN C 1.0 -139.40 -44.40 PHI 48 48 A 28 ASN N A 28 ASN CA A 28 ASN C A 29 ALA N 1.0 74.40 174.60 PSI 49 49 A 28 ASN C A 29 ALA N A 29 ALA CA A 29 ALA C 1.0 -93.20 -43.80 PHI 50 50 A 29 ALA N A 29 ALA CA A 29 ALA C A 30 ASN N 1.0 -40.90 -0.90 PSI 51 51 A 29 ALA C A 30 ASN N A 30 ASN CA A 30 ASN C 1.0 -131.80 -63.40 PHI 52 52 A 30 ASN N A 30 ASN CA A 30 ASN C A 31 CYS N 1.0 -32.70 55.50 PSI 53 53 A 30 ASN C A 31 CYS N A 31 CYS CA A 31 CYS C 1.0 -94.20 -47.00 PHI 54 54 A 31 CYS N A 31 CYS CA A 31 CYS C A 32 SER N 1.0 112.70 163.30 PSI 55 55 A 31 CYS C A 32 SER N A 32 SER CA A 32 SER C 1.0 -134.90 -60.90 PHI 56 56 A 32 SER N A 32 SER CA A 32 SER C A 33 LEU N 1.0 108.20 148.40 PSI 57 57 A 32 SER C A 33 LEU N A 33 LEU CA A 33 LEU C 1.0 -99.00 -54.40 PHI 58 58 A 33 LEU N A 33 LEU CA A 33 LEU C A 34 PRO N 1.0 86.60 181.60 PSI 59 59 A 33 LEU C A 34 PRO N A 34 PRO CA A 34 PRO C 1.0 -71.90 -31.90 PHI 60 60 A 34 PRO N A 34 PRO CA A 34 PRO C A 35 SER N 1.0 -57.90 -17.90 PSI 61 61 A 34 PRO C A 35 SER N A 35 SER CA A 35 SER C 1.0 -92.50 -52.50 PHI 62 62 A 35 SER N A 35 SER CA A 35 SER C A 36 CYS N 1.0 -54.90 -4.90 PSI 63 63 A 35 SER C A 36 CYS N A 36 CYS CA A 36 CYS C 1.0 -78.50 -38.50 PHI 64 64 A 36 CYS N A 36 CYS CA A 36 CYS C A 37 GLN N 1.0 -66.50 -26.50 PSI 65 65 A 36 CYS C A 37 GLN N A 37 GLN CA A 37 GLN C 1.0 -79.10 -39.10 PHI 66 66 A 37 GLN N A 37 GLN CA A 37 GLN C A 38 LYS N 1.0 -62.30 -22.30 PSI 67 67 A 37 GLN C A 38 LYS N A 38 LYS CA A 38 LYS C 1.0 -83.20 -43.20 PHI 68 68 A 38 LYS N A 38 LYS CA A 38 LYS C A 39 MET N 1.0 -61.50 -21.50 PSI 69 69 A 38 LYS C A 39 MET N A 39 MET CA A 39 MET C 1.0 -85.90 -45.90 PHI 70 70 A 39 MET N A 39 MET CA A 39 MET C A 40 LYS N 1.0 -61.90 -21.90 PSI 71 71 A 39 MET C A 40 LYS N A 40 LYS CA A 40 LYS C 1.0 -81.50 -41.50 PHI 72 72 A 40 LYS N A 40 LYS CA A 40 LYS C A 41 ARG N 1.0 -61.20 -21.20 PSI 73 73 A 40 LYS C A 41 ARG N A 41 ARG CA A 41 ARG C 1.0 -86.80 -46.80 PHI 74 74 A 41 ARG N A 41 ARG CA A 41 ARG C A 42 VAL N 1.0 -55.10 -15.10 PSI 75 75 A 41 ARG C A 42 VAL N A 42 VAL CA A 42 VAL C 1.0 -87.00 -47.00 PHI 76 76 A 42 VAL N A 42 VAL CA A 42 VAL C A 43 VAL N 1.0 -61.50 -21.50 PSI 77 77 A 42 VAL C A 43 VAL N A 43 VAL CA A 43 VAL C 1.0 -83.40 -43.40 PHI 78 78 A 43 VAL N A 43 VAL CA A 43 VAL C A 44 GLN N 1.0 -62.30 -22.30 PSI 79 79 A 43 VAL C A 44 GLN N A 44 GLN CA A 44 GLN C 1.0 -82.60 -42.60 PHI 80 80 A 44 GLN N A 44 GLN CA A 44 GLN C A 45 HIS N 1.0 -63.40 -23.40 PSI 81 81 A 44 GLN C A 45 HIS N A 45 HIS CA A 45 HIS C 1.0 -83.10 -43.10 PHI 82 82 A 45 HIS N A 45 HIS CA A 45 HIS C A 46 THR N 1.0 -64.60 -24.60 PSI 83 83 A 45 HIS C A 46 THR N A 46 THR CA A 46 THR C 1.0 -84.10 -44.10 PHI 84 84 A 46 THR N A 46 THR CA A 46 THR C A 47 LYS N 1.0 -59.40 -19.40 PSI 85 85 A 46 THR C A 47 LYS N A 47 LYS CA A 47 LYS C 1.0 -86.10 -46.10 PHI 86 86 A 47 LYS N A 47 LYS CA A 47 LYS C A 48 GLY N 1.0 -52.10 -12.10 PSI 87 87 A 47 LYS C A 48 GLY N A 48 GLY CA A 48 GLY C 1.0 -122.00 -82.00 PHI 88 88 A 48 GLY N A 48 GLY CA A 48 GLY C A 49 CYS N 1.0 -29.60 30.60 PSI 89 89 A 48 GLY C A 49 CYS N A 49 CYS CA A 49 CYS C 1.0 -92.80 -52.80 PHI 90 90 A 49 CYS N A 49 CYS CA A 49 CYS C A 50 LYS N 1.0 77.60 166.00 PSI 91 91 A 49 CYS C A 50 LYS N A 50 LYS CA A 50 LYS C 1.0 -119.40 -35.40 PHI 92 92 A 50 LYS N A 50 LYS CA A 50 LYS C A 51 ARG N 1.0 -53.70 19.30 PSI 93 93 A 50 LYS C A 51 ARG N A 51 ARG CA A 51 ARG C 1.0 -88.00 -47.20 PHI 94 94 A 51 ARG N A 51 ARG CA A 51 ARG C A 52 LYS N 1.0 -58.10 -8.10 PSI 95 95 A 51 ARG C A 52 LYS N A 52 LYS CA A 52 LYS C 1.0 -83.80 -43.80 PHI 96 96 A 52 LYS N A 52 LYS CA A 52 LYS C A 53 THR N 1.0 -63.60 3.00 PSI 97 97 A 52 LYS C A 53 THR N A 53 THR CA A 53 THR C 1.0 -83.70 -43.70 PHI 98 98 A 53 THR N A 53 THR CA A 53 THR C A 54 ASN N 1.0 -64.50 -3.10 PSI 99 99 A 56 GLY C A 57 CYS N A 57 CYS CA A 57 CYS C 1.0 -157.60 -74.20 PHI 100 100 A 57 CYS N A 57 CYS CA A 57 CYS C A 58 PRO N 1.0 57.50 193.90 PSI 101 101 A 57 CYS C A 58 PRO N A 58 PRO CA A 58 PRO C 1.0 -79.10 -39.10 PHI 102 102 A 58 PRO N A 58 PRO CA A 58 PRO C A 59 ILE N 1.0 124.60 164.60 PSI 103 103 A 58 PRO C A 59 ILE N A 59 ILE CA A 59 ILE C 1.0 -82.20 -42.20 PHI 104 104 A 59 ILE N A 59 ILE CA A 59 ILE C A 60 CYS N 1.0 -52.30 -10.10 PSI 105 105 A 59 ILE C A 60 CYS N A 60 CYS CA A 60 CYS C 1.0 -82.70 -42.70 PHI 106 106 A 60 CYS N A 60 CYS CA A 60 CYS C A 61 LYS N 1.0 -64.00 -24.00 PSI 107 107 A 60 CYS C A 61 LYS N A 61 LYS CA A 61 LYS C 1.0 -80.70 -40.70 PHI 108 108 A 61 LYS N A 61 LYS CA A 61 LYS C A 62 GLN N 1.0 -56.10 -16.10 PSI 109 109 A 61 LYS C A 62 GLN N A 62 GLN CA A 62 GLN C 1.0 -85.90 -45.90 PHI 110 110 A 62 GLN N A 62 GLN CA A 62 GLN C A 63 LEU N 1.0 -57.10 -17.10 PSI 111 111 A 62 GLN C A 63 LEU N A 63 LEU CA A 63 LEU C 1.0 -83.20 -43.20 PHI 112 112 A 63 LEU N A 63 LEU CA A 63 LEU C A 64 ILE N 1.0 -57.40 -17.40 PSI 113 113 A 63 LEU C A 64 ILE N A 64 ILE CA A 64 ILE C 1.0 -83.70 -43.70 PHI 114 114 A 64 ILE N A 64 ILE CA A 64 ILE C A 65 ALA N 1.0 -63.80 -23.80 PSI 115 115 A 64 ILE C A 65 ALA N A 65 ALA CA A 65 ALA C 1.0 -80.30 -40.30 PHI 116 116 A 65 ALA N A 65 ALA CA A 65 ALA C A 66 LEU N 1.0 -64.00 -24.00 PSI 117 117 A 65 ALA C A 66 LEU N A 66 LEU CA A 66 LEU C 1.0 -86.00 -46.00 PHI 118 118 A 66 LEU N A 66 LEU CA A 66 LEU C A 67 ALA N 1.0 -62.50 -22.50 PSI 119 119 A 66 LEU C A 67 ALA N A 67 ALA CA A 67 ALA C 1.0 -81.90 -41.90 PHI 120 120 A 67 ALA N A 67 ALA CA A 67 ALA C A 68 ALA N 1.0 -59.60 -19.60 PSI 121 121 A 67 ALA C A 68 ALA N A 68 ALA CA A 68 ALA C 1.0 -81.40 -41.40 PHI 122 122 A 68 ALA N A 68 ALA CA A 68 ALA C A 69 TYR N 1.0 -63.60 -8.40 PSI 123 123 A 68 ALA C A 69 TYR N A 69 TYR CA A 69 TYR C 1.0 -135.60 -46.80 PHI 124 124 A 69 TYR N A 69 TYR CA A 69 TYR C A 70 HIS N 1.0 -67.10 38.10 PSI 125 125 A 69 TYR C A 70 HIS N A 70 HIS CA A 70 HIS C 1.0 -82.00 -42.00 PHI 126 126 A 70 HIS N A 70 HIS CA A 70 HIS C A 71 ALA N 1.0 -57.70 -17.70 PSI 127 127 A 70 HIS C A 71 ALA N A 71 ALA CA A 71 ALA C 1.0 -81.20 -41.20 PHI 128 128 A 71 ALA N A 71 ALA CA A 71 ALA C A 72 LYS N 1.0 -58.90 -18.90 PSI 129 129 A 71 ALA C A 72 LYS N A 72 LYS CA A 72 LYS C 1.0 -89.40 -49.40 PHI 130 130 A 72 LYS N A 72 LYS CA A 72 LYS C A 73 HIS N 1.0 -47.60 -7.20 PSI 131 131 A 72 LYS C A 73 HIS N A 73 HIS CA A 73 HIS C 1.0 -123.30 -78.10 PHI 132 132 A 73 HIS N A 73 HIS CA A 73 HIS C A 74 CYS N 1.0 -33.00 30.00 PSI 133 133 A 73 HIS C A 74 CYS N A 74 CYS CA A 74 CYS C 1.0 -97.20 -45.80 PHI 134 134 A 74 CYS N A 74 CYS CA A 74 CYS C A 75 GLN N 1.0 109.20 160.00 PSI 135 135 A 74 CYS C A 75 GLN N A 75 GLN CA A 75 GLN C 1.0 -148.30 -58.50 PHI 136 136 A 75 GLN N A 75 GLN CA A 75 GLN C A 76 GLU N 1.0 92.00 163.60 PSI 137 137 A 75 GLN C A 76 GLU N A 76 GLU CA A 76 GLU C 1.0 -158.10 -42.70 PHI 138 138 A 76 GLU N A 76 GLU CA A 76 GLU C A 77 ASN N 1.0 86.40 191.00 PSI 139 139 A 76 GLU C A 77 ASN N A 77 ASN CA A 77 ASN C 1.0 -116.30 -35.30 PHI 140 140 A 77 ASN N A 77 ASN CA A 77 ASN C A 78 LYS N 1.0 -67.60 3.60 PSI 141 141 A 81 VAL C A 82 PRO N A 82 PRO CA A 82 PRO C 1.0 -88.40 -48.40 PHI 142 142 A 82 PRO N A 82 PRO CA A 82 PRO C A 83 PHE N 1.0 132.10 172.10 PSI 143 143 A 82 PRO C A 83 PHE N A 83 PHE CA A 83 PHE C 1.0 -151.60 -44.60 PHI 144 144 A 83 PHE N A 83 PHE CA A 83 PHE C A 84 CYS N 1.0 94.30 156.90 PSI 145 145 A 83 PHE C A 84 CYS N A 84 CYS CA A 84 CYS C 1.0 -133.40 -56.40 PHI 146 146 A 84 CYS N A 84 CYS CA A 84 CYS C A 85 LEU N 1.0 139.60 194.00 PSI 147 147 A 84 CYS C A 85 LEU N A 85 LEU CA A 85 LEU C 1.0 -84.00 -44.00 PHI 148 148 A 85 LEU N A 85 LEU CA A 85 LEU C A 86 ASN N 1.0 -58.40 15.40 PSI 149 149 A 85 LEU C A 86 ASN N A 86 ASN CA A 86 ASN C 1.0 -123.00 -72.60 PHI 150 150 A 86 ASN N A 86 ASN CA A 86 ASN C A 87 ILE N 1.0 -32.90 21.10 PSI 151 151 A 87 ILE C A 88 LYS N A 88 LYS CA A 88 LYS C 1.0 -131.00 -66.60 PHI 152 152 A 88 LYS N A 88 LYS CA A 88 LYS C A 89 GLN N 1.0 72.00 157.80 PSI 153 153 A 88 LYS C A 89 GLN N A 89 GLN CA A 89 GLN C 1.0 -143.70 -37.10 PHI 154 154 A 89 GLN N A 89 GLN CA A 89 GLN C A 90 LYS N 1.0 97.30 146.50 PSI 155 155 B 6 MET C B 7 ASP N B 7 ASP CA B 7 ASP C 1.0 -92.48 -44.44 PHI 156 156 B 7 ASP C B 8 ASP N B 8 ASP CA B 8 ASP C 1.0 -93.28 -48.14 PHI 157 157 B 8 ASP C B 9 LEU N B 9 LEU CA B 9 LEU C 1.0 -137.14 -30.02 PHI 158 158 B 11 LEU C B 12 SER N B 12 SER CA B 12 SER C 1.0 -143.46 -23.92 PHI 159 159 B 12 SER C B 13 PRO N B 13 PRO CA B 13 PRO C 1.0 -68.35 -44.33 PHI 160 160 B 13 PRO C B 14 ASP N B 14 ASP CA B 14 ASP C 1.0 -91.32 -42.96 PHI 161 161 B 14 ASP C B 15 ASP N B 15 ASP CA B 15 ASP C 1.0 -73.59 -52.29 PHI 162 162 B 15 ASP C B 16 ILE N B 16 ILE CA B 16 ILE C 1.0 -76.08 -48.42 PHI 163 163 B 16 ILE C B 17 GLU N B 17 GLU CA B 17 GLU C 1.0 -80.50 -52.88 PHI 164 164 B 17 GLU C B 18 GLN N B 18 GLN CA B 18 GLN C 1.0 -110.10 -34.70 PHI 165 165 B 18 GLN C B 19 TRP N B 19 TRP CA B 19 TRP C 1.0 -98.42 -56.64 PHI 166 166 B 20 PHE C B 21 THR N B 21 THR CA B 21 THR C 1.0 -148.21 -27.15 PHI 167 167 B 22 GLU C B 23 ASP N B 23 ASP CA B 23 ASP C 1.0 -117.74 -44.76 PHI 168 168 B 7 ASP N B 7 ASP CA B 7 ASP C B 8 ASP N 1.0 -81.07 13.17 PSI 169 169 B 8 ASP N B 8 ASP CA B 8 ASP C B 9 LEU N 1.0 -76.36 16.00 PSI 170 170 B 9 LEU N B 9 LEU CA B 9 LEU C B 10 MET N 1.0 -74.64 25.24 PSI 171 171 B 12 SER N B 12 SER CA B 12 SER C B 13 PRO N 1.0 94.42 168.76 PSI 172 172 B 13 PRO N B 13 PRO CA B 13 PRO C B 14 ASP N 1.0 -45.74 -15.42 PSI 173 173 B 14 ASP N B 14 ASP CA B 14 ASP C B 15 ASP N 1.0 -64.71 10.41 PSI 174 174 B 15 ASP N B 15 ASP CA B 15 ASP C B 16 ILE N 1.0 -63.03 -17.85 PSI 175 175 B 16 ILE N B 16 ILE CA B 16 ILE C B 17 GLU N 1.0 -59.28 -25.14 PSI 176 176 B 17 GLU N B 17 GLU CA B 17 GLU C B 18 GLN N 1.0 -58.47 -3.03 PSI 177 177 B 18 GLN N B 18 GLN CA B 18 GLN C B 19 TRP N 1.0 -60.20 -12.64 PSI 178 178 B 19 TRP N B 19 TRP CA B 19 TRP C B 20 PHE N 1.0 -53.47 8.55 PSI 179 179 B 21 THR N B 21 THR CA B 21 THR C B 22 GLU N 1.0 96.83 174.29 PSI 180 180 B 23 ASP N B 23 ASP CA B 23 ASP C B 24 PRO N 1.0 105.92 177.26 PSI stop_ save_