data_nef_c15437_2jua save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 5687 PDB 1p68 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 MET start . . 2 A 2 TYR middle . . 3 A 3 GLY middle . false 4 A 4 LYS middle . . 5 A 5 LEU middle . . 6 A 6 ASN middle . . 7 A 7 ASP middle . . 8 A 8 LEU middle . . 9 A 9 LEU middle . . 10 A 10 GLU middle . . 11 A 11 ASP middle . . 12 A 12 LEU middle . . 13 A 13 GLN middle . . 14 A 14 GLU middle . . 15 A 15 VAL middle . . 16 A 16 LEU middle . . 17 A 17 LYS middle . . 18 A 18 HIS middle . . 19 A 19 VAL middle . . 20 A 20 ASN middle . . 21 A 21 GLN middle . . 22 A 22 HIS middle . . 23 A 23 TRP middle . . 24 A 24 GLN middle . . 25 A 25 GLY middle . false 26 A 26 GLY middle . false 27 A 27 GLN middle . . 28 A 28 LYS middle . . 29 A 29 ASN middle . . 30 A 30 MET middle . . 31 A 31 ASN middle . . 32 A 32 LYS middle . . 33 A 33 VAL middle . . 34 A 34 ASP middle . . 35 A 35 HIS middle . . 36 A 36 HIS middle . . 37 A 37 LEU middle . . 38 A 38 GLN middle . . 39 A 39 ASN middle . . 40 A 40 VAL middle . . 41 A 41 ILE middle . . 42 A 42 GLU middle . . 43 A 43 ASP middle . . 44 A 44 ILE middle . . 45 A 45 HIS middle . . 46 A 46 ASP middle . . 47 A 47 PHE middle . . 48 A 48 MET middle . . 49 A 49 GLN middle . . 50 A 50 GLY middle . false 51 A 51 GLY middle . false 52 A 52 GLY middle . false 53 A 53 SER middle . . 54 A 54 GLY middle . false 55 A 55 GLY middle . false 56 A 56 LYS middle . . 57 A 57 LEU middle . . 58 A 58 GLN middle . . 59 A 59 GLU middle . . 60 A 60 MET middle . . 61 A 61 MET middle . . 62 A 62 LYS middle . . 63 A 63 GLU middle . . 64 A 64 PHE middle . . 65 A 65 GLN middle . . 66 A 66 GLN middle . . 67 A 67 VAL middle . . 68 A 68 LEU middle . . 69 A 69 ASP middle . . 70 A 70 GLU middle . . 71 A 71 ILE middle . . 72 A 72 LYS middle . . 73 A 73 GLN middle . . 74 A 74 GLN middle . . 75 A 75 LEU middle . . 76 A 76 GLN middle . . 77 A 77 GLY middle . false 78 A 78 GLY middle . false 79 A 79 ASP middle . . 80 A 80 ASN middle . . 81 A 81 SER middle . . 82 A 82 LEU middle . . 83 A 83 HIS middle . . 84 A 84 ASN middle . . 85 A 85 VAL middle . . 86 A 86 HIS middle . . 87 A 87 GLU middle . . 88 A 88 ASN middle . . 89 A 89 ILE middle . . 90 A 90 LYS middle . . 91 A 91 GLU middle . . 92 A 92 ILE middle . . 93 A 93 PHE middle . . 94 A 94 HIS middle . . 95 A 95 HIS middle . . 96 A 96 LEU middle . . 97 A 97 GLU middle . . 98 A 98 GLU middle . . 99 A 99 LEU middle . . 100 A 100 VAL middle . . 101 A 101 HIS middle . . 102 A 102 ARG end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET HA H 1 4.01 0.02 A 1 MET HBx H 1 2.019 0.02 A 1 MET HBy H 1 2.019 0.02 A 1 MET HGx H 1 2.422 0.02 A 1 MET HGy H 1 2.422 0.02 A 1 MET C C 13 172 0.2 A 1 MET CA C 13 55.09 0.2 A 1 MET CB C 13 32.98 0.2 A 1 MET CG C 13 30.8 0.2 A 2 TYR H H 1 8.688 0.02 A 2 TYR HA H 1 4.737 0.02 A 2 TYR HBy H 1 3.017 0.02 A 2 TYR HBx H 1 2.961 0.02 A 2 TYR HDx H 1 7.038 0.02 A 2 TYR HDy H 1 7.038 0.02 A 2 TYR C C 13 175.9 0.2 A 2 TYR CA C 13 57.92 0.2 A 2 TYR CB C 13 38.34 0.2 A 2 TYR N N 15 122.1 0.2 A 3 GLY H H 1 8.434 0.02 A 3 GLY HAy H 1 3.909 0.02 A 3 GLY HAx H 1 3.841 0.02 A 3 GLY C C 13 174.3 0.2 A 3 GLY CA C 13 46.05 0.2 A 3 GLY N N 15 111.1 0.2 A 4 LYS H H 1 8.06 0.02 A 4 LYS HA H 1 4.297 0.02 A 4 LYS HBx H 1 1.843 0.02 A 4 LYS HBy H 1 1.843 0.02 A 4 LYS HDx H 1 1.69 0.02 A 4 LYS HDy H 1 1.69 0.02 A 4 LYS HEx H 1 2.932 0.02 A 4 LYS HEy H 1 2.932 0.02 A 4 LYS HGx H 1 1.409 0.02 A 4 LYS HGy H 1 1.409 0.02 A 4 LYS C C 13 178 0.2 A 4 LYS CA C 13 56.93 0.2 A 4 LYS CB C 13 32.68 0.2 A 4 LYS CD C 13 28.83 0.2 A 4 LYS CE C 13 42.07 0.2 A 4 LYS CG C 13 24.99 0.2 A 4 LYS N N 15 119.5 0.2 A 5 LEU H H 1 8.243 0.02 A 5 LEU HA H 1 3.947 0.02 A 5 LEU HBx H 1 1.625 0.02 A 5 LEU HBy H 1 1.625 0.02 A 5 LEU HDx% H 1 0.827 0.02 A 5 LEU HDy% H 1 0.8134 0.02 A 5 LEU HG H 1 1.602 0.02 A 5 LEU C C 13 177.9 0.2 A 5 LEU CA C 13 57.93 0.2 A 5 LEU CB C 13 41.62 0.2 A 5 LEU CDx C 13 24.89 0.2 A 5 LEU CDy C 13 24.89 0.2 A 5 LEU CG C 13 27.18 0.2 A 5 LEU N N 15 120.8 0.2 A 6 ASN H H 1 8.256 0.02 A 6 ASN HA H 1 4.252 0.02 A 6 ASN HBy H 1 2.753 0.02 A 6 ASN HBx H 1 2.675 0.02 A 6 ASN HD2y H 1 7.603 0.02 A 6 ASN HD2x H 1 6.773 0.02 A 6 ASN C C 13 177.3 0.2 A 6 ASN CA C 13 56.9 0.2 A 6 ASN CB C 13 38.2 0.2 A 6 ASN N N 15 116.2 0.2 A 6 ASN ND2 N 15 112.4 0.2 A 7 ASP H H 1 7.699 0.02 A 7 ASP HA H 1 4.32 0.02 A 7 ASP HBx H 1 2.73 0.02 A 7 ASP HBy H 1 2.73 0.02 A 7 ASP C C 13 178 0.2 A 7 ASP CA C 13 56.98 0.2 A 7 ASP CB C 13 39.87 0.2 A 7 ASP N N 15 119.1 0.2 A 8 LEU H H 1 7.58 0.02 A 8 LEU HA H 1 4.091 0.02 A 8 LEU HBy H 1 1.782 0.02 A 8 LEU HBx H 1 1.523 0.02 A 8 LEU HDx% H 1 0.7764 0.02 A 8 LEU HDy% H 1 0.7977 0.02 A 8 LEU HG H 1 1.686 0.02 A 8 LEU C C 13 178.8 0.2 A 8 LEU CA C 13 57.79 0.2 A 8 LEU CB C 13 41.88 0.2 A 8 LEU CDy C 13 25.81 0.2 A 8 LEU CDx C 13 24.53 0.2 A 8 LEU CG C 13 27.16 0.2 A 8 LEU N N 15 120.4 0.2 A 9 LEU H H 1 8.125 0.02 A 9 LEU HA H 1 3.891 0.02 A 9 LEU HBy H 1 1.813 0.02 A 9 LEU HBx H 1 1.564 0.02 A 9 LEU HDx% H 1 0.7846 0.02 A 9 LEU HDy% H 1 0.6922 0.02 A 9 LEU HG H 1 1.647 0.02 A 9 LEU C C 13 178.9 0.2 A 9 LEU CA C 13 58.35 0.2 A 9 LEU CB C 13 41.51 0.2 A 9 LEU CDy C 13 24.52 0.2 A 9 LEU CDx C 13 23.34 0.2 A 9 LEU CG C 13 26.06 0.2 A 9 LEU N N 15 118.9 0.2 A 10 GLU H H 1 8.011 0.02 A 10 GLU HA H 1 4.072 0.02 A 10 GLU HBx H 1 2.153 0.02 A 10 GLU HBy H 1 2.153 0.02 A 10 GLU HGx H 1 2.467 0.02 A 10 GLU HGy H 1 2.467 0.02 A 10 GLU C C 13 179 0.2 A 10 GLU CA C 13 59.09 0.2 A 10 GLU CB C 13 27.91 0.2 A 10 GLU CG C 13 34 0.2 A 10 GLU N N 15 119.3 0.2 A 11 ASP H H 1 8.128 0.02 A 11 ASP HA H 1 4.383 0.02 A 11 ASP HBy H 1 3.036 0.02 A 11 ASP HBx H 1 2.712 0.02 A 11 ASP C C 13 178.5 0.2 A 11 ASP CA C 13 56.58 0.2 A 11 ASP CB C 13 38.6 0.2 A 11 ASP N N 15 119.6 0.2 A 12 LEU H H 1 8.394 0.02 A 12 LEU HA H 1 3.923 0.02 A 12 LEU HBy H 1 1.796 0.02 A 12 LEU HBx H 1 1.553 0.02 A 12 LEU HDx% H 1 0.6961 0.02 A 12 LEU HDy% H 1 0.5374 0.02 A 12 LEU HG H 1 1.594 0.02 A 12 LEU C C 13 178.2 0.2 A 12 LEU CA C 13 57.88 0.2 A 12 LEU CB C 13 41.85 0.2 A 12 LEU CDy C 13 24.98 0.2 A 12 LEU CDx C 13 24.36 0.2 A 12 LEU CG C 13 27.05 0.2 A 12 LEU N N 15 120.5 0.2 A 13 GLN H H 1 8.371 0.02 A 13 GLN HA H 1 3.879 0.02 A 13 GLN HBy H 1 2.275 0.02 A 13 GLN HBx H 1 2.109 0.02 A 13 GLN HE2y H 1 7.133 0.02 A 13 GLN HE2x H 1 6.81 0.02 A 13 GLN HGx H 1 2.297 0.02 A 13 GLN HGy H 1 2.297 0.02 A 13 GLN C C 13 178.6 0.2 A 13 GLN CA C 13 59.57 0.2 A 13 GLN CB C 13 28.44 0.2 A 13 GLN CG C 13 34.45 0.2 A 13 GLN N N 15 118.4 0.2 A 13 GLN NE2 N 15 109.8 0.2 A 14 GLU H H 1 7.913 0.02 A 14 GLU HA H 1 4.021 0.02 A 14 GLU HBy H 1 2.222 0.02 A 14 GLU HBx H 1 2.125 0.02 A 14 GLU HGx H 1 2.429 0.02 A 14 GLU HGy H 1 2.429 0.02 A 14 GLU C C 13 179 0.2 A 14 GLU CA C 13 59.03 0.2 A 14 GLU CB C 13 28.72 0.2 A 14 GLU CG C 13 34.86 0.2 A 14 GLU N N 15 119.1 0.2 A 15 VAL H H 1 7.991 0.02 A 15 VAL HA H 1 3.696 0.02 A 15 VAL HB H 1 2.222 0.02 A 15 VAL HGx% H 1 1.034 0.02 A 15 VAL HGy% H 1 0.8971 0.02 A 15 VAL C C 13 178.3 0.2 A 15 VAL CA C 13 66.64 0.2 A 15 VAL CB C 13 31.47 0.2 A 15 VAL CGy C 13 23.14 0.2 A 15 VAL CGx C 13 22.03 0.2 A 15 VAL N N 15 120.3 0.2 A 16 LEU H H 1 8.172 0.02 A 16 LEU HA H 1 3.876 0.02 A 16 LEU HBy H 1 1.668 0.02 A 16 LEU HBx H 1 1.634 0.02 A 16 LEU HDx% H 1 0.7635 0.02 A 16 LEU HDy% H 1 0.7451 0.02 A 16 LEU HG H 1 2.09 0.02 A 16 LEU C C 13 178.4 0.2 A 16 LEU CA C 13 58.05 0.2 A 16 LEU CB C 13 41.42 0.2 A 16 LEU CDy C 13 25.14 0.2 A 16 LEU CDx C 13 24.2 0.2 A 16 LEU CG C 13 26.92 0.2 A 16 LEU N N 15 119.7 0.2 A 17 LYS H H 1 7.755 0.02 A 17 LYS HA H 1 3.951 0.02 A 17 LYS HBx H 1 1.78 0.02 A 17 LYS HBy H 1 1.78 0.02 A 17 LYS HDx H 1 1.587 0.02 A 17 LYS HDy H 1 1.587 0.02 A 17 LYS HEx H 1 2.845 0.02 A 17 LYS HEy H 1 2.845 0.02 A 17 LYS HGx H 1 1.295 0.02 A 17 LYS HGy H 1 1.539 0.02 A 17 LYS C C 13 178.8 0.2 A 17 LYS CA C 13 59.47 0.2 A 17 LYS CB C 13 32.35 0.2 A 17 LYS CD C 13 29.47 0.2 A 17 LYS CE C 13 41.99 0.2 A 17 LYS CG C 13 25.35 0.2 A 17 LYS N N 15 117.8 0.2 A 18 HIS H H 1 7.847 0.02 A 18 HIS HA H 1 4.549 0.02 A 18 HIS HBy H 1 3.38 0.02 A 18 HIS HBx H 1 3.322 0.02 A 18 HIS HD2 H 1 7.276 0.02 A 18 HIS C C 13 177.2 0.2 A 18 HIS CA C 13 57.87 0.2 A 18 HIS CB C 13 28.73 0.2 A 18 HIS N N 15 116.2 0.2 A 19 VAL H H 1 8.415 0.02 A 19 VAL HA H 1 3.746 0.02 A 19 VAL HB H 1 2.178 0.02 A 19 VAL HGx% H 1 0.968 0.02 A 19 VAL HGy% H 1 0.758 0.02 A 19 VAL CA C 13 65.85 0.2 A 19 VAL CB C 13 31.6 0.2 A 19 VAL CGy C 13 22.97 0.2 A 19 VAL CGx C 13 21.31 0.2 A 20 ASN H H 1 8.041 0.02 A 20 ASN HA H 1 4.545 0.02 A 20 ASN HBx H 1 2.743 0.02 A 20 ASN HBy H 1 2.818 0.02 A 20 ASN HD2y H 1 7.56 0.02 A 20 ASN HD2x H 1 6.81 0.02 A 20 ASN C C 13 176.9 0.2 A 20 ASN CA C 13 55.07 0.2 A 20 ASN CB C 13 38.27 0.2 A 20 ASN N N 15 117.9 0.2 A 20 ASN ND2 N 15 111.3 0.2 A 21 GLN H H 1 7.887 0.02 A 21 GLN HA H 1 4.096 0.02 A 21 GLN HBy H 1 1.99 0.02 A 21 GLN HBx H 1 1.887 0.02 A 21 GLN HE2y H 1 7.413 0.02 A 21 GLN HE2x H 1 6.808 0.02 A 21 GLN HGy H 1 2.385 0.02 A 21 GLN HGx H 1 2.214 0.02 A 21 GLN C C 13 176.9 0.2 A 21 GLN CA C 13 57.51 0.2 A 21 GLN CB C 13 29.1 0.2 A 21 GLN CG C 13 33.86 0.2 A 21 GLN N N 15 117.9 0.2 A 21 GLN NE2 N 15 111.4 0.2 A 22 HIS H H 1 7.887 0.02 A 22 HIS HA H 1 4.679 0.02 A 22 HIS HBy H 1 3.33 0.02 A 22 HIS HBx H 1 3.003 0.02 A 22 HIS HD2 H 1 7.104 0.02 A 22 HIS C C 13 174.3 0.2 A 22 HIS CA C 13 55.77 0.2 A 22 HIS CB C 13 28.63 0.2 A 22 HIS N N 15 116.1 0.2 A 23 TRP H H 1 7.929 0.02 A 23 TRP HA H 1 4.542 0.02 A 23 TRP HBy H 1 3.395 0.02 A 23 TRP HBx H 1 3.22 0.02 A 23 TRP HD1 H 1 7.078 0.02 A 23 TRP HE1 H 1 9.973 0.02 A 23 TRP HE3 H 1 7.599 0.02 A 23 TRP HZ2 H 1 7.259 0.02 A 23 TRP C C 13 176.6 0.2 A 23 TRP CA C 13 58.02 0.2 A 23 TRP CB C 13 29.7 0.2 A 23 TRP N N 15 122 0.2 A 23 TRP NE1 N 15 128.7 0.2 A 24 GLN H H 1 8.258 0.02 A 24 GLN HA H 1 4.329 0.02 A 24 GLN HBx H 1 1.822 0.02 A 24 GLN HBy H 1 2.045 0.02 A 24 GLN HE2y H 1 7.312 0.02 A 24 GLN HE2x H 1 6.761 0.02 A 24 GLN HGx H 1 2.245 0.02 A 24 GLN HGy H 1 2.245 0.02 A 24 GLN C C 13 176.2 0.2 A 24 GLN CA C 13 55.96 0.2 A 24 GLN CB C 13 29.44 0.2 A 24 GLN CG C 13 33.72 0.2 A 24 GLN N N 15 123.8 0.2 A 24 GLN NE2 N 15 112 0.2 A 25 GLY H H 1 7.47 0.02 A 25 GLY HAy H 1 3.939 0.02 A 25 GLY HAx H 1 3.8 0.02 A 25 GLY C C 13 174.8 0.2 A 25 GLY CA C 13 45.47 0.2 A 25 GLY N N 15 108.1 0.2 A 26 GLY H H 1 8.332 0.02 A 26 GLY HAy H 1 4.105 0.02 A 26 GLY HAx H 1 3.974 0.02 A 26 GLY C C 13 174.9 0.2 A 26 GLY CA C 13 45.41 0.2 A 26 GLY N N 15 108.7 0.2 A 27 GLN H H 1 8.474 0.02 A 27 GLN HA H 1 4.106 0.02 A 27 GLN HBx H 1 2.034 0.02 A 27 GLN HBy H 1 2.05 0.02 A 27 GLN HE2y H 1 7.493 0.02 A 27 GLN HE2x H 1 6.815 0.02 A 27 GLN HGx H 1 2.339 0.02 A 27 GLN HGy H 1 2.339 0.02 A 27 GLN C C 13 177.1 0.2 A 27 GLN CA C 13 57.54 0.2 A 27 GLN CB C 13 29.05 0.2 A 27 GLN CG C 13 33.92 0.2 A 27 GLN N N 15 121.1 0.2 A 27 GLN NE2 N 15 112.4 0.2 A 28 LYS H H 1 8.448 0.02 A 28 LYS HA H 1 4.068 0.02 A 28 LYS HBx H 1 1.762 0.02 A 28 LYS HBy H 1 1.762 0.02 A 28 LYS HDx H 1 1.422 0.02 A 28 LYS HDy H 1 1.422 0.02 A 28 LYS HEx H 1 2.925 0.02 A 28 LYS HEy H 1 2.925 0.02 A 28 LYS HGx H 1 1.319 0.02 A 28 LYS HGy H 1 1.319 0.02 A 28 LYS C C 13 177.9 0.2 A 28 LYS CA C 13 58.41 0.2 A 28 LYS CB C 13 32.21 0.2 A 28 LYS CD C 13 29.12 0.2 A 28 LYS CE C 13 41.93 0.2 A 28 LYS CG C 13 24.89 0.2 A 28 LYS N N 15 120.5 0.2 A 29 ASN H H 1 8.273 0.02 A 29 ASN HA H 1 4.584 0.02 A 29 ASN HBy H 1 2.914 0.02 A 29 ASN HBx H 1 2.825 0.02 A 29 ASN HD2y H 1 7.681 0.02 A 29 ASN HD2x H 1 6.978 0.02 A 29 ASN C C 13 176.2 0.2 A 29 ASN CA C 13 54.4 0.2 A 29 ASN CB C 13 38.28 0.2 A 29 ASN N N 15 117.5 0.2 A 29 ASN ND2 N 15 112.6 0.2 A 30 MET H H 1 7.87 0.02 A 30 MET HA H 1 4.085 0.02 A 30 MET HBx H 1 2.542 0.02 A 30 MET HBy H 1 2.542 0.02 A 30 MET HGx H 1 2.814 0.02 A 30 MET HGy H 1 2.814 0.02 A 30 MET C C 13 177 0.2 A 30 MET CA C 13 56.88 0.2 A 30 MET CB C 13 32.34 0.2 A 30 MET CG C 13 30.77 0.2 A 30 MET N N 15 121.1 0.2 A 31 ASN H H 1 8.186 0.02 A 31 ASN HA H 1 4.311 0.02 A 31 ASN HBx H 1 2.743 0.02 A 31 ASN HBy H 1 2.743 0.02 A 31 ASN HD2y H 1 7.508 0.02 A 31 ASN HD2x H 1 6.865 0.02 A 31 ASN C C 13 176.7 0.2 A 31 ASN CA C 13 55.32 0.2 A 31 ASN CB C 13 38.41 0.2 A 31 ASN N N 15 117.9 0.2 A 31 ASN ND2 N 15 112 0.2 A 32 LYS H H 1 7.792 0.02 A 32 LYS HA H 1 3.992 0.02 A 32 LYS HBx H 1 1.795 0.02 A 32 LYS HBy H 1 1.795 0.02 A 32 LYS HDx H 1 1.442 0.02 A 32 LYS HDy H 1 1.442 0.02 A 32 LYS HEx H 1 2.927 0.02 A 32 LYS HEy H 1 2.927 0.02 A 32 LYS HGx H 1 1.321 0.02 A 32 LYS HGy H 1 1.321 0.02 A 32 LYS C C 13 177.9 0.2 A 32 LYS CA C 13 59.05 0.2 A 32 LYS CB C 13 32.46 0.2 A 32 LYS CD C 13 29.27 0.2 A 32 LYS CE C 13 42.1 0.2 A 32 LYS CG C 13 24.89 0.2 A 32 LYS N N 15 120.4 0.2 A 33 VAL H H 1 7.689 0.02 A 33 VAL HA H 1 3.791 0.02 A 33 VAL HB H 1 1.932 0.02 A 33 VAL HGx% H 1 0.9561 0.02 A 33 VAL HGy% H 1 0.7562 0.02 A 33 VAL C C 13 177.1 0.2 A 33 VAL CA C 13 65.36 0.2 A 33 VAL CB C 13 31.92 0.2 A 33 VAL CGy C 13 22.76 0.2 A 33 VAL CGx C 13 21.13 0.2 A 33 VAL N N 15 120.2 0.2 A 34 ASP H H 1 8.408 0.02 A 34 ASP HA H 1 4.303 0.02 A 34 ASP HBx H 1 2.714 0.02 A 34 ASP HBy H 1 2.714 0.02 A 34 ASP C C 13 178.2 0.2 A 34 ASP CA C 13 55.88 0.2 A 34 ASP CB C 13 38.71 0.2 A 34 ASP N N 15 120.1 0.2 A 35 HIS H H 1 8.204 0.02 A 35 HIS HA H 1 4.343 0.02 A 35 HIS HBx H 1 3.137 0.02 A 35 HIS HBy H 1 3.137 0.02 A 35 HIS C C 13 176.8 0.2 A 35 HIS CA C 13 58.31 0.2 A 35 HIS CB C 13 28.07 0.2 A 35 HIS N N 15 118.2 0.2 A 36 HIS H H 1 8.067 0.02 A 36 HIS HA H 1 4.602 0.02 A 36 HIS HBx H 1 3.276 0.02 A 36 HIS HBy H 1 3.276 0.02 A 36 HIS HD2 H 1 7.434 0.02 A 36 HIS C C 13 177.1 0.2 A 36 HIS CA C 13 58.52 0.2 A 36 HIS CB C 13 28.72 0.2 A 36 HIS N N 15 117.1 0.2 A 37 LEU H H 1 8.473 0.02 A 37 LEU HA H 1 3.894 0.02 A 37 LEU HBy H 1 1.887 0.02 A 37 LEU HBx H 1 1.517 0.02 A 37 LEU HDx% H 1 0.7807 0.02 A 37 LEU HDy% H 1 0.7807 0.02 A 37 LEU HG H 1 1.716 0.02 A 37 LEU C C 13 178.2 0.2 A 37 LEU CA C 13 58.52 0.2 A 37 LEU CB C 13 41.81 0.2 A 37 LEU CDy C 13 25.73 0.2 A 37 LEU CDx C 13 24.65 0.2 A 37 LEU CG C 13 27.29 0.2 A 37 LEU N N 15 119.6 0.2 A 38 GLN H H 1 8.337 0.02 A 38 GLN HA H 1 3.882 0.02 A 38 GLN HBy H 1 2.039 0.02 A 38 GLN HBx H 1 1.901 0.02 A 38 GLN HE2y H 1 7.423 0.02 A 38 GLN HE2x H 1 6.802 0.02 A 38 GLN HGy H 1 2.31 0.02 A 38 GLN HGx H 1 2.127 0.02 A 38 GLN C C 13 178.5 0.2 A 38 GLN CA C 13 59.2 0.2 A 38 GLN CB C 13 27.85 0.2 A 38 GLN CG C 13 33.91 0.2 A 38 GLN N N 15 118 0.2 A 38 GLN NE2 N 15 111.6 0.2 A 39 ASN H H 1 7.923 0.02 A 39 ASN HA H 1 4.39 0.02 A 39 ASN HBy H 1 3.075 0.02 A 39 ASN HBx H 1 2.811 0.02 A 39 ASN HD2y H 1 7.826 0.02 A 39 ASN HD2x H 1 6.464 0.02 A 39 ASN C C 13 177.5 0.2 A 39 ASN CA C 13 55.78 0.2 A 39 ASN CB C 13 37.45 0.2 A 39 ASN N N 15 118.7 0.2 A 39 ASN ND2 N 15 110.3 0.2 A 40 VAL H H 1 7.907 0.02 A 40 VAL HA H 1 3.629 0.02 A 40 VAL HB H 1 2.174 0.02 A 40 VAL HGx% H 1 0.9479 0.02 A 40 VAL HGy% H 1 0.7661 0.02 A 40 VAL C C 13 177.5 0.2 A 40 VAL CA C 13 67.08 0.2 A 40 VAL CB C 13 31.39 0.2 A 40 VAL CGy C 13 23.05 0.2 A 40 VAL CGx C 13 22.16 0.2 A 40 VAL N N 15 120.4 0.2 A 41 ILE H H 1 8.103 0.02 A 41 ILE HA H 1 3.401 0.02 A 41 ILE HB H 1 1.904 0.02 A 41 ILE HD1% H 1 0.6862 0.02 A 41 ILE HG1x H 1 0.8238 0.02 A 41 ILE HG1y H 1 0.8238 0.02 A 41 ILE HG2% H 1 0.832 0.02 A 41 ILE C C 13 178 0.2 A 41 ILE CA C 13 66.43 0.2 A 41 ILE CB C 13 38.05 0.2 A 41 ILE CD1 C 13 13.45 0.2 A 41 ILE CG1 C 13 31.02 0.2 A 41 ILE CG2 C 13 17.07 0.2 A 41 ILE N N 15 120.6 0.2 A 42 GLU H H 1 8.15 0.02 A 42 GLU HA H 1 4.062 0.02 A 42 GLU HBx H 1 2.144 0.02 A 42 GLU HBy H 1 2.144 0.02 A 42 GLU HGx H 1 2.466 0.02 A 42 GLU HGy H 1 2.466 0.02 A 42 GLU C C 13 178.5 0.2 A 42 GLU CA C 13 59.12 0.2 A 42 GLU CB C 13 28.16 0.2 A 42 GLU CG C 13 34.4 0.2 A 42 GLU N N 15 119.9 0.2 A 43 ASP H H 1 8.453 0.02 A 43 ASP HA H 1 4.445 0.02 A 43 ASP HBy H 1 3.192 0.02 A 43 ASP HBx H 1 2.716 0.02 A 43 ASP C C 13 178.4 0.2 A 43 ASP CA C 13 56.49 0.2 A 43 ASP CB C 13 37.82 0.2 A 43 ASP N N 15 119.7 0.2 A 44 ILE H H 1 8.544 0.02 A 44 ILE HA H 1 3.59 0.02 A 44 ILE HB H 1 1.962 0.02 A 44 ILE HD1% H 1 0.6807 0.02 A 44 ILE HG1x H 1 0.8519 0.02 A 44 ILE HG1y H 1 0.8519 0.02 A 44 ILE HG2% H 1 0.8629 0.02 A 44 ILE C C 13 177.8 0.2 A 44 ILE CA C 13 66.32 0.2 A 44 ILE CB C 13 37.69 0.2 A 44 ILE CD1 C 13 14.4 0.2 A 44 ILE CG1 C 13 29.83 0.2 A 44 ILE CG2 C 13 18.6 0.2 A 44 ILE N N 15 121.5 0.2 A 45 HIS H H 1 8.261 0.02 A 45 HIS HA H 1 4.255 0.02 A 45 HIS HBx H 1 3.406 0.02 A 45 HIS HBy H 1 3.406 0.02 A 45 HIS HD2 H 1 7.293 0.02 A 45 HIS C C 13 177.2 0.2 A 45 HIS CA C 13 59.58 0.2 A 45 HIS CB C 13 27.79 0.2 A 45 HIS N N 15 118.8 0.2 A 46 ASP H H 1 8.68 0.02 A 46 ASP HA H 1 4.338 0.02 A 46 ASP HBx H 1 2.753 0.02 A 46 ASP HBy H 1 2.937 0.02 A 46 ASP C C 13 178.7 0.2 A 46 ASP CA C 13 57.01 0.2 A 46 ASP CB C 13 39.4 0.2 A 46 ASP N N 15 119.2 0.2 A 47 PHE H H 1 8.38 0.02 A 47 PHE HA H 1 4.07 0.02 A 47 PHE HBy H 1 3.186 0.02 A 47 PHE HBx H 1 3.116 0.02 A 47 PHE HDx H 1 7.102 0.02 A 47 PHE HDy H 1 7.102 0.02 A 47 PHE C C 13 178.6 0.2 A 47 PHE CA C 13 61.25 0.2 A 47 PHE CB C 13 39.57 0.2 A 47 PHE N N 15 121.8 0.2 A 48 MET H H 1 8.366 0.02 A 48 MET HA H 1 3.998 0.02 A 48 MET HBx H 1 2.166 0.02 A 48 MET HBy H 1 2.166 0.02 A 48 MET HGx H 1 2.51 0.02 A 48 MET HGy H 1 2.773 0.02 A 48 MET C C 13 177.4 0.2 A 48 MET CA C 13 58.47 0.2 A 48 MET CB C 13 33.17 0.2 A 48 MET CG C 13 32.58 0.2 A 48 MET N N 15 117.7 0.2 A 49 GLN H H 1 7.659 0.02 A 49 GLN HA H 1 4.258 0.02 A 49 GLN HBy H 1 2.13 0.02 A 49 GLN HBx H 1 1.977 0.02 A 49 GLN HE2y H 1 7.3 0.02 A 49 GLN HE2x H 1 6.791 0.02 A 49 GLN HGx H 1 2.295 0.02 A 49 GLN HGy H 1 2.302 0.02 A 49 GLN C C 13 176.7 0.2 A 49 GLN CA C 13 56.38 0.2 A 49 GLN CB C 13 28.98 0.2 A 49 GLN CG C 13 33.81 0.2 A 49 GLN N N 15 116.7 0.2 A 49 GLN NE2 N 15 111.5 0.2 A 50 GLY H H 1 7.685 0.02 A 50 GLY HAx H 1 3.998 0.02 A 50 GLY HAy H 1 3.998 0.02 A 50 GLY C C 13 174.9 0.2 A 50 GLY CA C 13 45.46 0.2 A 50 GLY N N 15 106.4 0.2 A 51 GLY H H 1 8.031 0.02 A 51 GLY HAx H 1 3.817 0.02 A 51 GLY HAy H 1 3.817 0.02 A 51 GLY C C 13 174.5 0.2 A 51 GLY CA C 13 45.19 0.2 A 51 GLY N N 15 108.9 0.2 A 52 GLY H H 1 8.126 0.02 A 52 GLY HAx H 1 3.362 0.02 A 52 GLY HAy H 1 3.362 0.02 A 52 GLY C C 13 173.3 0.2 A 52 GLY CA C 13 45.12 0.2 A 52 GLY N N 15 108.1 0.2 A 53 SER H H 1 7.594 0.02 A 53 SER HA H 1 4.53 0.02 A 53 SER HBy H 1 4.042 0.02 A 53 SER HBx H 1 3.94 0.02 A 53 SER C C 13 175.3 0.2 A 53 SER CA C 13 57.77 0.2 A 53 SER CB C 13 64.75 0.2 A 53 SER N N 15 114.1 0.2 A 54 GLY H H 1 9.003 0.02 A 54 GLY HAy H 1 4.037 0.02 A 54 GLY HAx H 1 3.911 0.02 A 54 GLY C C 13 176.5 0.2 A 54 GLY CA C 13 47.04 0.2 A 54 GLY N N 15 110.4 0.2 A 55 GLY H H 1 8.617 0.02 A 55 GLY HAx H 1 3.946 0.02 A 55 GLY HAy H 1 3.946 0.02 A 55 GLY C C 13 176.4 0.2 A 55 GLY CA C 13 46.63 0.2 A 55 GLY N N 15 109.8 0.2 A 56 LYS H H 1 7.876 0.02 A 56 LYS HA H 1 4.195 0.02 A 56 LYS HBx H 1 1.922 0.02 A 56 LYS HBy H 1 1.922 0.02 A 56 LYS HDx H 1 1.711 0.02 A 56 LYS HDy H 1 1.711 0.02 A 56 LYS HEx H 1 2.935 0.02 A 56 LYS HEy H 1 2.935 0.02 A 56 LYS HGx H 1 1.513 0.02 A 56 LYS HGy H 1 1.513 0.02 A 56 LYS C C 13 178.6 0.2 A 56 LYS CA C 13 57.96 0.2 A 56 LYS CB C 13 32.11 0.2 A 56 LYS CD C 13 28.43 0.2 A 56 LYS CE C 13 41.9 0.2 A 56 LYS CG C 13 25.03 0.2 A 56 LYS N N 15 121.8 0.2 A 57 LEU H H 1 8.153 0.02 A 57 LEU HA H 1 3.992 0.02 A 57 LEU HBy H 1 1.787 0.02 A 57 LEU HBx H 1 1.636 0.02 A 57 LEU HDx% H 1 0.6901 0.02 A 57 LEU HDy% H 1 0.6291 0.02 A 57 LEU HG H 1 1.485 0.02 A 57 LEU C C 13 178.4 0.2 A 57 LEU CA C 13 58.19 0.2 A 57 LEU CB C 13 41.36 0.2 A 57 LEU CDy C 13 24.92 0.2 A 57 LEU CDx C 13 23.94 0.2 A 57 LEU CG C 13 27.03 0.2 A 57 LEU N N 15 120.7 0.2 A 58 GLN H H 1 8.019 0.02 A 58 GLN HA H 1 3.942 0.02 A 58 GLN HBx H 1 2.148 0.02 A 58 GLN HBy H 1 2.148 0.02 A 58 GLN HE2y H 1 7.468 0.02 A 58 GLN HE2x H 1 6.839 0.02 A 58 GLN HGx H 1 2.427 0.02 A 58 GLN HGy H 1 2.427 0.02 A 58 GLN C C 13 179.1 0.2 A 58 GLN CA C 13 59.36 0.2 A 58 GLN CB C 13 28.03 0.2 A 58 GLN CG C 13 34.06 0.2 A 58 GLN N N 15 117.4 0.2 A 58 GLN NE2 N 15 111.9 0.2 A 59 GLU H H 1 7.838 0.02 A 59 GLU HA H 1 4.03 0.02 A 59 GLU HBx H 1 2.142 0.02 A 59 GLU HBy H 1 2.142 0.02 A 59 GLU HGx H 1 2.354 0.02 A 59 GLU HGy H 1 2.426 0.02 A 59 GLU C C 13 178.6 0.2 A 59 GLU CA C 13 59.25 0.2 A 59 GLU CB C 13 28.96 0.2 A 59 GLU CG C 13 35.16 0.2 A 59 GLU N N 15 119.9 0.2 A 60 MET H H 1 8.223 0.02 A 60 MET HA H 1 3.966 0.02 A 60 MET HBx H 1 2.2 0.02 A 60 MET HBy H 1 2.379 0.02 A 60 MET HGy H 1 2.5 0.02 A 60 MET HGx H 1 2.362 0.02 A 60 MET C C 13 177.9 0.2 A 60 MET CA C 13 59.35 0.2 A 60 MET CB C 13 33.21 0.2 A 60 MET CG C 13 31.59 0.2 A 60 MET N N 15 120.1 0.2 A 61 MET H H 1 8.134 0.02 A 61 MET HA H 1 4.195 0.02 A 61 MET HBx H 1 2.094 0.02 A 61 MET HBy H 1 2.165 0.02 A 61 MET HGx H 1 2.443 0.02 A 61 MET HGy H 1 2.515 0.02 A 61 MET C C 13 179.1 0.2 A 61 MET CA C 13 58.21 0.2 A 61 MET CB C 13 31.34 0.2 A 61 MET CG C 13 32.43 0.2 A 61 MET N N 15 117 0.2 A 62 LYS H H 1 7.782 0.02 A 62 LYS HA H 1 4.085 0.02 A 62 LYS HBx H 1 1.937 0.02 A 62 LYS HBy H 1 1.937 0.02 A 62 LYS HDx H 1 1.658 0.02 A 62 LYS HDy H 1 1.658 0.02 A 62 LYS HEx H 1 2.925 0.02 A 62 LYS HEy H 1 2.925 0.02 A 62 LYS HGx H 1 1.384 0.02 A 62 LYS HGy H 1 1.56 0.02 A 62 LYS C C 13 179.6 0.2 A 62 LYS CA C 13 59.61 0.2 A 62 LYS CB C 13 32.18 0.2 A 62 LYS CD C 13 29.24 0.2 A 62 LYS CE C 13 42.11 0.2 A 62 LYS CG C 13 25.06 0.2 A 62 LYS N N 15 120.6 0.2 A 63 GLU H H 1 8.041 0.02 A 63 GLU HA H 1 4.057 0.02 A 63 GLU HBx H 1 2.142 0.02 A 63 GLU HBy H 1 2.142 0.02 A 63 GLU HGx H 1 2.406 0.02 A 63 GLU HGy H 1 2.406 0.02 A 63 GLU C C 13 178.9 0.2 A 63 GLU CA C 13 59.17 0.2 A 63 GLU CB C 13 29 0.2 A 63 GLU CG C 13 35.61 0.2 A 63 GLU N N 15 120.2 0.2 A 64 PHE H H 1 8.604 0.02 A 64 PHE HA H 1 4.155 0.02 A 64 PHE HBy H 1 3.228 0.02 A 64 PHE HBx H 1 3.054 0.02 A 64 PHE HDx H 1 7.143 0.02 A 64 PHE HDy H 1 7.143 0.02 A 64 PHE C C 13 177.8 0.2 A 64 PHE CA C 13 59.82 0.2 A 64 PHE CB C 13 38.47 0.2 A 64 PHE N N 15 119.7 0.2 A 65 GLN H H 1 8.177 0.02 A 65 GLN HA H 1 3.637 0.02 A 65 GLN HBx H 1 2.155 0.02 A 65 GLN HBy H 1 2.155 0.02 A 65 GLN HE2y H 1 7.442 0.02 A 65 GLN HE2x H 1 6.669 0.02 A 65 GLN HGx H 1 2.278 0.02 A 65 GLN HGy H 1 2.278 0.02 A 65 GLN C C 13 177.8 0.2 A 65 GLN CA C 13 58.97 0.2 A 65 GLN CB C 13 28.28 0.2 A 65 GLN CG C 13 33.86 0.2 A 65 GLN N N 15 118.5 0.2 A 65 GLN NE2 N 15 113.5 0.2 A 66 GLN H H 1 7.622 0.02 A 66 GLN HA H 1 4.04 0.02 A 66 GLN HBy H 1 1.908 0.02 A 66 GLN HBx H 1 1.752 0.02 A 66 GLN HE2y H 1 7.221 0.02 A 66 GLN HE2x H 1 6.717 0.02 A 66 GLN HGy H 1 2.325 0.02 A 66 GLN HGx H 1 2.172 0.02 A 66 GLN C C 13 178.6 0.2 A 66 GLN CA C 13 59.15 0.2 A 66 GLN CB C 13 28.23 0.2 A 66 GLN CG C 13 34.19 0.2 A 66 GLN N N 15 117.4 0.2 A 66 GLN NE2 N 15 111 0.2 A 67 VAL H H 1 7.744 0.02 A 67 VAL HA H 1 3.785 0.02 A 67 VAL HB H 1 2.249 0.02 A 67 VAL HGx% H 1 1.047 0.02 A 67 VAL HGy% H 1 0.8975 0.02 A 67 VAL C C 13 177.5 0.2 A 67 VAL CA C 13 66.22 0.2 A 67 VAL CB C 13 31.39 0.2 A 67 VAL CGy C 13 23.91 0.2 A 67 VAL CGx C 13 21.44 0.2 A 67 VAL N N 15 119.5 0.2 A 68 LEU H H 1 7.983 0.02 A 68 LEU HA H 1 3.825 0.02 A 68 LEU HBy H 1 1.681 0.02 A 68 LEU HBx H 1 1.544 0.02 A 68 LEU HDx% H 1 0.4678 0.02 A 68 LEU HDy% H 1 0.5563 0.02 A 68 LEU HG H 1 1.491 0.02 A 68 LEU C C 13 179.1 0.2 A 68 LEU CA C 13 58.74 0.2 A 68 LEU CB C 13 41.09 0.2 A 68 LEU CDy C 13 25.04 0.2 A 68 LEU CDx C 13 24.21 0.2 A 68 LEU CG C 13 27.11 0.2 A 68 LEU N N 15 120.4 0.2 A 69 ASP H H 1 8.179 0.02 A 69 ASP HA H 1 4.38 0.02 A 69 ASP HBy H 1 2.798 0.02 A 69 ASP HBx H 1 2.664 0.02 A 69 ASP C C 13 178.9 0.2 A 69 ASP CA C 13 57.32 0.2 A 69 ASP CB C 13 40.04 0.2 A 69 ASP N N 15 119 0.2 A 70 GLU H H 1 8.166 0.02 A 70 GLU HA H 1 4.082 0.02 A 70 GLU HBx H 1 2.06 0.02 A 70 GLU HBy H 1 2.06 0.02 A 70 GLU HGx H 1 2.416 0.02 A 70 GLU HGy H 1 2.416 0.02 A 70 GLU C C 13 179.6 0.2 A 70 GLU CA C 13 59.01 0.2 A 70 GLU CB C 13 28.9 0.2 A 70 GLU CG C 13 35.22 0.2 A 70 GLU N N 15 120.5 0.2 A 71 ILE H H 1 8.415 0.02 A 71 ILE HA H 1 3.79 0.02 A 71 ILE HB H 1 2.019 0.02 A 71 ILE HD1% H 1 0.7726 0.02 A 71 ILE HG1x H 1 1.193 0.02 A 71 ILE HG1y H 1 1.193 0.02 A 71 ILE HG2% H 1 0.8606 0.02 A 71 ILE C C 13 177.4 0.2 A 71 ILE CA C 13 64.89 0.2 A 71 ILE CB C 13 37.68 0.2 A 71 ILE CD1 C 13 13.85 0.2 A 71 ILE CG1 C 13 32.8 0.2 A 71 ILE CG2 C 13 17.75 0.2 A 71 ILE N N 15 119.2 0.2 A 72 LYS H H 1 8.248 0.02 A 72 LYS HA H 1 3.625 0.02 A 72 LYS HBy H 1 1.978 0.02 A 72 LYS HBx H 1 1.905 0.02 A 72 LYS HEx H 1 2.909 0.02 A 72 LYS HEy H 1 2.909 0.02 A 72 LYS HGx H 1 1.329 0.02 A 72 LYS HGy H 1 1.329 0.02 A 72 LYS C C 13 178.4 0.2 A 72 LYS CA C 13 59.85 0.2 A 72 LYS CB C 13 32.07 0.2 A 72 LYS CD C 13 29.39 0.2 A 72 LYS CE C 13 42.03 0.2 A 72 LYS CG C 13 24.83 0.2 A 72 LYS N N 15 120.8 0.2 A 73 GLN H H 1 7.937 0.02 A 73 GLN HA H 1 4.042 0.02 A 73 GLN HBx H 1 2.136 0.02 A 73 GLN HBy H 1 2.136 0.02 A 73 GLN HE2y H 1 7.417 0.02 A 73 GLN HE2x H 1 6.786 0.02 A 73 GLN HGy H 1 2.466 0.02 A 73 GLN HGx H 1 2.378 0.02 A 73 GLN C C 13 178.4 0.2 A 73 GLN CA C 13 58.51 0.2 A 73 GLN CB C 13 28.43 0.2 A 73 GLN CG C 13 33.98 0.2 A 73 GLN N N 15 117 0.2 A 73 GLN NE2 N 15 111.8 0.2 A 74 GLN H H 1 7.712 0.02 A 74 GLN HA H 1 4.08 0.02 A 74 GLN HBx H 1 1.997 0.02 A 74 GLN HBy H 1 1.997 0.02 A 74 GLN HE2y H 1 7.463 0.02 A 74 GLN HE2x H 1 6.528 0.02 A 74 GLN HGx H 1 2.164 0.02 A 74 GLN HGy H 1 2.164 0.02 A 74 GLN C C 13 177.8 0.2 A 74 GLN CA C 13 57.27 0.2 A 74 GLN CB C 13 28.7 0.2 A 74 GLN CG C 13 33.59 0.2 A 74 GLN N N 15 118.2 0.2 A 74 GLN NE2 N 15 111.3 0.2 A 75 LEU H H 1 7.956 0.02 A 75 LEU HA H 1 4.212 0.02 A 75 LEU HBy H 1 1.627 0.02 A 75 LEU HBx H 1 1.583 0.02 A 75 LEU HDx% H 1 0.6648 0.02 A 75 LEU HDy% H 1 0.6973 0.02 A 75 LEU HG H 1 1.609 0.02 A 75 LEU CA C 13 56.66 0.2 A 75 LEU CB C 13 42 0.2 A 75 LEU CDy C 13 25.41 0.2 A 75 LEU CDx C 13 24.18 0.2 A 75 LEU CG C 13 26.6 0.2 A 75 LEU N N 15 120.7 0.2 A 76 GLN H H 1 8.315 0.02 A 76 GLN HA H 1 4.113 0.02 A 76 GLN HBx H 1 2.064 0.02 A 76 GLN HBy H 1 2.064 0.02 A 76 GLN HE2y H 1 7.342 0.02 A 76 GLN HE2x H 1 6.707 0.02 A 76 GLN HGx H 1 2.381 0.02 A 76 GLN HGy H 1 2.381 0.02 A 76 GLN C C 13 177.1 0.2 A 76 GLN CA C 13 57.4 0.2 A 76 GLN CB C 13 28.64 0.2 A 76 GLN CG C 13 34.04 0.2 A 76 GLN N N 15 120.1 0.2 A 76 GLN NE2 N 15 111.2 0.2 A 77 GLY H H 1 8.021 0.02 A 77 GLY HAy H 1 4.042 0.02 A 77 GLY HAx H 1 3.869 0.02 A 77 GLY C C 13 174.6 0.2 A 77 GLY CA C 13 45.43 0.2 A 77 GLY N N 15 107.7 0.2 A 78 GLY H H 1 7.819 0.02 A 78 GLY HAy H 1 4.208 0.02 A 78 GLY HAx H 1 3.801 0.02 A 78 GLY C C 13 173.9 0.2 A 78 GLY CA C 13 45.14 0.2 A 78 GLY N N 15 107.1 0.2 A 79 ASP H H 1 7.912 0.02 A 79 ASP HA H 1 4.722 0.02 A 79 ASP HBy H 1 2.768 0.02 A 79 ASP HBx H 1 2.583 0.02 A 79 ASP C C 13 176.2 0.2 A 79 ASP CA C 13 53.21 0.2 A 79 ASP CB C 13 40.16 0.2 A 79 ASP N N 15 119.8 0.2 A 80 ASN H H 1 8.45 0.02 A 80 ASN HA H 1 4.593 0.02 A 80 ASN HBx H 1 2.807 0.02 A 80 ASN HBy H 1 2.807 0.02 A 80 ASN HD2y H 1 7.585 0.02 A 80 ASN HD2x H 1 6.902 0.02 A 80 ASN C C 13 177.3 0.2 A 80 ASN CA C 13 54.68 0.2 A 80 ASN CB C 13 38.79 0.2 A 80 ASN N N 15 121.7 0.2 A 80 ASN ND2 N 15 113.2 0.2 A 81 SER H H 1 8.444 0.02 A 81 SER HA H 1 4.263 0.02 A 81 SER HBx H 1 3.872 0.02 A 81 SER HBy H 1 3.872 0.02 A 81 SER C C 13 176.1 0.2 A 81 SER CA C 13 61.47 0.2 A 81 SER CB C 13 61.47 0.2 A 81 SER N N 15 117.1 0.2 A 82 LEU H H 1 7.929 0.02 A 82 LEU HA H 1 4.332 0.02 A 82 LEU HBx H 1 1.653 0.02 A 82 LEU HBy H 1 1.653 0.02 A 82 LEU HDx% H 1 0.8396 0.02 A 82 LEU HDy% H 1 0.7069 0.02 A 82 LEU HG H 1 1.514 0.02 A 82 LEU C C 13 177.4 0.2 A 82 LEU CA C 13 55.06 0.2 A 82 LEU CB C 13 41.94 0.2 A 82 LEU CDy C 13 26.22 0.2 A 82 LEU CDx C 13 23.34 0.2 A 82 LEU CG C 13 26.76 0.2 A 82 LEU N N 15 120.4 0.2 A 83 HIS H H 1 8.014 0.02 A 83 HIS HA H 1 4.173 0.02 A 83 HIS HBx H 1 3.344 0.02 A 83 HIS HBy H 1 3.344 0.02 A 83 HIS C C 13 176.1 0.2 A 83 HIS CA C 13 59.94 0.2 A 83 HIS CB C 13 28.05 0.2 A 83 HIS N N 15 119.4 0.2 A 84 ASN H H 1 8.598 0.02 A 84 ASN HA H 1 4.735 0.02 A 84 ASN HBx H 1 2.806 0.02 A 84 ASN HBy H 1 2.806 0.02 A 84 ASN HD2y H 1 7.592 0.02 A 84 ASN HD2x H 1 6.941 0.02 A 84 ASN C C 13 177.4 0.2 A 84 ASN CA C 13 55.79 0.2 A 84 ASN CB C 13 37.52 0.2 A 84 ASN N N 15 118.1 0.2 A 84 ASN ND2 N 15 112.3 0.2 A 85 VAL H H 1 7.933 0.02 A 85 VAL HA H 1 3.849 0.02 A 85 VAL HB H 1 2.053 0.02 A 85 VAL HGx% H 1 0.9928 0.02 A 85 VAL HGy% H 1 0.8819 0.02 A 85 VAL C C 13 177.1 0.2 A 85 VAL CA C 13 65.49 0.2 A 85 VAL CB C 13 31.76 0.2 A 85 VAL CGy C 13 22.45 0.2 A 85 VAL CGx C 13 21.52 0.2 A 85 VAL N N 15 120.5 0.2 A 86 HIS H H 1 8.46 0.02 A 86 HIS HA H 1 4.054 0.02 A 86 HIS HBy H 1 3.334 0.02 A 86 HIS HBx H 1 3.085 0.02 A 86 HIS HD2 H 1 6.889 0.02 A 86 HIS C C 13 176.3 0.2 A 86 HIS CA C 13 59.86 0.2 A 86 HIS CB C 13 29.67 0.2 A 86 HIS N N 15 119.3 0.2 A 87 GLU H H 1 7.897 0.02 A 87 GLU HA H 1 3.838 0.02 A 87 GLU HBx H 1 2.019 0.02 A 87 GLU HBy H 1 2.019 0.02 A 87 GLU HGx H 1 2.252 0.02 A 87 GLU HGy H 1 2.252 0.02 A 87 GLU C C 13 178.3 0.2 A 87 GLU CA C 13 58.69 0.2 A 87 GLU CB C 13 28.46 0.2 A 87 GLU CG C 13 35.1 0.2 A 87 GLU N N 15 117.1 0.2 A 88 ASN H H 1 8.103 0.02 A 88 ASN HA H 1 4.503 0.02 A 88 ASN HBx H 1 2.763 0.02 A 88 ASN HBy H 1 2.866 0.02 A 88 ASN HD2y H 1 7.415 0.02 A 88 ASN HD2x H 1 6.98 0.02 A 88 ASN C C 13 177.7 0.2 A 88 ASN CA C 13 55.99 0.2 A 88 ASN CB C 13 39.01 0.2 A 88 ASN N N 15 118.4 0.2 A 88 ASN ND2 N 15 111.2 0.2 A 89 ILE H H 1 8.501 0.02 A 89 ILE HA H 1 3.67 0.02 A 89 ILE HB H 1 1.843 0.02 A 89 ILE HD1% H 1 0.6992 0.02 A 89 ILE HG1x H 1 1.024 0.02 A 89 ILE HG1y H 1 1.024 0.02 A 89 ILE HG2% H 1 0.7787 0.02 A 89 ILE C C 13 177 0.2 A 89 ILE CA C 13 65.39 0.2 A 89 ILE CB C 13 37.44 0.2 A 89 ILE CD1 C 13 14.35 0.2 A 89 ILE CG1 C 13 29.15 0.2 A 89 ILE CG2 C 13 18.06 0.2 A 89 ILE N N 15 118.7 0.2 A 90 LYS H H 1 8.017 0.02 A 90 LYS HA H 1 3.775 0.02 A 90 LYS HBx H 1 1.702 0.02 A 90 LYS HBy H 1 1.702 0.02 A 90 LYS HDx H 1 1.484 0.02 A 90 LYS HDy H 1 1.484 0.02 A 90 LYS HEx H 1 2.75 0.02 A 90 LYS HEy H 1 2.75 0.02 A 90 LYS HGx H 1 1.214 0.02 A 90 LYS HGy H 1 1.331 0.02 A 90 LYS C C 13 178.8 0.2 A 90 LYS CA C 13 60.45 0.2 A 90 LYS CB C 13 32.11 0.2 A 90 LYS CD C 13 29.52 0.2 A 90 LYS CE C 13 41.54 0.2 A 90 LYS CG C 13 25.18 0.2 A 90 LYS N N 15 120.9 0.2 A 91 GLU H H 1 7.732 0.02 A 91 GLU HA H 1 4.083 0.02 A 91 GLU HBx H 1 2.134 0.02 A 91 GLU HBy H 1 2.155 0.02 A 91 GLU HGx H 1 2.436 0.02 A 91 GLU HGy H 1 2.436 0.02 A 91 GLU C C 13 179.1 0.2 A 91 GLU CA C 13 59.12 0.2 A 91 GLU CB C 13 28.81 0.2 A 91 GLU CG C 13 34.99 0.2 A 91 GLU N N 15 119.3 0.2 A 92 ILE H H 1 8.11 0.02 A 92 ILE HA H 1 3.685 0.02 A 92 ILE HB H 1 1.852 0.02 A 92 ILE HD1% H 1 0.7045 0.02 A 92 ILE HG1x H 1 1.013 0.02 A 92 ILE HG1y H 1 1.013 0.02 A 92 ILE HG2% H 1 0.8681 0.02 A 92 ILE C C 13 178 0.2 A 92 ILE CA C 13 65.9 0.2 A 92 ILE CB C 13 38.4 0.2 A 92 ILE CD1 C 13 14.28 0.2 A 92 ILE CG1 C 13 27.85 0.2 A 92 ILE CG2 C 13 17.9 0.2 A 92 ILE N N 15 121.1 0.2 A 93 PHE H H 1 8.651 0.02 A 93 PHE HA H 1 3.873 0.02 A 93 PHE HBx H 1 2.813 0.02 A 93 PHE HBy H 1 3.023 0.02 A 93 PHE HDx H 1 6.734 0.02 A 93 PHE HDy H 1 6.734 0.02 A 93 PHE HEx H 1 7.026 0.02 A 93 PHE HEy H 1 7.026 0.02 A 93 PHE C C 13 177.1 0.2 A 93 PHE CA C 13 61.02 0.2 A 93 PHE CB C 13 38.56 0.2 A 93 PHE CDx C 13 130.3 0.2 A 93 PHE CDy C 13 130.3 0.2 A 93 PHE N N 15 119.4 0.2 A 94 HIS H H 1 8.126 0.02 A 94 HIS HA H 1 4.368 0.02 A 94 HIS HBx H 1 3.258 0.02 A 94 HIS HBy H 1 3.258 0.02 A 94 HIS HD2 H 1 6.735 0.02 A 94 HIS HE1 H 1 7.098 0.02 A 94 HIS C C 13 177.1 0.2 A 94 HIS CA C 13 58.31 0.2 A 94 HIS CB C 13 27.91 0.2 A 94 HIS N N 15 116.4 0.2 A 95 HIS H H 1 8.058 0.02 A 95 HIS HA H 1 4.465 0.02 A 95 HIS HBy H 1 3.288 0.02 A 95 HIS HBx H 1 3.231 0.02 A 95 HIS HD2 H 1 7.2 0.02 A 95 HIS C C 13 177.3 0.2 A 95 HIS CA C 13 57.9 0.2 A 95 HIS CB C 13 28.49 0.2 A 95 HIS N N 15 117 0.2 A 96 LEU H H 1 8.525 0.02 A 96 LEU HA H 1 3.865 0.02 A 96 LEU HBy H 1 1.726 0.02 A 96 LEU HBx H 1 1.515 0.02 A 96 LEU HDx% H 1 0.6515 0.02 A 96 LEU HDy% H 1 0.7695 0.02 A 96 LEU HG H 1 1.62 0.02 A 96 LEU C C 13 178.3 0.2 A 96 LEU CA C 13 58.25 0.2 A 96 LEU CB C 13 41.72 0.2 A 96 LEU CDy C 13 25.43 0.2 A 96 LEU CDx C 13 25.01 0.2 A 96 LEU CG C 13 27.95 0.2 A 96 LEU N N 15 121.3 0.2 A 97 GLU H H 1 8.076 0.02 A 97 GLU HA H 1 3.719 0.02 A 97 GLU HBy H 1 1.994 0.02 A 97 GLU HBx H 1 1.88 0.02 A 97 GLU HGx H 1 2.107 0.02 A 97 GLU HGy H 1 2.107 0.02 A 97 GLU C C 13 178.3 0.2 A 97 GLU CA C 13 59.3 0.2 A 97 GLU CB C 13 28.96 0.2 A 97 GLU CG C 13 35.24 0.2 A 97 GLU N N 15 117.1 0.2 A 98 GLU H H 1 7.329 0.02 A 98 GLU HA H 1 4.024 0.02 A 98 GLU HBy H 1 2.12 0.02 A 98 GLU HBx H 1 2.027 0.02 A 98 GLU HGy H 1 2.348 0.02 A 98 GLU HGx H 1 2.23 0.02 A 98 GLU C C 13 177.9 0.2 A 98 GLU CA C 13 58.19 0.2 A 98 GLU CB C 13 29.12 0.2 A 98 GLU CG C 13 35.11 0.2 A 98 GLU N N 15 116 0.2 A 99 LEU H H 1 7.535 0.02 A 99 LEU HA H 1 4.183 0.02 A 99 LEU HBy H 1 1.788 0.02 A 99 LEU HBx H 1 1.502 0.02 A 99 LEU HDx% H 1 0.7268 0.02 A 99 LEU HDy% H 1 0.7777 0.02 A 99 LEU HG H 1 1.705 0.02 A 99 LEU C C 13 178.1 0.2 A 99 LEU CA C 13 56.44 0.2 A 99 LEU CB C 13 43.01 0.2 A 99 LEU CDy C 13 25.72 0.2 A 99 LEU CDx C 13 23.22 0.2 A 99 LEU CG C 13 26.75 0.2 A 99 LEU N N 15 118.2 0.2 A 100 VAL H H 1 7.561 0.02 A 100 VAL HA H 1 4.033 0.02 A 100 VAL HB H 1 2.044 0.02 A 100 VAL HGx% H 1 0.6971 0.02 A 100 VAL HGy% H 1 0.7888 0.02 A 100 VAL C C 13 175.4 0.2 A 100 VAL CA C 13 62.43 0.2 A 100 VAL CB C 13 32.05 0.2 A 100 VAL CGy C 13 21.22 0.2 A 100 VAL CGx C 13 20.53 0.2 A 100 VAL N N 15 114.8 0.2 A 101 HIS H H 1 7.827 0.02 A 101 HIS HA H 1 4.63 0.02 A 101 HIS HBy H 1 3.283 0.02 A 101 HIS HBx H 1 3.183 0.02 A 101 HIS HD2 H 1 7.267 0.02 A 101 HIS HE1 H 1 7.424 0.02 A 101 HIS C C 13 173.5 0.2 A 101 HIS CA C 13 55.41 0.2 A 101 HIS CB C 13 28.87 0.2 A 101 HIS N N 15 120.3 0.2 A 102 ARG H H 1 7.987 0.02 A 102 ARG HA H 1 4.122 0.02 A 102 ARG HBy H 1 1.827 0.02 A 102 ARG HBx H 1 1.696 0.02 A 102 ARG HDx H 1 3.154 0.02 A 102 ARG HDy H 1 3.154 0.02 A 102 ARG HGx H 1 1.593 0.02 A 102 ARG HGy H 1 1.593 0.02 A 102 ARG C C 13 180.8 0.2 A 102 ARG CA C 13 57.57 0.2 A 102 ARG CB C 13 31.24 0.2 A 102 ARG CD C 13 43.54 0.2 A 102 ARG CG C 13 27.25 0.2 A 102 ARG N N 15 127.3 0.2 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 3 GLY H A 99 LEU HDy% 1.0 1.8 6.0 2 2 A 4 LYS HA A 99 LEU HDx% 1.0 1.8 6.0 3 3 A 99 LEU HDy% A 4 LYS HA 1.0 1.8 6.0 4 4 A 99 LEU HDx% A 4 LYS HBy 1.0 1.8 6.0 5 5 A 99 LEU HDy% A 4 LYS HBy 1.0 1.8 6.0 6 6 A 5 LEU HA A 96 LEU HDy% 1.0 1.8 6.0 7 7 A 5 LEU HA A 96 LEU HG 1.0 1.8 5.0 8 8 A 99 LEU HDx% A 5 LEU HA 1.0 1.8 6.0 9 9 A 99 LEU HDy% A 5 LEU HA 1.0 1.8 6.0 10 10 A 96 LEU HG A 5 LEU HBy 1.0 1.8 6.0 11 10 A 96 LEU HG A 5 LEU HBx 1.0 1.8 6.0 12 11 A 8 LEU HA A 92 ILE HD1% 1.0 1.8 6.0 13 12 A 96 LEU HDy% A 8 LEU HBx 1.0 1.8 6.0 14 13 A 8 LEU HBx A 96 LEU HDx% 1.0 1.8 6.0 15 14 A 96 LEU HDx% A 8 LEU HBy 1.0 1.8 6.0 16 15 A 96 LEU HDy% A 8 LEU HBy 1.0 1.8 6.0 17 16 A 8 LEU HG A 96 LEU HBy 1.0 1.8 5.0 18 17 A 96 LEU HG A 8 LEU HG 1.0 1.8 5.0 19 18 A 8 LEU HDx% A 92 ILE HA 1.0 1.8 6.0 20 19 A 92 ILE HA A 8 LEU HDy% 1.0 1.8 6.0 21 20 A 8 LEU HDy% A 95 HIS HBx 1.0 1.8 6.0 22 21 A 92 ILE HD1% A 8 LEU H 1.0 1.8 6.0 23 22 A 9 LEU HA A 41 ILE HD1% 1.0 1.8 6.0 24 23 A 9 LEU HBx A 41 ILE HG2% 1.0 1.8 6.0 25 24 A 9 LEU HBy A 44 ILE HD1% 1.0 1.8 6.0 26 25 A 44 ILE HD1% A 9 LEU H 1.0 1.8 6.0 27 26 A 9 LEU H A 44 ILE HG1y 1.0 1.8 6.0 28 26 A 9 LEU H A 44 ILE HG1x 1.0 1.8 6.0 29 27 A 10 GLU H A 44 ILE HG1x 1.0 1.8 7.4 30 27 A 10 GLU H A 44 ILE HG2% 1.0 1.8 7.4 31 27 A 10 GLU H A 44 ILE HG1y 1.0 1.8 7.4 32 28 A 92 ILE HD1% A 11 ASP H 1.0 1.8 6.0 33 29 A 11 ASP HBx A 92 ILE HG1x 1.0 1.8 6.0 34 29 A 11 ASP HBx A 92 ILE HG1y 1.0 1.8 6.0 35 30 A 12 LEU H A 92 ILE HG2% 1.0 1.8 6.0 36 31 A 12 LEU H A 92 ILE HG1x 1.0 1.8 6.0 37 31 A 92 ILE HG1y A 12 LEU H 1.0 1.8 6.0 38 32 A 44 ILE HD1% A 12 LEU H 1.0 1.8 6.0 39 33 A 41 ILE HD1% A 12 LEU HBx 1.0 1.8 6.0 40 34 A 44 ILE HD1% A 12 LEU HBx 1.0 1.8 6.0 41 35 A 92 ILE HD1% A 12 LEU HBx 1.0 1.8 6.0 42 36 A 44 ILE HD1% A 12 LEU HBy 1.0 1.8 6.0 43 37 A 92 ILE HD1% A 12 LEU HBy 1.0 1.8 6.0 44 38 A 12 LEU HDx% A 64 PHE HD% 1.0 1.8 6.0 45 39 A 64 PHE HD% A 12 LEU HDy% 1.0 1.8 6.0 46 40 A 41 ILE HD1% A 13 GLN H 1.0 1.8 6.0 47 41 A 41 ILE HG2% A 13 GLN H 1.0 1.8 6.0 48 42 A 41 ILE HG2% A 13 GLN HE2y 1.0 1.8 6.0 49 43 A 41 ILE HG2% A 13 GLN HE2x 1.0 1.8 6.0 50 44 A 41 ILE HD1% A 13 GLN HA 1.0 1.8 6.0 51 45 A 41 ILE HD1% A 13 GLN HBx 1.0 1.8 6.0 52 46 A 13 GLN HBx A 41 ILE HG1y 1.0 1.8 5.0 53 47 A 41 ILE HD1% A 13 GLN HBy 1.0 1.8 6.0 54 48 A 41 ILE HG1y A 13 GLN HBy 1.0 1.8 5.0 55 49 A 15 VAL HA A 85 VAL HGy% 1.0 1.8 6.0 56 50 A 15 VAL HA A 85 VAL HA 1.0 1.8 5.0 57 51 A 85 VAL HA A 15 VAL HGy% 1.0 1.8 6.0 58 52 A 15 VAL HGy% A 88 ASN HD2y 1.0 1.8 6.0 59 53 A 15 VAL HGx% A 89 ILE HG1x 1.0 1.8 4.9 60 53 A 15 VAL HGx% A 89 ILE HG1y 1.0 1.8 4.9 61 54 A 15 VAL HGx% A 92 ILE HG1x 1.0 1.8 7.0 62 54 A 92 ILE HG1y A 15 VAL HGx% 1.0 1.8 7.0 63 55 A 88 ASN HD2y A 15 VAL HGx% 1.0 1.8 6.0 64 56 A 85 VAL HA A 15 VAL HGx% 1.0 1.8 6.0 65 57 A 16 LEU HA A 37 LEU HDx% 1.0 1.8 6.0 66 58 A 16 LEU HA A 37 LEU HDy% 1.0 1.8 6.0 67 59 A 16 LEU HA A 85 VAL HGx% 1.0 1.8 6.0 68 60 A 37 LEU HDy% A 16 LEU HBy 1.0 1.8 7.0 69 60 A 37 LEU HDy% A 16 LEU HBx 1.0 1.8 7.0 70 61 A 41 ILE HD1% A 16 LEU HBy 1.0 1.8 7.0 71 61 A 41 ILE HD1% A 16 LEU HBx 1.0 1.8 7.0 72 62 A 71 ILE HD1% A 16 LEU HBy 1.0 1.8 7.0 73 62 A 16 LEU HBx A 71 ILE HD1% 1.0 1.8 7.0 74 63 A 37 LEU HDy% A 16 LEU H 1.0 1.8 6.0 75 64 A 85 VAL HGy% A 18 HIS HBy 1.0 1.8 6.0 76 65 A 85 VAL HGx% A 18 HIS H 1.0 1.8 6.0 77 66 A 85 VAL HGy% A 19 VAL HA 1.0 1.8 6.0 78 67 A 19 VAL HGx% A 30 MET HA 1.0 1.8 6.0 79 68 A 20 ASN HA A 30 MET HBx 1.0 1.8 6.0 80 68 A 20 ASN HA A 30 MET HBy 1.0 1.8 6.0 81 69 A 20 ASN HBx A 30 MET HGx 1.0 1.8 7.0 82 69 A 20 ASN HBy A 30 MET HGx 1.0 1.8 7.0 83 69 A 30 MET HGy A 20 ASN HBy 1.0 1.8 7.0 84 69 A 20 ASN HBx A 30 MET HGy 1.0 1.8 7.0 85 70 A 22 HIS HA A 79 ASP HA 1.0 1.8 5.0 86 71 A 22 HIS HBy A 81 SER HBx 1.0 1.8 6.0 87 71 A 22 HIS HBy A 81 SER HBy 1.0 1.8 6.0 88 72 A 23 TRP HA A 82 LEU HDx% 1.0 1.8 6.0 89 73 A 23 TRP HBx A 30 MET HBx 1.0 1.8 6.0 90 73 A 30 MET HBy A 23 TRP HBx 1.0 1.8 6.0 91 74 A 23 TRP HBx A 82 LEU HDy% 1.0 1.8 6.0 92 75 A 23 TRP HBy A 30 MET HBx 1.0 1.8 6.0 93 75 A 30 MET HBy A 23 TRP HBy 1.0 1.8 6.0 94 76 A 23 TRP HE1 A 29 ASN HBy 1.0 1.8 5.0 95 77 A 23 TRP HE1 A 30 MET HBx 1.0 1.8 6.0 96 77 A 30 MET HBy A 23 TRP HE1 1.0 1.8 6.0 97 78 A 23 TRP HE1 A 30 MET H 1.0 1.8 5.0 98 79 A 23 TRP HE1 A 28 LYS HGx 1.0 1.8 6.0 99 79 A 23 TRP HE1 A 28 LYS HGy 1.0 1.8 6.0 100 80 A 23 TRP HE1 A 71 ILE HG2% 1.0 1.8 6.0 101 81 A 79 ASP HA A 24 GLN H 1.0 1.8 5.0 102 82 A 26 GLY H A 74 GLN HE2x 1.0 1.8 5.0 103 83 A 16 LEU HDx% A 34 ASP HBx 1.0 1.8 6.0 104 83 A 34 ASP HBy A 16 LEU HDx% 1.0 1.8 6.0 105 84 A 16 LEU HDx% A 34 ASP HA 1.0 1.8 4.3 106 85 A 36 HIS H A 67 VAL HGy% 1.0 1.8 6.0 107 86 A 37 LEU HBy A 67 VAL HGx% 1.0 1.8 6.0 108 87 A 64 PHE HD% A 37 LEU HDy% 1.0 1.8 8.4 109 88 A 38 GLN HA A 16 LEU HDy% 1.0 1.8 6.0 110 89 A 16 LEU HDy% A 38 GLN HGx 1.0 1.8 6.0 111 90 A 16 LEU HDy% A 38 GLN HGy 1.0 1.8 6.0 112 91 A 64 PHE HD% A 40 VAL HGy% 1.0 1.8 6.0 113 92 A 40 VAL HGx% A 64 PHE HA 1.0 1.8 4.3 114 93 A 64 PHE HD% A 40 VAL HGx% 1.0 1.8 8.4 115 94 A 9 LEU HA A 41 ILE HA 1.0 1.8 5.0 116 95 A 41 ILE HA A 9 LEU HG 1.0 1.8 5.0 117 96 A 41 ILE HA A 9 LEU HDy% 1.0 1.8 6.0 118 97 A 12 LEU HDx% A 41 ILE H 1.0 1.8 6.0 119 98 A 64 PHE HD% A 41 ILE H 1.0 1.8 7.4 120 99 A 12 LEU HDx% A 41 ILE HG1x 1.0 1.8 6.0 121 100 A 41 ILE HD1% A 12 LEU HBy 1.0 1.8 6.0 122 101 A 41 ILE HD1% A 12 LEU HDx% 1.0 1.8 7.0 123 102 A 9 LEU HA A 41 ILE HG2% 1.0 1.8 6.0 124 103 A 41 ILE HG2% A 9 LEU HG 1.0 1.8 6.0 125 104 A 43 ASP HBy A 60 MET HBx 1.0 1.8 5.0 126 104 A 43 ASP HBy A 60 MET HBy 1.0 1.8 5.0 127 105 A 44 ILE HA A 5 LEU HBy 1.0 1.8 6.0 128 105 A 5 LEU HBx A 44 ILE HA 1.0 1.8 6.0 129 106 A 44 ILE HB A 9 LEU HDx% 1.0 1.8 6.0 130 107 A 44 ILE HB A 9 LEU HDy% 1.0 1.8 6.0 131 108 A 9 LEU HG A 44 ILE HB 1.0 1.8 5.0 132 109 A 9 LEU HA A 44 ILE HD1% 1.0 1.8 6.0 133 110 A 44 ILE HD1% A 9 LEU HG 1.0 1.8 6.0 134 111 A 9 LEU HG A 44 ILE HG2% 1.0 1.8 6.0 135 112 A 96 LEU HDx% A 44 ILE HG1y 1.0 1.8 7.0 136 112 A 96 LEU HDx% A 44 ILE HG1x 1.0 1.8 7.0 137 113 A 96 LEU HDx% A 44 ILE HG2% 1.0 1.8 7.0 138 114 A 9 LEU HA A 44 ILE HG2% 1.0 1.8 6.0 139 115 A 9 LEU HBy A 44 ILE HG2% 1.0 1.8 6.0 140 116 A 96 LEU HDy% A 44 ILE HG2% 1.0 1.8 7.0 141 117 A 45 HIS H A 9 LEU HDx% 1.0 1.8 6.0 142 118 A 45 HIS H A 9 LEU HDy% 1.0 1.8 6.0 143 119 A 45 HIS HA A 9 LEU HDx% 1.0 1.8 6.0 144 120 A 45 HIS HA A 9 LEU HDy% 1.0 1.8 6.0 145 121 A 45 HIS HBy A 9 LEU HDx% 1.0 1.8 7.0 146 121 A 9 LEU HDx% A 45 HIS HBx 1.0 1.8 7.0 147 122 A 45 HIS HBy A 9 LEU HDy% 1.0 1.8 7.0 148 122 A 9 LEU HDy% A 45 HIS HBx 1.0 1.8 7.0 149 123 A 47 PHE H A 5 LEU HDy% 1.0 1.8 6.0 150 124 A 47 PHE H A 5 LEU HG 1.0 1.8 5.0 151 125 A 47 PHE HA A 52 GLY H 1.0 1.8 5.0 152 126 A 47 PHE HA A 52 GLY HAx 1.0 1.8 6.0 153 126 A 47 PHE HA A 52 GLY HAy 1.0 1.8 6.0 154 127 A 5 LEU HDy% A 47 PHE HBx 1.0 1.8 6.0 155 128 A 5 LEU HDy% A 47 PHE HBy 1.0 1.8 6.0 156 129 A 47 PHE HBx A 5 LEU HBy 1.0 1.8 6.0 157 129 A 5 LEU HBx A 47 PHE HBx 1.0 1.8 6.0 158 130 A 47 PHE HBy A 5 LEU HBy 1.0 1.8 6.0 159 130 A 5 LEU HBx A 47 PHE HBy 1.0 1.8 6.0 160 131 A 5 LEU HDy% A 48 MET H 1.0 1.8 6.0 161 132 A 5 LEU HDy% A 48 MET HA 1.0 1.8 6.0 162 133 A 5 LEU HBy A 48 MET HBx 1.0 1.8 7.0 163 133 A 5 LEU HBx A 48 MET HBx 1.0 1.8 7.0 164 133 A 48 MET HBy A 5 LEU HBy 1.0 1.8 7.0 165 133 A 5 LEU HBx A 48 MET HBy 1.0 1.8 7.0 166 134 A 5 LEU HDy% A 48 MET HBx 1.0 1.8 7.0 167 134 A 5 LEU HDy% A 48 MET HBy 1.0 1.8 7.0 168 135 A 5 LEU HG A 48 MET HBx 1.0 1.8 6.0 169 135 A 5 LEU HG A 48 MET HBy 1.0 1.8 6.0 170 136 A 5 LEU HDy% A 48 MET HGx 1.0 1.8 6.0 171 137 A 5 LEU HG A 48 MET HGx 1.0 1.8 5.0 172 138 A 5 LEU HDy% A 48 MET HGy 1.0 1.8 6.0 173 139 A 47 PHE HA A 56 LYS HBx 1.0 1.8 6.0 174 139 A 47 PHE HA A 56 LYS HBy 1.0 1.8 6.0 175 140 A 47 PHE HD% A 56 LYS HBx 1.0 1.8 8.4 176 140 A 56 LYS HBy A 47 PHE HD% 1.0 1.8 8.4 177 141 A 47 PHE HD% A 57 LEU H 1.0 1.8 7.4 178 142 A 96 LEU HBx A 57 LEU HDx% 1.0 1.8 6.0 179 143 A 97 GLU HA A 57 LEU HDx% 1.0 1.8 6.0 180 144 A 47 PHE HD% A 57 LEU HDy% 1.0 1.8 8.4 181 145 A 96 LEU HDx% A 57 LEU HA 1.0 1.8 6.0 182 146 A 40 VAL HGx% A 60 MET H 1.0 1.8 6.0 183 147 A 43 ASP HBy A 60 MET HBx 1.0 1.8 6.0 184 147 A 43 ASP HBy A 60 MET HBy 1.0 1.8 6.0 185 148 A 40 VAL HGx% A 60 MET HGx 1.0 1.8 6.0 186 149 A 40 VAL HGy% A 60 MET HGx 1.0 1.8 6.0 187 150 A 60 MET HGx A 40 VAL HA 1.0 1.8 5.0 188 151 A 60 MET HGx A 43 ASP HBx 1.0 1.8 5.0 189 152 A 40 VAL HA A 60 MET HGy 1.0 1.8 5.0 190 153 A 43 ASP HBx A 60 MET HGy 1.0 1.8 5.0 191 154 A 40 VAL HGx% A 60 MET HGy 1.0 1.8 6.0 192 155 A 40 VAL HGy% A 60 MET HGy 1.0 1.8 6.0 193 156 A 40 VAL HGy% A 63 GLU HBy 1.0 1.8 4.3 194 157 A 40 VAL HGx% A 64 PHE H 1.0 1.8 6.0 195 158 A 40 VAL HGy% A 64 PHE H 1.0 1.8 6.0 196 159 A 64 PHE H A 93 PHE HE% 1.0 1.8 7.4 197 160 A 40 VAL HGx% A 64 PHE HA 1.0 1.8 6.0 198 161 A 64 PHE HBx A 93 PHE HD% 1.0 1.8 7.4 199 162 A 67 VAL HGy% A 37 LEU H 1.0 1.8 6.0 200 163 A 67 VAL HGy% A 37 LEU HBx 1.0 1.8 6.0 201 164 A 67 VAL HGx% A 37 LEU HBx 1.0 1.8 6.0 202 165 A 67 VAL HGx% A 37 LEU HG 1.0 1.8 6.0 203 166 A 67 VAL HGx% A 37 LEU H 1.0 1.8 6.0 204 167 A 67 VAL H A 89 ILE HG2% 1.0 1.8 6.0 205 168 A 67 VAL HGx% A 33 VAL HGy% 1.0 1.8 7.0 206 169 A 67 VAL HGx% A 36 HIS HBy 1.0 1.8 4.3 207 170 A 67 VAL HGx% A 36 HIS HBx 1.0 1.8 4.3 208 171 A 67 VAL HGx% A 37 LEU HA 1.0 1.8 6.0 209 172 A 93 PHE HE% A 68 LEU H 1.0 1.8 7.4 210 173 A 93 PHE HD% A 68 LEU HDx% 1.0 1.8 8.4 211 174 A 93 PHE HE% A 68 LEU HDx% 1.0 1.8 8.4 212 175 A 68 LEU HDy% A 86 HIS HD2 1.0 1.8 6.0 213 176 A 70 GLU HBy A 33 VAL HGx% 1.0 1.8 6.0 214 177 A 33 VAL HGx% A 70 GLU HBx 1.0 1.8 6.0 215 178 A 71 ILE HG2% A 82 LEU HBy 1.0 1.8 6.0 216 179 A 71 ILE HG2% A 82 LEU HBx 1.0 1.8 6.0 217 180 A 71 ILE HG2% A 86 HIS HA 1.0 1.8 6.0 218 181 A 71 ILE HG2% A 86 HIS HD2 1.0 1.8 6.0 219 182 A 71 ILE HG2% A 86 HIS H 1.0 1.8 6.0 220 183 A 71 ILE HG2% A 86 HIS HBx 1.0 1.8 6.0 221 184 A 71 ILE HG2% A 86 HIS HBy 1.0 1.8 6.0 222 185 A 74 GLN HE2x A 27 GLN HA 1.0 1.8 5.0 223 186 A 75 LEU HDx% A 80 ASN HA 1.0 1.8 6.0 224 187 A 86 HIS HA A 75 LEU HDy% 1.0 1.8 6.0 225 188 A 86 HIS HBx A 75 LEU HDy% 1.0 1.8 6.0 226 189 A 75 LEU HDx% A 81 SER HBx 1.0 1.8 7.0 227 189 A 81 SER HBy A 75 LEU HDx% 1.0 1.8 7.0 228 190 A 19 VAL HA A 81 SER HBx 1.0 1.8 6.0 229 190 A 19 VAL HA A 81 SER HBy 1.0 1.8 6.0 230 191 A 82 LEU HDx% A 19 VAL HB 1.0 1.8 6.0 231 192 A 82 LEU HDx% A 24 GLN HBx 1.0 1.8 6.0 232 193 A 82 LEU HDx% A 74 GLN HBx 1.0 1.8 6.0 233 193 A 82 LEU HDx% A 74 GLN HBy 1.0 1.8 6.0 234 194 A 82 LEU HDy% A 23 TRP HD1 1.0 1.8 6.0 235 195 A 82 LEU HDy% A 23 TRP HZ2 1.0 1.8 6.0 236 196 A 19 VAL HA A 82 LEU HDy% 1.0 1.8 6.0 237 197 A 19 VAL HGx% A 82 LEU HDy% 1.0 1.8 7.0 238 198 A 23 TRP HA A 82 LEU HDy% 1.0 1.8 6.0 239 199 A 82 LEU HDy% A 23 TRP HE3 1.0 1.8 6.0 240 200 A 82 LEU HDy% A 71 ILE HB 1.0 1.8 6.0 241 201 A 75 LEU HDy% A 83 HIS H 1.0 1.8 6.0 242 202 A 75 LEU HDx% A 83 HIS HA 1.0 1.8 6.0 243 203 A 75 LEU HDy% A 83 HIS HA 1.0 1.8 6.0 244 204 A 15 VAL HA A 85 VAL HGy% 1.0 1.8 6.0 245 205 A 85 VAL HGy% A 19 VAL H 1.0 1.8 6.0 246 206 A 85 VAL HGy% A 19 VAL HGy% 1.0 1.8 7.0 247 207 A 85 VAL HGx% A 18 HIS HBx 1.0 1.8 6.0 248 208 A 85 VAL HGx% A 18 HIS HBy 1.0 1.8 6.0 249 209 A 85 VAL HGx% A 19 VAL H 1.0 1.8 6.0 250 210 A 85 VAL HGx% A 19 VAL HGy% 1.0 1.8 7.0 251 211 A 86 HIS H A 75 LEU HDx% 1.0 1.8 6.0 252 212 A 15 VAL HGx% A 88 ASN HBy 1.0 1.8 6.0 253 213 A 15 VAL HGy% A 88 ASN HBy 1.0 1.8 6.0 254 214 A 15 VAL HGx% A 88 ASN HBx 1.0 1.8 6.0 255 215 A 15 VAL HGy% A 88 ASN HBx 1.0 1.8 6.0 256 216 A 89 ILE HA A 12 LEU HA 1.0 1.8 5.0 257 217 A 68 LEU HDy% A 89 ILE HB 1.0 1.8 6.0 258 218 A 15 VAL HGx% A 89 ILE HD1% 1.0 1.8 7.0 259 219 A 64 PHE HD% A 89 ILE HD1% 1.0 1.8 8.4 260 220 A 15 VAL HGx% A 89 ILE HG1x 1.0 1.8 7.0 261 220 A 15 VAL HGx% A 89 ILE HG1y 1.0 1.8 7.0 262 221 A 64 PHE HD% A 89 ILE HG2% 1.0 1.8 8.4 263 222 A 89 ILE HG2% A 68 LEU HA 1.0 1.8 6.0 264 223 A 89 ILE HG2% A 68 LEU HBy 1.0 1.8 6.0 265 224 A 68 LEU HDy% A 90 LYS H 1.0 1.8 6.0 266 225 A 68 LEU HDy% A 90 LYS HA 1.0 1.8 6.0 267 226 A 8 LEU HA A 92 ILE HA 1.0 1.8 5.0 268 227 A 92 ILE HD1% A 11 ASP HBx 1.0 1.8 6.0 269 228 A 92 ILE HD1% A 11 ASP HBy 1.0 1.8 6.0 270 229 A 92 ILE HD1% A 12 LEU HA 1.0 1.8 6.0 271 230 A 92 ILE HD1% A 12 LEU H 1.0 1.8 6.0 272 231 A 8 LEU HA A 92 ILE HG2% 1.0 1.8 6.0 273 232 A 8 LEU HG A 92 ILE HG2% 1.0 1.8 6.0 274 233 A 92 ILE HG2% A 64 PHE HD% 1.0 1.8 8.4 275 234 A 92 ILE HG2% A 12 LEU HBy 1.0 1.8 6.0 276 235 A 44 ILE HD1% A 92 ILE HG2% 1.0 1.8 7.0 277 236 A 8 LEU HDx% A 95 HIS H 1.0 1.8 6.0 278 237 A 64 PHE HD% A 95 HIS H 1.0 1.8 7.4 279 238 A 8 LEU HDx% A 95 HIS HBx 1.0 1.8 6.0 280 239 A 8 LEU HDx% A 95 HIS HBy 1.0 1.8 6.0 281 240 A 8 LEU HDx% A 96 LEU H 1.0 1.8 6.0 282 241 A 8 LEU HDy% A 96 LEU H 1.0 1.8 6.0 283 242 A 8 LEU HG A 96 LEU H 1.0 1.8 5.0 284 243 A 96 LEU HDx% A 8 LEU HG 1.0 1.8 6.0 285 244 A 96 LEU HDx% A 64 PHE HD% 1.0 1.8 8.4 286 245 A 64 PHE HD% A 97 GLU H 1.0 1.8 7.4 287 246 A 97 GLU H A 58 GLN HE2x 1.0 1.8 5.0 288 247 A 97 GLU HA A 57 LEU HDy% 1.0 1.8 6.0 289 248 A 8 LEU HDy% A 99 LEU H 1.0 1.8 6.0 290 249 A 99 LEU H A 5 LEU HDx% 1.0 1.8 6.0 291 250 A 47 PHE HD% A 99 LEU H 1.0 1.8 7.4 292 251 A 99 LEU HDx% A 4 LYS HBx 1.0 1.8 6.0 293 252 A 99 LEU HDy% A 5 LEU HBy 1.0 1.8 7.0 294 252 A 99 LEU HDy% A 5 LEU HBx 1.0 1.8 7.0 295 253 A 100 VAL HGy% A 54 GLY HAy 1.0 1.8 6.0 296 254 A 100 VAL HGy% A 57 LEU HBx 1.0 1.8 6.0 297 255 A 100 VAL HGy% A 57 LEU HBy 1.0 1.8 6.0 298 256 A 54 GLY HAy A 100 VAL HB 1.0 1.8 5.0 299 257 A 21 GLN H A 22 HIS HD2 1.0 1.8 5.0 300 258 A 58 GLN H A 56 LYS HBx 1.0 1.8 6.0 301 258 A 56 LYS HBy A 58 GLN H 1.0 1.8 6.0 302 259 A 68 LEU HDx% A 69 ASP HBx 1.0 1.8 6.0 303 260 A 71 ILE HG1y A 67 VAL HA 1.0 1.8 5.0 304 261 A 79 ASP HA A 81 SER HBx 1.0 1.8 6.0 305 261 A 79 ASP HA A 81 SER HBy 1.0 1.8 6.0 306 262 A 88 ASN HBx A 89 ILE HA 1.0 1.8 5.0 307 263 A 97 GLU H A 94 HIS HD2 1.0 1.8 5.0 308 264 A 4 LYS H A 2 TYR HE% 1.0 1.8 7.4 309 265 A 5 LEU H A 3 GLY HAx 1.0 1.8 5.0 310 266 A 9 LEU HBy A 6 ASN H 1.0 1.8 5.0 311 267 A 7 ASP H A 4 LYS HGx 1.0 1.8 6.0 312 267 A 7 ASP H A 4 LYS HGy 1.0 1.8 6.0 313 268 A 8 LEU HDy% A 7 ASP H 1.0 1.8 6.0 314 269 A 9 LEU H A 5 LEU HBy 1.0 1.8 5.0 315 270 A 8 LEU HDx% A 12 LEU H 1.0 1.8 6.0 316 271 A 12 LEU H A 9 LEU HDy% 1.0 1.8 6.0 317 272 A 13 GLN HE2y A 10 GLU HA 1.0 1.8 5.0 318 273 A 13 GLN HE2x A 10 GLU HA 1.0 1.8 5.0 319 274 A 14 GLU H A 12 LEU HG 1.0 1.8 5.0 320 275 A 15 VAL HGy% A 14 GLU H 1.0 1.8 6.0 321 276 A 17 LYS H A 14 GLU HBx 1.0 1.8 5.0 322 277 A 17 LYS H A 14 GLU HBy 1.0 1.8 5.0 323 278 A 18 HIS H A 19 VAL HGy% 1.0 1.8 6.0 324 279 A 16 LEU HDx% A 20 ASN HD2y 1.0 1.8 6.0 325 280 A 16 LEU HDx% A 20 ASN HD2x 1.0 1.8 6.0 326 281 A 23 TRP HE1 A 25 GLY HAx 1.0 1.8 5.0 327 282 A 23 TRP HE1 A 27 GLN HA 1.0 1.8 5.0 328 283 A 23 TRP HZ2 A 29 ASN H 1.0 1.8 5.0 329 284 A 31 ASN H A 32 LYS HGx 1.0 1.8 6.0 330 284 A 31 ASN H A 32 LYS HGy 1.0 1.8 6.0 331 285 A 31 ASN HD2y A 27 GLN HGx 1.0 1.8 6.0 332 285 A 31 ASN HD2y A 27 GLN HGy 1.0 1.8 6.0 333 286 A 31 ASN HD2x A 27 GLN HGx 1.0 1.8 6.0 334 286 A 27 GLN HGy A 31 ASN HD2x 1.0 1.8 6.0 335 287 A 31 ASN HD2x A 34 ASP HBx 1.0 1.8 6.0 336 287 A 34 ASP HBy A 31 ASN HD2x 1.0 1.8 6.0 337 288 A 31 ASN HD2x A 28 LYS HA 1.0 1.8 5.0 338 289 A 31 ASN HD2x A 31 ASN HA 1.0 1.8 5.0 339 290 A 16 LEU HDx% A 34 ASP H 1.0 1.8 6.0 340 291 A 36 HIS H A 33 VAL HB 1.0 1.8 5.0 341 292 A 37 LEU H A 34 ASP HBx 1.0 1.8 6.0 342 292 A 34 ASP HBy A 37 LEU H 1.0 1.8 6.0 343 293 A 37 LEU H A 35 HIS HA 1.0 1.8 5.0 344 294 A 40 VAL HGy% A 39 ASN H 1.0 1.8 6.0 345 295 A 37 LEU HDy% A 41 ILE H 1.0 1.8 6.0 346 296 A 41 ILE H A 43 ASP H 1.0 1.8 5.0 347 297 A 44 ILE HG1y A 43 ASP H 1.0 1.8 6.0 348 297 A 43 ASP H A 44 ILE HG1x 1.0 1.8 6.0 349 298 A 44 ILE H A 42 GLU HA 1.0 1.8 5.0 350 299 A 41 ILE HA A 45 HIS H 1.0 1.8 5.0 351 300 A 45 HIS H A 47 PHE HD% 1.0 1.8 7.4 352 301 A 46 ASP H A 42 GLU HBx 1.0 1.8 6.0 353 301 A 46 ASP H A 42 GLU HBy 1.0 1.8 6.0 354 302 A 46 ASP H A 42 GLU HGx 1.0 1.8 6.0 355 302 A 46 ASP H A 42 GLU HGy 1.0 1.8 6.0 356 303 A 44 ILE HG1y A 46 ASP H 1.0 1.8 6.0 357 303 A 46 ASP H A 44 ILE HG1x 1.0 1.8 6.0 358 304 A 47 PHE H A 48 MET HBx 1.0 1.8 6.0 359 304 A 47 PHE H A 48 MET HBy 1.0 1.8 6.0 360 305 A 48 MET H A 44 ILE HG2% 1.0 1.8 6.0 361 306 A 48 MET H A 45 HIS HBx 1.0 1.8 6.0 362 306 A 45 HIS HBy A 48 MET H 1.0 1.8 6.0 363 307 A 47 PHE HA A 49 GLN H 1.0 1.8 5.0 364 308 A 50 GLY H A 49 GLN HE2x 1.0 1.8 5.0 365 309 A 51 GLY H A 49 GLN HA 1.0 1.8 5.0 366 310 A 51 GLY H A 49 GLN HBx 1.0 1.8 5.0 367 311 A 52 GLY H A 47 PHE HD% 1.0 1.8 7.4 368 312 A 55 GLY H A 56 LYS HA 1.0 1.8 5.0 369 313 A 56 LYS H A 53 SER HA 1.0 1.8 5.0 370 314 A 58 GLN HE2x A 58 GLN HA 1.0 1.8 5.0 371 315 A 64 PHE HD% A 61 MET H 1.0 1.8 7.4 372 316 A 67 VAL HGy% A 66 GLN H 1.0 1.8 6.0 373 317 A 64 PHE HD% A 67 VAL H 1.0 1.8 7.4 374 318 A 64 PHE HD% A 68 LEU H 1.0 1.8 7.4 375 319 A 82 LEU H A 81 SER HA 1.0 1.8 5.0 376 320 A 84 ASN H A 81 SER H 1.0 1.8 5.0 377 321 A 87 GLU H A 84 ASN HBx 1.0 1.8 6.0 378 321 A 87 GLU H A 84 ASN HBy 1.0 1.8 6.0 379 322 A 89 ILE H A 90 LYS HBx 1.0 1.8 6.0 380 322 A 89 ILE H A 90 LYS HBy 1.0 1.8 6.0 381 323 A 90 LYS H A 92 ILE HB 1.0 1.8 5.0 382 324 A 90 LYS H A 89 ILE HG1x 1.0 1.8 6.0 383 324 A 89 ILE HG1y A 90 LYS H 1.0 1.8 6.0 384 325 A 89 ILE HD1% A 90 LYS H 1.0 1.8 6.0 385 326 A 94 HIS H A 91 GLU HBx 1.0 1.8 6.0 386 326 A 94 HIS H A 91 GLU HBy 1.0 1.8 6.0 387 327 A 96 LEU H A 94 HIS HBx 1.0 1.8 6.0 388 327 A 96 LEU H A 94 HIS HBy 1.0 1.8 6.0 389 328 A 96 LEU HDy% A 98 GLU H 1.0 1.8 6.0 390 329 A 99 LEU HDx% A 98 GLU H 1.0 1.8 6.0 391 330 A 98 GLU H A 99 LEU HA 1.0 1.8 5.0 392 331 A 99 LEU H A 102 ARG HGx 1.0 1.8 6.0 393 331 A 99 LEU H A 102 ARG HGy 1.0 1.8 6.0 394 332 A 99 LEU H A 100 VAL HGx% 1.0 1.8 6.0 395 333 A 99 LEU H A 100 VAL HGy% 1.0 1.8 6.0 396 334 A 19 VAL H A 16 LEU HBy 1.0 1.8 6.0 397 334 A 16 LEU HBx A 19 VAL H 1.0 1.8 6.0 398 335 A 29 ASN HBy A 33 VAL H 1.0 1.8 5.0 399 336 A 33 VAL H A 29 ASN HBx 1.0 1.8 5.0 400 337 A 37 LEU HDx% A 40 VAL HB 1.0 1.8 6.0 401 338 A 60 MET HGx A 57 LEU HDx% 1.0 1.8 6.0 402 339 A 60 MET HGy A 57 LEU HDx% 1.0 1.8 6.0 403 340 A 68 LEU HDy% A 64 PHE HE% 1.0 1.8 8.4 404 341 A 1 MET HA A 2 TYR HBx 1.0 1.8 6.0 405 341 A 1 MET HA A 2 TYR HBy 1.0 1.8 6.0 406 342 A 2 TYR HE% A 1 MET HA 1.0 1.8 5.0 407 343 A 1 MET HA A 2 TYR H 1.0 1.8 5.0 408 344 A 2 TYR HA A 1 MET HBx 1.0 1.8 6.0 409 344 A 1 MET HBy A 2 TYR HA 1.0 1.8 6.0 410 345 A 2 TYR HA A 1 MET HGx 1.0 1.8 6.0 411 345 A 2 TYR HA A 1 MET HGy 1.0 1.8 6.0 412 346 A 1 MET HGy A 5 LEU HBy 1.0 1.8 7.0 413 346 A 1 MET HGx A 5 LEU HBy 1.0 1.8 7.0 414 346 A 5 LEU HBx A 1 MET HGx 1.0 1.8 7.0 415 346 A 5 LEU HBx A 1 MET HGy 1.0 1.8 7.0 416 347 A 1 MET HA A 2 TYR H 1.0 1.8 5.0 417 348 A 2 TYR H A 1 MET HBx 1.0 1.8 6.0 418 348 A 2 TYR H A 1 MET HBy 1.0 1.8 6.0 419 349 A 3 GLY H A 2 TYR HBx 1.0 1.8 5.0 420 350 A 5 LEU HDy% A 2 TYR HBx 1.0 1.8 6.0 421 351 A 3 GLY H A 2 TYR HBy 1.0 1.8 5.0 422 352 A 3 GLY H A 1 MET HA 1.0 1.8 5.0 423 353 A 3 GLY H A 2 TYR HA 1.0 1.8 5.0 424 354 A 3 GLY H A 2 TYR HBx 1.0 1.8 6.0 425 354 A 3 GLY H A 2 TYR HBy 1.0 1.8 6.0 426 355 A 3 GLY H A 2 TYR HE% 1.0 1.8 5.0 427 356 A 3 GLY H A 2 TYR H 1.0 1.8 5.0 428 357 A 3 GLY H A 4 LYS HA 1.0 1.8 5.0 429 358 A 3 GLY H A 4 LYS H 1.0 1.8 5.0 430 359 A 3 GLY H A 5 LEU H 1.0 1.8 5.0 431 360 A 4 LYS H A 3 GLY HAx 1.0 1.8 5.0 432 361 A 4 LYS H A 3 GLY HAy 1.0 1.8 5.0 433 362 A 3 GLY HAx A 6 ASN HBx 1.0 1.8 6.0 434 362 A 3 GLY HAx A 6 ASN HBy 1.0 1.8 6.0 435 363 A 3 GLY HAx A 6 ASN H 1.0 1.8 5.0 436 364 A 3 GLY HAy A 6 ASN HBx 1.0 1.8 6.0 437 364 A 3 GLY HAy A 6 ASN HBy 1.0 1.8 6.0 438 365 A 6 ASN H A 3 GLY HAy 1.0 1.8 5.0 439 366 A 4 LYS H A 2 TYR HA 1.0 1.8 5.0 440 367 A 4 LYS H A 3 GLY HAx 1.0 1.8 5.0 441 368 A 4 LYS H A 3 GLY HAy 1.0 1.8 5.0 442 369 A 3 GLY H A 4 LYS H 1.0 1.8 5.0 443 370 A 4 LYS H A 5 LEU H 1.0 1.8 5.0 444 371 A 4 LYS H A 6 ASN H 1.0 1.8 5.0 445 372 A 4 LYS HA A 7 ASP HBx 1.0 1.8 6.0 446 372 A 4 LYS HA A 7 ASP HBy 1.0 1.8 6.0 447 373 A 4 LYS HA A 5 LEU H 1.0 1.8 5.0 448 374 A 4 LYS HA A 6 ASN H 1.0 1.8 5.0 449 375 A 4 LYS HA A 8 LEU HDy% 1.0 1.8 6.0 450 376 A 4 LYS HBy A 5 LEU H 1.0 1.8 5.0 451 377 A 4 LYS HBy A 7 ASP HBx 1.0 1.8 6.0 452 377 A 4 LYS HBy A 7 ASP HBy 1.0 1.8 6.0 453 378 A 4 LYS HBx A 5 LEU H 1.0 1.8 5.0 454 379 A 4 LYS HBx A 7 ASP HBx 1.0 1.8 6.0 455 379 A 4 LYS HBx A 7 ASP HBy 1.0 1.8 6.0 456 380 A 5 LEU H A 4 LYS HGx 1.0 1.8 6.0 457 380 A 5 LEU H A 4 LYS HGy 1.0 1.8 6.0 458 381 A 4 LYS HA A 5 LEU H 1.0 1.8 5.0 459 382 A 5 LEU H A 4 LYS HGx 1.0 1.8 6.0 460 382 A 5 LEU H A 4 LYS HGy 1.0 1.8 6.0 461 383 A 4 LYS H A 5 LEU H 1.0 1.8 5.0 462 384 A 5 LEU H A 7 ASP H 1.0 1.8 5.0 463 385 A 5 LEU HA A 8 LEU HDy% 1.0 1.8 6.0 464 386 A 5 LEU HA A 8 LEU HBx 1.0 1.8 5.0 465 387 A 5 LEU HA A 8 LEU HBy 1.0 1.8 5.0 466 388 A 5 LEU HA A 8 LEU H 1.0 1.8 5.0 467 389 A 5 LEU HDy% A 2 TYR HE% 1.0 1.8 6.0 468 390 A 3 GLY HAx A 6 ASN H 1.0 1.8 5.0 469 391 A 5 LEU HA A 6 ASN H 1.0 1.8 5.0 470 392 A 6 ASN H A 5 LEU HBy 1.0 1.8 5.0 471 393 A 5 LEU HBx A 6 ASN H 1.0 1.8 5.0 472 394 A 5 LEU HDx% A 6 ASN H 1.0 1.8 6.0 473 395 A 5 LEU HDy% A 6 ASN H 1.0 1.8 6.0 474 396 A 5 LEU HG A 6 ASN H 1.0 1.8 5.0 475 397 A 6 ASN H A 7 ASP H 1.0 1.8 5.0 476 398 A 8 LEU H A 6 ASN H 1.0 1.8 5.0 477 399 A 9 LEU HBy A 6 ASN HA 1.0 1.8 5.0 478 400 A 9 LEU HBx A 6 ASN HA 1.0 1.8 5.0 479 401 A 6 ASN HA A 9 LEU HDx% 1.0 1.8 5.7 480 401 A 6 ASN HA A 9 LEU HDy% 1.0 1.8 5.7 481 402 A 9 LEU HG A 6 ASN HA 1.0 1.8 5.0 482 403 A 7 ASP H A 6 ASN HA 1.0 1.8 5.0 483 404 A 9 LEU H A 6 ASN HA 1.0 1.8 5.0 484 405 A 7 ASP H A 6 ASN HBx 1.0 1.8 5.0 485 406 A 7 ASP H A 6 ASN HBy 1.0 1.8 5.0 486 407 A 4 LYS HA A 7 ASP H 1.0 1.8 5.0 487 408 A 4 LYS HBy A 7 ASP H 1.0 1.8 5.0 488 409 A 4 LYS HBx A 7 ASP H 1.0 1.8 5.0 489 410 A 5 LEU HA A 7 ASP H 1.0 1.8 5.0 490 411 A 7 ASP H A 6 ASN HBx 1.0 1.8 5.0 491 412 A 7 ASP H A 6 ASN HBy 1.0 1.8 5.0 492 413 A 6 ASN H A 7 ASP H 1.0 1.8 5.0 493 414 A 8 LEU H A 7 ASP H 1.0 1.8 5.0 494 415 A 7 ASP HA A 10 GLU HBx 1.0 1.8 6.0 495 415 A 7 ASP HA A 10 GLU HBy 1.0 1.8 6.0 496 416 A 7 ASP HA A 10 GLU HGx 1.0 1.8 6.0 497 416 A 7 ASP HA A 10 GLU HGy 1.0 1.8 6.0 498 417 A 8 LEU H A 7 ASP HBx 1.0 1.8 5.0 499 417 A 8 LEU H A 7 ASP HBy 1.0 1.8 5.0 500 418 A 4 LYS HBy A 7 ASP HBx 1.0 1.8 6.0 501 418 A 4 LYS HBy A 7 ASP HBy 1.0 1.8 6.0 502 419 A 4 LYS HBx A 7 ASP HBx 1.0 1.8 6.0 503 419 A 4 LYS HBx A 7 ASP HBy 1.0 1.8 6.0 504 420 A 8 LEU HA A 7 ASP HBx 1.0 1.8 6.0 505 420 A 8 LEU HA A 7 ASP HBy 1.0 1.8 6.0 506 421 A 4 LYS HA A 8 LEU H 1.0 1.8 5.0 507 422 A 4 LYS HA A 8 LEU H 1.0 1.8 5.0 508 423 A 5 LEU HA A 8 LEU H 1.0 1.8 5.0 509 424 A 8 LEU H A 5 LEU HBy 1.0 1.8 5.0 510 425 A 5 LEU HBx A 8 LEU H 1.0 1.8 5.0 511 426 A 8 LEU H A 7 ASP HBx 1.0 1.8 6.0 512 426 A 8 LEU H A 7 ASP HBy 1.0 1.8 6.0 513 427 A 8 LEU H A 7 ASP H 1.0 1.8 5.0 514 428 A 8 LEU H A 9 LEU H 1.0 1.8 5.0 515 429 A 8 LEU HA A 11 ASP HBx 1.0 1.8 5.0 516 430 A 8 LEU HA A 11 ASP HBy 1.0 1.8 5.0 517 431 A 8 LEU HA A 11 ASP H 1.0 1.8 5.0 518 432 A 8 LEU HBx A 9 LEU H 1.0 1.8 5.0 519 433 A 8 LEU HG A 9 LEU H 1.0 1.8 5.0 520 434 A 8 LEU HDx% A 9 LEU HA 1.0 1.8 6.0 521 435 A 8 LEU HDx% A 12 LEU HA 1.0 1.8 6.0 522 436 A 8 LEU HDy% A 9 LEU H 1.0 1.8 6.0 523 437 A 5 LEU HBx A 9 LEU H 1.0 1.8 5.0 524 438 A 9 LEU H A 6 ASN HA 1.0 1.8 5.0 525 439 A 9 LEU H A 7 ASP H 1.0 1.8 5.0 526 440 A 8 LEU HA A 9 LEU H 1.0 1.8 5.0 527 441 A 8 LEU HBy A 9 LEU H 1.0 1.8 5.0 528 442 A 8 LEU H A 9 LEU H 1.0 1.8 5.0 529 443 A 8 LEU HG A 9 LEU H 1.0 1.8 5.0 530 444 A 9 LEU HA A 12 LEU HBx 1.0 1.8 5.0 531 445 A 9 LEU HA A 12 LEU HBy 1.0 1.8 5.0 532 446 A 9 LEU HA A 12 LEU H 1.0 1.8 5.0 533 447 A 9 LEU HBy A 6 ASN HA 1.0 1.8 5.0 534 448 A 9 LEU HBx A 6 ASN HA 1.0 1.8 5.0 535 449 A 10 GLU H A 7 ASP HA 1.0 1.8 5.0 536 450 A 10 GLU H A 7 ASP HBx 1.0 1.8 6.0 537 450 A 10 GLU H A 7 ASP HBy 1.0 1.8 6.0 538 451 A 8 LEU H A 10 GLU H 1.0 1.8 5.0 539 452 A 9 LEU HA A 10 GLU H 1.0 1.8 5.0 540 453 A 9 LEU HBy A 10 GLU H 1.0 1.8 5.0 541 454 A 10 GLU H A 9 LEU HG 1.0 1.8 5.0 542 455 A 10 GLU H A 12 LEU H 1.0 1.8 5.0 543 456 A 13 GLN HBx A 10 GLU HA 1.0 1.8 5.0 544 457 A 13 GLN HBy A 10 GLU HA 1.0 1.8 5.0 545 458 A 10 GLU HA A 9 LEU HDx% 1.0 1.8 6.0 546 459 A 8 LEU HA A 11 ASP H 1.0 1.8 5.0 547 460 A 9 LEU HA A 11 ASP H 1.0 1.8 5.0 548 461 A 11 ASP H A 10 GLU HA 1.0 1.8 5.0 549 462 A 11 ASP H A 10 GLU HBx 1.0 1.8 6.0 550 462 A 11 ASP H A 10 GLU HBy 1.0 1.8 6.0 551 463 A 11 ASP H A 12 LEU H 1.0 1.8 5.0 552 464 A 14 GLU HBx A 11 ASP HA 1.0 1.8 5.0 553 465 A 14 GLU HBy A 11 ASP HA 1.0 1.8 5.0 554 466 A 12 LEU H A 11 ASP HA 1.0 1.8 5.0 555 467 A 11 ASP HA A 14 GLU HGx 1.0 1.8 6.0 556 467 A 11 ASP HA A 14 GLU HGy 1.0 1.8 6.0 557 468 A 14 GLU H A 11 ASP HA 1.0 1.8 5.0 558 469 A 8 LEU HA A 11 ASP HBx 1.0 1.8 5.0 559 470 A 12 LEU H A 11 ASP HBy 1.0 1.8 5.0 560 471 A 8 LEU HA A 11 ASP HBy 1.0 1.8 5.0 561 472 A 8 LEU HA A 12 LEU H 1.0 1.8 5.0 562 473 A 9 LEU HA A 12 LEU H 1.0 1.8 5.0 563 474 A 12 LEU H A 10 GLU HA 1.0 1.8 5.0 564 475 A 10 GLU H A 12 LEU H 1.0 1.8 5.0 565 476 A 12 LEU H A 11 ASP HA 1.0 1.8 5.0 566 477 A 11 ASP HBx A 12 LEU H 1.0 1.8 5.0 567 478 A 12 LEU H A 11 ASP HBy 1.0 1.8 5.0 568 479 A 11 ASP H A 12 LEU H 1.0 1.8 5.0 569 480 A 12 LEU HA A 15 VAL HB 1.0 1.8 5.0 570 481 A 15 VAL HGy% A 12 LEU HA 1.0 1.8 6.0 571 482 A 12 LEU HA A 15 VAL H 1.0 1.8 5.0 572 483 A 9 LEU HA A 12 LEU HBx 1.0 1.8 5.0 573 484 A 9 LEU HA A 12 LEU HBy 1.0 1.8 5.0 574 485 A 13 GLN H A 10 GLU HA 1.0 1.8 5.0 575 486 A 13 GLN H A 10 GLU HBx 1.0 1.8 6.0 576 486 A 13 GLN H A 10 GLU HBy 1.0 1.8 6.0 577 487 A 12 LEU HBx A 13 GLN H 1.0 1.8 6.0 578 488 A 12 LEU HBy A 13 GLN H 1.0 1.8 6.0 579 489 A 13 GLN H A 12 LEU HG 1.0 1.8 5.0 580 490 A 13 GLN H A 14 GLU H 1.0 1.8 5.0 581 491 A 13 GLN HE2y A 16 LEU HDy% 1.0 1.8 6.0 582 492 A 13 GLN HA A 16 LEU HBy 1.0 1.8 6.0 583 492 A 13 GLN HA A 16 LEU HBx 1.0 1.8 6.0 584 493 A 14 GLU H A 11 ASP HA 1.0 1.8 5.0 585 494 A 12 LEU H A 14 GLU H 1.0 1.8 5.0 586 495 A 13 GLN HA A 14 GLU H 1.0 1.8 5.0 587 496 A 14 GLU H A 13 GLN HGy 1.0 1.8 5.0 588 497 A 14 GLU HA A 17 LYS HBx 1.0 1.8 6.0 589 497 A 14 GLU HA A 17 LYS HBy 1.0 1.8 6.0 590 498 A 17 LYS H A 14 GLU HA 1.0 1.8 5.0 591 499 A 11 ASP HA A 14 GLU HGx 1.0 1.8 5.0 592 499 A 11 ASP HA A 14 GLU HGy 1.0 1.8 5.0 593 500 A 11 ASP HA A 15 VAL H 1.0 1.8 5.0 594 501 A 12 LEU HA A 15 VAL H 1.0 1.8 5.0 595 502 A 12 LEU HDx% A 15 VAL H 1.0 1.8 6.0 596 503 A 13 GLN H A 15 VAL H 1.0 1.8 5.0 597 504 A 15 VAL H A 14 GLU HA 1.0 1.8 5.0 598 505 A 14 GLU HBx A 15 VAL H 1.0 1.8 5.0 599 506 A 15 VAL H A 14 GLU HGx 1.0 1.8 6.0 600 506 A 14 GLU HGy A 15 VAL H 1.0 1.8 6.0 601 507 A 16 LEU H A 15 VAL H 1.0 1.8 5.0 602 508 A 17 LYS H A 15 VAL H 1.0 1.8 5.0 603 509 A 14 GLU HBy A 15 VAL H 1.0 1.8 5.0 604 510 A 15 VAL HA A 18 HIS HBx 1.0 1.8 5.0 605 511 A 15 VAL HA A 18 HIS HBy 1.0 1.8 5.0 606 512 A 15 VAL HA A 16 LEU H 1.0 1.8 5.0 607 513 A 15 VAL HA A 18 HIS HD2 1.0 1.8 5.0 608 514 A 15 VAL HA A 18 HIS H 1.0 1.8 5.0 609 515 A 15 VAL HA A 19 VAL HGy% 1.0 1.8 6.0 610 516 A 15 VAL HA A 19 VAL H 1.0 1.8 5.0 611 517 A 12 LEU HA A 15 VAL HB 1.0 1.8 5.0 612 518 A 16 LEU H A 15 VAL HB 1.0 1.8 5.0 613 519 A 15 VAL HGy% A 12 LEU HA 1.0 1.8 6.0 614 520 A 15 VAL HGy% A 16 LEU HA 1.0 1.8 6.0 615 521 A 15 VAL HGy% A 16 LEU H 1.0 1.8 6.0 616 522 A 15 VAL HGx% A 16 LEU H 1.0 1.8 6.0 617 523 A 12 LEU H A 15 VAL HGx% 1.0 1.8 6.0 618 524 A 13 GLN HA A 16 LEU H 1.0 1.8 5.0 619 525 A 16 LEU H A 14 GLU H 1.0 1.8 5.0 620 526 A 15 VAL HA A 16 LEU H 1.0 1.8 5.0 621 527 A 16 LEU H A 15 VAL HB 1.0 1.8 5.0 622 528 A 15 VAL HGx% A 16 LEU H 1.0 1.8 6.0 623 529 A 15 VAL HGy% A 16 LEU H 1.0 1.8 6.0 624 530 A 16 LEU H A 17 LYS H 1.0 1.8 5.0 625 531 A 16 LEU HA A 19 VAL HGx% 1.0 1.8 6.0 626 532 A 17 LYS H A 16 LEU HBy 1.0 1.8 6.0 627 532 A 16 LEU HBx A 17 LYS H 1.0 1.8 6.0 628 533 A 13 GLN HA A 17 LYS H 1.0 1.8 5.0 629 534 A 17 LYS H A 14 GLU HA 1.0 1.8 5.0 630 535 A 16 LEU HA A 17 LYS H 1.0 1.8 5.0 631 536 A 17 LYS H A 16 LEU HBy 1.0 1.8 6.0 632 536 A 16 LEU HBx A 17 LYS H 1.0 1.8 6.0 633 537 A 16 LEU HDx% A 17 LYS H 1.0 1.8 6.0 634 538 A 16 LEU H A 17 LYS H 1.0 1.8 5.0 635 539 A 17 LYS HA A 20 ASN HBy 1.0 1.8 6.0 636 539 A 20 ASN HBx A 17 LYS HA 1.0 1.8 6.0 637 540 A 14 GLU HA A 17 LYS HBx 1.0 1.8 6.0 638 540 A 14 GLU HA A 17 LYS HBy 1.0 1.8 6.0 639 541 A 15 VAL HA A 18 HIS H 1.0 1.8 5.0 640 542 A 16 LEU HA A 18 HIS H 1.0 1.8 5.0 641 543 A 18 HIS H A 17 LYS HA 1.0 1.8 5.0 642 544 A 18 HIS H A 17 LYS HBx 1.0 1.8 6.0 643 544 A 18 HIS H A 17 LYS HBy 1.0 1.8 6.0 644 545 A 18 HIS H A 19 VAL H 1.0 1.8 5.0 645 546 A 15 VAL HA A 18 HIS HBx 1.0 1.8 5.0 646 547 A 15 VAL HA A 18 HIS HBy 1.0 1.8 5.0 647 548 A 18 HIS HBy A 19 VAL H 1.0 1.8 5.0 648 549 A 19 VAL HA A 20 ASN H 1.0 1.8 5.0 649 550 A 19 VAL HA A 22 HIS HBx 1.0 1.8 5.0 650 551 A 19 VAL HA A 22 HIS HBy 1.0 1.8 5.0 651 552 A 19 VAL HA A 22 HIS H 1.0 1.8 5.0 652 553 A 19 VAL HA A 23 TRP HE3 1.0 1.8 5.0 653 554 A 16 LEU HA A 19 VAL HB 1.0 1.8 5.0 654 555 A 19 VAL HGy% A 22 HIS H 1.0 1.8 6.0 655 556 A 16 LEU HDx% A 20 ASN H 1.0 1.8 6.0 656 557 A 17 LYS HA A 20 ASN H 1.0 1.8 5.0 657 558 A 20 ASN H A 18 HIS HA 1.0 1.8 5.0 658 559 A 19 VAL HA A 20 ASN H 1.0 1.8 5.0 659 560 A 19 VAL HB A 20 ASN H 1.0 1.8 5.0 660 561 A 19 VAL HGx% A 20 ASN H 1.0 1.8 6.0 661 562 A 19 VAL H A 20 ASN H 1.0 1.8 5.0 662 563 A 20 ASN H A 22 HIS H 1.0 1.8 5.0 663 564 A 20 ASN HA A 21 GLN H 1.0 1.8 5.0 664 565 A 20 ASN HA A 23 TRP HBx 1.0 1.8 5.0 665 566 A 20 ASN HA A 23 TRP HBy 1.0 1.8 5.0 666 567 A 17 LYS HA A 20 ASN HBy 1.0 1.8 6.0 667 567 A 20 ASN HBx A 17 LYS HA 1.0 1.8 6.0 668 568 A 21 GLN H A 17 LYS HA 1.0 1.8 5.0 669 569 A 21 GLN H A 18 HIS HA 1.0 1.8 5.0 670 570 A 19 VAL HA A 21 GLN H 1.0 1.8 5.0 671 571 A 20 ASN HA A 21 GLN H 1.0 1.8 5.0 672 572 A 21 GLN H A 20 ASN HBy 1.0 1.8 5.0 673 573 A 20 ASN HBx A 21 GLN H 1.0 1.8 5.0 674 574 A 21 GLN H A 20 ASN H 1.0 1.8 5.0 675 575 A 21 GLN H A 23 TRP H 1.0 1.8 5.0 676 576 A 22 HIS H A 18 HIS HA 1.0 1.8 5.0 677 577 A 19 VAL HA A 22 HIS H 1.0 1.8 5.0 678 578 A 22 HIS H A 21 GLN HA 1.0 1.8 5.0 679 579 A 22 HIS H A 21 GLN HBx 1.0 1.8 5.0 680 580 A 22 HIS H A 21 GLN HBy 1.0 1.8 5.0 681 581 A 19 VAL HA A 23 TRP H 1.0 1.8 5.0 682 582 A 20 ASN HA A 23 TRP H 1.0 1.8 5.0 683 583 A 23 TRP H A 21 GLN HA 1.0 1.8 5.0 684 584 A 22 HIS HA A 23 TRP H 1.0 1.8 5.0 685 585 A 22 HIS HBx A 23 TRP H 1.0 1.8 5.0 686 586 A 24 GLN H A 23 TRP H 1.0 1.8 5.0 687 587 A 23 TRP HE1 A 26 GLY H 1.0 1.8 5.0 688 588 A 23 TRP HA A 24 GLN H 1.0 1.8 5.0 689 589 A 23 TRP HBx A 24 GLN H 1.0 1.8 5.0 690 590 A 23 TRP HBy A 24 GLN H 1.0 1.8 5.0 691 591 A 23 TRP HA A 24 GLN H 1.0 1.8 5.0 692 592 A 23 TRP HBx A 24 GLN H 1.0 1.8 5.0 693 593 A 23 TRP HBy A 24 GLN H 1.0 1.8 5.0 694 594 A 24 GLN H A 23 TRP HE3 1.0 1.8 5.0 695 595 A 24 GLN H A 23 TRP H 1.0 1.8 5.0 696 596 A 24 GLN H A 23 TRP HD1 1.0 1.8 5.0 697 597 A 24 GLN H A 25 GLY H 1.0 1.8 5.0 698 598 A 25 GLY H A 24 GLN HA 1.0 1.8 5.0 699 599 A 23 TRP HA A 24 GLN HGx 1.0 1.8 6.0 700 599 A 23 TRP HA A 24 GLN HGy 1.0 1.8 6.0 701 600 A 26 GLY H A 25 GLY HAx 1.0 1.8 5.0 702 601 A 26 GLY H A 25 GLY HAy 1.0 1.8 5.0 703 602 A 23 TRP HE1 A 26 GLY H 1.0 1.8 5.0 704 603 A 26 GLY H A 23 TRP HD1 1.0 1.8 5.0 705 604 A 26 GLY H A 24 GLN HA 1.0 1.8 5.0 706 605 A 26 GLY H A 25 GLY HAx 1.0 1.8 5.0 707 606 A 26 GLY H A 25 GLY H 1.0 1.8 5.0 708 607 A 26 GLY HAx A 27 GLN H 1.0 1.8 5.0 709 608 A 27 GLN H A 26 GLY HAy 1.0 1.8 5.0 710 609 A 27 GLN HA A 26 GLY HAy 1.0 1.8 5.0 711 610 A 26 GLY HAx A 27 GLN H 1.0 1.8 5.0 712 611 A 27 GLN H A 26 GLY HAy 1.0 1.8 5.0 713 612 A 27 GLN HA A 30 MET HBx 1.0 1.8 5.0 714 612 A 30 MET HBy A 27 GLN HA 1.0 1.8 5.0 715 613 A 26 GLY HAx A 28 LYS H 1.0 1.8 5.0 716 614 A 26 GLY HAy A 28 LYS H 1.0 1.8 5.0 717 615 A 28 LYS H A 27 GLN HBx 1.0 1.8 6.0 718 615 A 28 LYS H A 27 GLN HBy 1.0 1.8 6.0 719 616 A 28 LYS H A 27 GLN HGx 1.0 1.8 6.0 720 616 A 27 GLN HGy A 28 LYS H 1.0 1.8 6.0 721 617 A 28 LYS H A 29 ASN HA 1.0 1.8 5.0 722 618 A 29 ASN H A 28 LYS H 1.0 1.8 5.0 723 619 A 29 ASN H A 28 LYS HA 1.0 1.8 5.0 724 620 A 28 LYS HA A 31 ASN HBx 1.0 1.8 6.0 725 620 A 28 LYS HA A 31 ASN HBy 1.0 1.8 6.0 726 621 A 29 ASN H A 28 LYS HBx 1.0 1.8 6.0 727 621 A 29 ASN H A 28 LYS HBy 1.0 1.8 6.0 728 622 A 29 ASN H A 27 GLN HBx 1.0 1.8 6.0 729 622 A 29 ASN H A 27 GLN HBy 1.0 1.8 6.0 730 623 A 29 ASN H A 27 GLN H 1.0 1.8 5.0 731 624 A 29 ASN H A 28 LYS HA 1.0 1.8 5.0 732 625 A 29 ASN H A 28 LYS HBx 1.0 1.8 6.0 733 625 A 29 ASN H A 28 LYS HBy 1.0 1.8 6.0 734 626 A 29 ASN H A 28 LYS HDx 1.0 1.8 6.0 735 626 A 29 ASN H A 28 LYS HDy 1.0 1.8 6.0 736 627 A 29 ASN H A 28 LYS HGx 1.0 1.8 6.0 737 627 A 28 LYS HGy A 29 ASN H 1.0 1.8 6.0 738 628 A 29 ASN H A 28 LYS H 1.0 1.8 5.0 739 629 A 30 MET H A 29 ASN H 1.0 1.8 5.0 740 630 A 29 ASN H A 31 ASN H 1.0 1.8 5.0 741 631 A 30 MET H A 29 ASN HA 1.0 1.8 5.0 742 632 A 29 ASN HA A 32 LYS HBx 1.0 1.8 6.0 743 632 A 29 ASN HA A 32 LYS HBy 1.0 1.8 6.0 744 633 A 29 ASN HBy A 30 MET H 1.0 1.8 5.0 745 634 A 29 ASN HBy A 33 VAL H 1.0 1.8 5.0 746 635 A 30 MET H A 29 ASN HBx 1.0 1.8 5.0 747 636 A 33 VAL H A 29 ASN HBx 1.0 1.8 5.0 748 637 A 30 MET H A 27 GLN HA 1.0 1.8 5.0 749 638 A 30 MET H A 27 GLN HBx 1.0 1.8 6.0 750 638 A 30 MET H A 27 GLN HBy 1.0 1.8 6.0 751 639 A 30 MET H A 29 ASN HA 1.0 1.8 5.0 752 640 A 30 MET H A 29 ASN HBx 1.0 1.8 5.0 753 641 A 30 MET H A 29 ASN H 1.0 1.8 5.0 754 642 A 30 MET H A 31 ASN H 1.0 1.8 5.0 755 643 A 30 MET H A 28 LYS HGx 1.0 1.8 6.0 756 643 A 30 MET H A 28 LYS HGy 1.0 1.8 6.0 757 644 A 31 ASN H A 28 LYS HA 1.0 1.8 5.0 758 645 A 31 ASN H A 29 ASN HA 1.0 1.8 5.0 759 646 A 31 ASN H A 30 MET HBx 1.0 1.8 6.0 760 646 A 30 MET HBy A 31 ASN H 1.0 1.8 6.0 761 647 A 30 MET H A 31 ASN H 1.0 1.8 5.0 762 648 A 31 ASN H A 32 LYS H 1.0 1.8 5.0 763 649 A 31 ASN H A 33 VAL H 1.0 1.8 5.0 764 650 A 31 ASN HA A 34 ASP HBx 1.0 1.8 6.0 765 650 A 34 ASP HBy A 31 ASN HA 1.0 1.8 6.0 766 651 A 31 ASN HA A 32 LYS H 1.0 1.8 5.0 767 652 A 31 ASN HA A 34 ASP H 1.0 1.8 5.0 768 653 A 28 LYS HA A 32 LYS H 1.0 1.8 5.0 769 654 A 29 ASN HA A 32 LYS H 1.0 1.8 5.0 770 655 A 31 ASN HA A 32 LYS H 1.0 1.8 5.0 771 656 A 32 LYS H A 31 ASN HBx 1.0 1.8 6.0 772 656 A 31 ASN HBy A 32 LYS H 1.0 1.8 6.0 773 657 A 29 ASN HA A 32 LYS HBx 1.0 1.8 6.0 774 657 A 29 ASN HA A 32 LYS HBy 1.0 1.8 6.0 775 658 A 33 VAL H A 30 MET HBx 1.0 1.8 6.0 776 658 A 30 MET HBy A 33 VAL H 1.0 1.8 6.0 777 659 A 33 VAL H A 31 ASN HBx 1.0 1.8 6.0 778 659 A 33 VAL H A 31 ASN HBy 1.0 1.8 6.0 779 660 A 33 VAL H A 32 LYS HA 1.0 1.8 5.0 780 661 A 33 VAL H A 32 LYS HBx 1.0 1.8 6.0 781 661 A 33 VAL H A 32 LYS HBy 1.0 1.8 6.0 782 662 A 33 VAL H A 32 LYS HGx 1.0 1.8 6.0 783 662 A 32 LYS HGy A 33 VAL H 1.0 1.8 6.0 784 663 A 33 VAL H A 32 LYS H 1.0 1.8 5.0 785 664 A 33 VAL H A 34 ASP HBx 1.0 1.8 6.0 786 664 A 34 ASP HBy A 33 VAL H 1.0 1.8 6.0 787 665 A 34 ASP H A 33 VAL H 1.0 1.8 5.0 788 666 A 34 ASP H A 33 VAL HA 1.0 1.8 5.0 789 667 A 30 MET HA A 33 VAL HB 1.0 1.8 5.0 790 668 A 34 ASP H A 33 VAL HB 1.0 1.8 5.0 791 669 A 36 HIS HBy A 33 VAL HA 1.0 1.8 5.0 792 670 A 36 HIS HBx A 33 VAL HA 1.0 1.8 5.0 793 671 A 36 HIS H A 33 VAL HA 1.0 1.8 5.0 794 672 A 34 ASP HA A 33 VAL HGy% 1.0 1.8 6.0 795 673 A 30 MET HA A 33 VAL HGx% 1.0 1.8 6.0 796 674 A 31 ASN HA A 34 ASP H 1.0 1.8 5.0 797 675 A 34 ASP H A 31 ASN HBx 1.0 1.8 6.0 798 675 A 34 ASP H A 31 ASN HBy 1.0 1.8 6.0 799 676 A 34 ASP H A 32 LYS HA 1.0 1.8 5.0 800 677 A 34 ASP H A 33 VAL HA 1.0 1.8 5.0 801 678 A 34 ASP H A 33 VAL HB 1.0 1.8 5.0 802 679 A 33 VAL HGy% A 34 ASP H 1.0 1.8 6.0 803 680 A 33 VAL HGx% A 34 ASP H 1.0 1.8 6.0 804 681 A 34 ASP H A 33 VAL H 1.0 1.8 5.0 805 682 A 34 ASP H A 35 HIS H 1.0 1.8 5.0 806 683 A 36 HIS H A 34 ASP H 1.0 1.8 5.0 807 684 A 32 LYS HA A 35 HIS H 1.0 1.8 5.0 808 685 A 35 HIS H A 32 LYS HBx 1.0 1.8 6.0 809 685 A 32 LYS HBy A 35 HIS H 1.0 1.8 6.0 810 686 A 34 ASP HA A 35 HIS H 1.0 1.8 5.0 811 687 A 35 HIS H A 34 ASP HBx 1.0 1.8 6.0 812 687 A 34 ASP HBy A 35 HIS H 1.0 1.8 6.0 813 688 A 34 ASP H A 35 HIS H 1.0 1.8 5.0 814 689 A 35 HIS HA A 38 GLN HBx 1.0 1.8 5.0 815 690 A 35 HIS HA A 38 GLN HBy 1.0 1.8 5.0 816 691 A 35 HIS HA A 38 GLN H 1.0 1.8 5.0 817 692 A 35 HIS HA A 39 ASN H 1.0 1.8 5.0 818 693 A 32 LYS HA A 35 HIS HBx 1.0 1.8 6.0 819 693 A 32 LYS HA A 35 HIS HBy 1.0 1.8 6.0 820 694 A 36 HIS H A 35 HIS HBx 1.0 1.8 6.0 821 694 A 36 HIS H A 35 HIS HBy 1.0 1.8 6.0 822 695 A 36 HIS H A 32 LYS HA 1.0 1.8 5.0 823 696 A 36 HIS H A 35 HIS HBx 1.0 1.8 6.0 824 696 A 36 HIS H A 35 HIS HBy 1.0 1.8 6.0 825 697 A 36 HIS H A 37 LEU H 1.0 1.8 5.0 826 698 A 36 HIS H A 38 GLN H 1.0 1.8 5.0 827 699 A 37 LEU H A 36 HIS HA 1.0 1.8 5.0 828 700 A 36 HIS HA A 39 ASN HBy 1.0 1.8 5.0 829 701 A 39 ASN H A 36 HIS HA 1.0 1.8 5.0 830 702 A 37 LEU H A 36 HIS HBy 1.0 1.8 5.0 831 703 A 37 LEU H A 33 VAL HA 1.0 1.8 5.0 832 704 A 37 LEU H A 33 VAL HB 1.0 1.8 5.0 833 705 A 37 LEU H A 33 VAL HGy% 1.0 1.8 6.0 834 706 A 34 ASP HA A 37 LEU H 1.0 1.8 5.0 835 707 A 37 LEU H A 36 HIS HA 1.0 1.8 5.0 836 708 A 37 LEU H A 36 HIS HBy 1.0 1.8 5.0 837 709 A 36 HIS H A 37 LEU H 1.0 1.8 5.0 838 710 A 37 LEU H A 39 ASN H 1.0 1.8 5.0 839 711 A 37 LEU HA A 40 VAL HB 1.0 1.8 5.0 840 712 A 37 LEU HA A 39 ASN H 1.0 1.8 5.0 841 713 A 34 ASP HA A 37 LEU HBx 1.0 1.8 5.0 842 714 A 37 LEU HBx A 38 GLN H 1.0 1.8 5.0 843 715 A 34 ASP HA A 37 LEU HBy 1.0 1.8 5.0 844 716 A 37 LEU HDx% A 34 ASP HA 1.0 1.8 5.0 845 717 A 35 HIS HA A 38 GLN H 1.0 1.8 5.0 846 718 A 38 GLN H A 35 HIS HBx 1.0 1.8 6.0 847 718 A 38 GLN H A 35 HIS HBy 1.0 1.8 6.0 848 719 A 37 LEU HBx A 38 GLN H 1.0 1.8 5.0 849 720 A 37 LEU HBy A 38 GLN H 1.0 1.8 5.0 850 721 A 37 LEU HDy% A 38 GLN H 1.0 1.8 6.0 851 722 A 37 LEU HG A 38 GLN H 1.0 1.8 5.0 852 723 A 39 ASN H A 38 GLN H 1.0 1.8 5.0 853 724 A 38 GLN HA A 41 ILE HB 1.0 1.8 5.0 854 725 A 41 ILE HD1% A 38 GLN HA 1.0 1.8 6.0 855 726 A 41 ILE HG2% A 38 GLN HA 1.0 1.8 6.0 856 727 A 38 GLN HA A 41 ILE H 1.0 1.8 5.0 857 728 A 38 GLN HA A 39 ASN H 1.0 1.8 5.0 858 729 A 39 ASN H A 38 GLN HBx 1.0 1.8 5.0 859 730 A 39 ASN H A 36 HIS HA 1.0 1.8 5.0 860 731 A 38 GLN HA A 39 ASN H 1.0 1.8 5.0 861 732 A 39 ASN H A 38 GLN HBx 1.0 1.8 5.0 862 733 A 39 ASN H A 38 GLN H 1.0 1.8 5.0 863 734 A 39 ASN HA A 42 GLU HBx 1.0 1.8 4.3 864 734 A 42 GLU HBy A 39 ASN HA 1.0 1.8 4.3 865 735 A 39 ASN HA A 42 GLU HGx 1.0 1.8 6.0 866 735 A 42 GLU HGy A 39 ASN HA 1.0 1.8 6.0 867 736 A 39 ASN HA A 42 GLU H 1.0 1.8 5.0 868 737 A 43 ASP H A 39 ASN HA 1.0 1.8 5.0 869 738 A 36 HIS HA A 39 ASN HBy 1.0 1.8 5.0 870 739 A 40 VAL HGy% A 39 ASN HBy 1.0 1.8 6.0 871 740 A 36 HIS HA A 39 ASN HBx 1.0 1.8 5.0 872 741 A 39 ASN HBx A 42 GLU HBx 1.0 1.8 6.0 873 741 A 42 GLU HBy A 39 ASN HBx 1.0 1.8 6.0 874 742 A 37 LEU HA A 40 VAL H 1.0 1.8 5.0 875 743 A 39 ASN HA A 40 VAL H 1.0 1.8 5.0 876 744 A 39 ASN HBy A 40 VAL H 1.0 1.8 5.0 877 745 A 39 ASN HBx A 40 VAL H 1.0 1.8 5.0 878 746 A 41 ILE H A 40 VAL H 1.0 1.8 5.0 879 747 A 42 GLU H A 40 VAL H 1.0 1.8 5.0 880 748 A 40 VAL HA A 43 ASP HBx 1.0 1.8 5.0 881 749 A 37 LEU HA A 40 VAL HB 1.0 1.8 5.0 882 750 A 41 ILE H A 40 VAL HB 1.0 1.8 5.0 883 751 A 40 VAL HA A 37 LEU HA 1.0 1.8 5.0 884 752 A 40 VAL HA A 39 ASN HA 1.0 1.8 5.0 885 753 A 41 ILE H A 40 VAL HA 1.0 1.8 5.0 886 754 A 43 ASP HBy A 40 VAL HA 1.0 1.8 5.0 887 755 A 40 VAL HA A 43 ASP H 1.0 1.8 5.0 888 756 A 40 VAL HGy% A 43 ASP HBx 1.0 1.8 6.0 889 757 A 40 VAL HGx% A 41 ILE H 1.0 1.8 6.0 890 758 A 40 VAL HGy% A 37 LEU HA 1.0 1.8 6.0 891 759 A 40 VAL HGy% A 41 ILE H 1.0 1.8 6.0 892 760 A 40 VAL HGx% A 37 LEU HA 1.0 1.8 6.0 893 761 A 38 GLN HA A 41 ILE H 1.0 1.8 5.0 894 762 A 41 ILE H A 40 VAL HA 1.0 1.8 5.0 895 763 A 41 ILE H A 40 VAL HB 1.0 1.8 5.0 896 764 A 40 VAL HGy% A 41 ILE H 1.0 1.8 6.0 897 765 A 41 ILE H A 40 VAL H 1.0 1.8 5.0 898 766 A 41 ILE H A 43 ASP H 1.0 1.8 5.0 899 767 A 41 ILE HA A 44 ILE H 1.0 1.8 5.0 900 768 A 41 ILE HA A 45 HIS H 1.0 1.8 5.0 901 769 A 38 GLN HA A 41 ILE HB 1.0 1.8 5.0 902 770 A 41 ILE HD1% A 38 GLN HGx 1.0 1.8 6.0 903 771 A 41 ILE HD1% A 38 GLN HGy 1.0 1.8 6.0 904 772 A 41 ILE HD1% A 42 GLU H 1.0 1.8 6.0 905 773 A 41 ILE HG1y A 38 GLN HA 1.0 1.8 5.0 906 774 A 41 ILE HG2% A 38 GLN HA 1.0 1.8 6.0 907 775 A 41 ILE HG2% A 42 GLU HA 1.0 1.8 6.0 908 776 A 41 ILE HG2% A 42 GLU H 1.0 1.8 6.0 909 777 A 41 ILE HG2% A 44 ILE H 1.0 1.8 6.0 910 778 A 41 ILE HG2% A 45 HIS HD2 1.0 1.8 6.0 911 779 A 41 ILE HG2% A 45 HIS H 1.0 1.8 6.0 912 780 A 39 ASN HA A 42 GLU H 1.0 1.8 5.0 913 781 A 41 ILE HA A 42 GLU H 1.0 1.8 5.0 914 782 A 41 ILE HB A 42 GLU H 1.0 1.8 5.0 915 783 A 41 ILE HD1% A 42 GLU H 1.0 1.8 6.0 916 784 A 41 ILE HG2% A 42 GLU H 1.0 1.8 6.0 917 785 A 43 ASP HBy A 42 GLU H 1.0 1.8 5.0 918 786 A 43 ASP HBx A 42 GLU H 1.0 1.8 5.0 919 787 A 43 ASP H A 42 GLU H 1.0 1.8 5.0 920 788 A 44 ILE H A 42 GLU H 1.0 1.8 5.0 921 789 A 41 ILE HG2% A 42 GLU HA 1.0 1.8 6.0 922 790 A 42 GLU HA A 45 HIS HBx 1.0 1.8 6.0 923 790 A 45 HIS HBy A 42 GLU HA 1.0 1.8 6.0 924 791 A 39 ASN HA A 42 GLU HBx 1.0 1.8 6.0 925 791 A 42 GLU HBy A 39 ASN HA 1.0 1.8 6.0 926 792 A 43 ASP H A 42 GLU HBx 1.0 1.8 6.0 927 792 A 43 ASP H A 42 GLU HBy 1.0 1.8 6.0 928 793 A 39 ASN HA A 42 GLU HGx 1.0 1.8 6.0 929 793 A 42 GLU HGy A 39 ASN HA 1.0 1.8 6.0 930 794 A 42 GLU HGx A 45 HIS HBx 1.0 1.8 6.0 931 794 A 42 GLU HGy A 45 HIS HBx 1.0 1.8 6.0 932 794 A 45 HIS HBy A 42 GLU HGx 1.0 1.8 6.0 933 794 A 45 HIS HBy A 42 GLU HGy 1.0 1.8 6.0 934 795 A 40 VAL HA A 43 ASP H 1.0 1.8 5.0 935 796 A 43 ASP H A 40 VAL HB 1.0 1.8 5.0 936 797 A 43 ASP H A 42 GLU HA 1.0 1.8 5.0 937 798 A 43 ASP H A 42 GLU HBx 1.0 1.8 6.0 938 798 A 43 ASP H A 42 GLU HBy 1.0 1.8 6.0 939 799 A 43 ASP H A 42 GLU HGx 1.0 1.8 6.0 940 799 A 43 ASP H A 42 GLU HGy 1.0 1.8 6.0 941 800 A 45 HIS H A 43 ASP H 1.0 1.8 5.0 942 801 A 43 ASP H A 42 GLU H 1.0 1.8 5.0 943 802 A 43 ASP HA A 46 ASP HBy 1.0 1.8 5.0 944 803 A 43 ASP HA A 42 GLU HGx 1.0 1.8 6.0 945 803 A 42 GLU HGy A 43 ASP HA 1.0 1.8 6.0 946 804 A 46 ASP H A 43 ASP HA 1.0 1.8 5.0 947 805 A 43 ASP HBy A 40 VAL HA 1.0 1.8 5.0 948 806 A 40 VAL HA A 43 ASP HBx 1.0 1.8 5.0 949 807 A 41 ILE HA A 44 ILE H 1.0 1.8 5.0 950 808 A 44 ILE H A 43 ASP HA 1.0 1.8 5.0 951 809 A 43 ASP HBy A 44 ILE H 1.0 1.8 5.0 952 810 A 43 ASP HBx A 44 ILE H 1.0 1.8 5.0 953 811 A 45 HIS H A 44 ILE H 1.0 1.8 5.0 954 812 A 44 ILE HA A 47 PHE HBx 1.0 1.8 5.0 955 813 A 44 ILE HA A 45 HIS H 1.0 1.8 5.0 956 814 A 44 ILE HA A 46 ASP H 1.0 1.8 5.0 957 815 A 44 ILE HA A 47 PHE HD% 1.0 1.8 7.4 958 816 A 44 ILE HA A 47 PHE H 1.0 1.8 5.0 959 817 A 41 ILE HA A 44 ILE HB 1.0 1.8 5.0 960 818 A 44 ILE HB A 45 HIS H 1.0 1.8 5.0 961 819 A 40 VAL HGx% A 44 ILE HB 1.0 1.8 6.0 962 820 A 44 ILE HD1% A 41 ILE HG1x 1.0 1.8 7.0 963 821 A 41 ILE HG2% A 44 ILE HD1% 1.0 1.8 4.9 964 822 A 44 ILE HD1% A 41 ILE HA 1.0 1.8 6.0 965 823 A 41 ILE HA A 44 ILE HG2% 1.0 1.8 6.0 966 824 A 45 HIS HA A 44 ILE HG2% 1.0 1.8 6.0 967 825 A 45 HIS H A 44 ILE HG2% 1.0 1.8 6.0 968 826 A 47 PHE HBx A 44 ILE HG2% 1.0 1.8 6.0 969 827 A 47 PHE HD% A 44 ILE HG2% 1.0 1.8 6.0 970 828 A 47 PHE H A 44 ILE HG2% 1.0 1.8 6.0 971 829 A 45 HIS H A 42 GLU HA 1.0 1.8 5.0 972 830 A 45 HIS H A 42 GLU HBx 1.0 1.8 6.0 973 830 A 45 HIS H A 42 GLU HBy 1.0 1.8 6.0 974 831 A 45 HIS H A 43 ASP HA 1.0 1.8 5.0 975 832 A 45 HIS H A 43 ASP H 1.0 1.8 5.0 976 833 A 44 ILE HA A 45 HIS H 1.0 1.8 5.0 977 834 A 44 ILE HB A 45 HIS H 1.0 1.8 5.0 978 835 A 44 ILE HD1% A 45 HIS H 1.0 1.8 6.0 979 836 A 44 ILE HG1y A 45 HIS H 1.0 1.8 6.0 980 836 A 45 HIS H A 44 ILE HG1x 1.0 1.8 6.0 981 837 A 45 HIS H A 44 ILE H 1.0 1.8 5.0 982 838 A 45 HIS H A 46 ASP H 1.0 1.8 5.0 983 839 A 45 HIS H A 47 PHE H 1.0 1.8 5.0 984 840 A 45 HIS HA A 48 MET HBx 1.0 1.8 6.0 985 840 A 45 HIS HA A 48 MET HBy 1.0 1.8 6.0 986 841 A 45 HIS HA A 46 ASP H 1.0 1.8 5.0 987 842 A 45 HIS HA A 47 PHE H 1.0 1.8 5.0 988 843 A 45 HIS HA A 48 MET HGx 1.0 1.8 5.0 989 844 A 41 ILE HG2% A 45 HIS HBx 1.0 1.8 7.0 990 844 A 41 ILE HG2% A 45 HIS HBy 1.0 1.8 7.0 991 845 A 46 ASP H A 45 HIS HBx 1.0 1.8 6.0 992 845 A 45 HIS HBy A 46 ASP H 1.0 1.8 6.0 993 846 A 42 GLU HA A 45 HIS HBx 1.0 1.8 6.0 994 846 A 45 HIS HBy A 42 GLU HA 1.0 1.8 6.0 995 847 A 46 ASP H A 45 HIS HBx 1.0 1.8 6.0 996 847 A 45 HIS HBy A 46 ASP H 1.0 1.8 6.0 997 848 A 42 GLU HA A 46 ASP H 1.0 1.8 5.0 998 849 A 46 ASP H A 43 ASP HA 1.0 1.8 5.0 999 850 A 44 ILE HA A 46 ASP H 1.0 1.8 5.0 1000 851 A 44 ILE H A 46 ASP H 1.0 1.8 5.0 1001 852 A 45 HIS HA A 46 ASP H 1.0 1.8 5.0 1002 853 A 46 ASP H A 45 HIS HBx 1.0 1.8 6.0 1003 853 A 45 HIS HBy A 46 ASP H 1.0 1.8 6.0 1004 854 A 45 HIS H A 46 ASP H 1.0 1.8 5.0 1005 855 A 48 MET H A 46 ASP H 1.0 1.8 5.0 1006 856 A 47 PHE H A 46 ASP H 1.0 1.8 5.0 1007 857 A 47 PHE H A 46 ASP HA 1.0 1.8 5.0 1008 858 A 46 ASP HA A 49 GLN HBy 1.0 1.8 5.0 1009 859 A 49 GLN HBx A 46 ASP HA 1.0 1.8 5.0 1010 860 A 46 ASP HA A 49 GLN HGx 1.0 1.8 6.0 1011 860 A 46 ASP HA A 49 GLN HGy 1.0 1.8 6.0 1012 861 A 43 ASP HA A 46 ASP HBy 1.0 1.8 5.0 1013 862 A 47 PHE H A 46 ASP HBy 1.0 1.8 5.0 1014 863 A 43 ASP HA A 46 ASP HBx 1.0 1.8 5.0 1015 864 A 46 ASP HBx A 45 HIS HBx 1.0 1.8 6.0 1016 864 A 45 HIS HBy A 46 ASP HBx 1.0 1.8 6.0 1017 865 A 47 PHE H A 43 ASP HA 1.0 1.8 5.0 1018 866 A 44 ILE HA A 47 PHE H 1.0 1.8 5.0 1019 867 A 44 ILE HB A 47 PHE H 1.0 1.8 5.0 1020 868 A 44 ILE HG1y A 47 PHE H 1.0 1.8 6.0 1021 868 A 47 PHE H A 44 ILE HG1x 1.0 1.8 6.0 1022 869 A 45 HIS HA A 47 PHE H 1.0 1.8 5.0 1023 870 A 47 PHE H A 45 HIS HBx 1.0 1.8 6.0 1024 870 A 45 HIS HBy A 47 PHE H 1.0 1.8 6.0 1025 871 A 47 PHE H A 46 ASP HA 1.0 1.8 5.0 1026 872 A 47 PHE H A 46 ASP HBy 1.0 1.8 5.0 1027 873 A 47 PHE H A 46 ASP HBx 1.0 1.8 5.0 1028 874 A 47 PHE H A 46 ASP H 1.0 1.8 5.0 1029 875 A 47 PHE H A 49 GLN H 1.0 1.8 5.0 1030 876 A 47 PHE HA A 49 GLN H 1.0 1.8 5.0 1031 877 A 44 ILE HA A 47 PHE HBx 1.0 1.8 5.0 1032 878 A 44 ILE HA A 47 PHE HBy 1.0 1.8 5.0 1033 879 A 44 ILE HA A 48 MET H 1.0 1.8 5.0 1034 880 A 45 HIS HA A 48 MET H 1.0 1.8 5.0 1035 881 A 47 PHE HA A 48 MET H 1.0 1.8 5.0 1036 882 A 47 PHE HBx A 48 MET H 1.0 1.8 5.0 1037 883 A 47 PHE HBy A 48 MET H 1.0 1.8 5.0 1038 884 A 48 MET H A 47 PHE HD% 1.0 1.8 7.4 1039 885 A 48 MET H A 49 GLN H 1.0 1.8 5.0 1040 886 A 48 MET H A 50 GLY H 1.0 1.8 5.0 1041 887 A 48 MET HA A 47 PHE HD% 1.0 1.8 7.4 1042 888 A 48 MET HA A 49 GLN H 1.0 1.8 5.0 1043 889 A 45 HIS HA A 48 MET HBx 1.0 1.8 6.0 1044 889 A 45 HIS HA A 48 MET HBy 1.0 1.8 6.0 1045 890 A 49 GLN H A 48 MET HBx 1.0 1.8 6.0 1046 890 A 48 MET HBy A 49 GLN H 1.0 1.8 6.0 1047 891 A 48 MET HGx A 47 PHE HD% 1.0 1.8 7.4 1048 892 A 48 MET HGy A 47 PHE HD% 1.0 1.8 7.4 1049 893 A 48 MET HGy A 49 GLN H 1.0 1.8 5.0 1050 894 A 49 GLN H A 46 ASP HA 1.0 1.8 5.0 1051 895 A 47 PHE H A 49 GLN H 1.0 1.8 5.0 1052 896 A 48 MET HA A 49 GLN H 1.0 1.8 5.0 1053 897 A 49 GLN H A 48 MET HBx 1.0 1.8 6.0 1054 897 A 48 MET HBy A 49 GLN H 1.0 1.8 6.0 1055 898 A 48 MET HGy A 49 GLN H 1.0 1.8 5.0 1056 899 A 48 MET H A 49 GLN H 1.0 1.8 5.0 1057 900 A 49 GLN H A 51 GLY H 1.0 1.8 5.0 1058 901 A 47 PHE HD% A 49 GLN HGx 1.0 1.8 8.4 1059 901 A 47 PHE HD% A 49 GLN HGy 1.0 1.8 8.4 1060 902 A 50 GLY H A 46 ASP HA 1.0 1.8 5.0 1061 903 A 47 PHE HA A 50 GLY H 1.0 1.8 5.0 1062 904 A 48 MET HA A 50 GLY H 1.0 1.8 5.0 1063 905 A 50 GLY H A 49 GLN HA 1.0 1.8 5.0 1064 906 A 50 GLY H A 49 GLN HBy 1.0 1.8 5.0 1065 907 A 50 GLY H A 49 GLN HBx 1.0 1.8 5.0 1066 908 A 50 GLY H A 49 GLN HGx 1.0 1.8 6.0 1067 908 A 50 GLY H A 49 GLN HGy 1.0 1.8 6.0 1068 909 A 50 GLY H A 51 GLY HAx 1.0 1.8 6.0 1069 909 A 50 GLY H A 51 GLY HAy 1.0 1.8 6.0 1070 910 A 50 GLY H A 51 GLY H 1.0 1.8 5.0 1071 911 A 49 GLN HGx A 50 GLY HAx 1.0 1.8 7.0 1072 911 A 49 GLN HGy A 50 GLY HAx 1.0 1.8 7.0 1073 911 A 50 GLY HAy A 49 GLN HGx 1.0 1.8 7.0 1074 911 A 49 GLN HGy A 50 GLY HAy 1.0 1.8 7.0 1075 912 A 47 PHE HA A 51 GLY H 1.0 1.8 5.0 1076 913 A 48 MET HA A 51 GLY H 1.0 1.8 5.0 1077 914 A 51 GLY H A 49 GLN HBy 1.0 1.8 5.0 1078 915 A 51 GLY H A 50 GLY HAx 1.0 1.8 6.0 1079 915 A 51 GLY H A 50 GLY HAy 1.0 1.8 6.0 1080 916 A 50 GLY H A 51 GLY H 1.0 1.8 5.0 1081 917 A 51 GLY HAx A 52 GLY HAx 1.0 1.8 7.0 1082 917 A 52 GLY HAy A 51 GLY HAx 1.0 1.8 7.0 1083 917 A 52 GLY HAy A 51 GLY HAy 1.0 1.8 7.0 1084 917 A 51 GLY HAy A 52 GLY HAx 1.0 1.8 7.0 1085 918 A 47 PHE HA A 52 GLY H 1.0 1.8 5.0 1086 919 A 52 GLY H A 50 GLY HAx 1.0 1.8 6.0 1087 919 A 52 GLY H A 50 GLY HAy 1.0 1.8 6.0 1088 920 A 52 GLY H A 50 GLY H 1.0 1.8 5.0 1089 921 A 52 GLY H A 51 GLY HAx 1.0 1.8 6.0 1090 921 A 52 GLY H A 51 GLY HAy 1.0 1.8 6.0 1091 922 A 52 GLY H A 53 SER HBx 1.0 1.8 5.0 1092 923 A 52 GLY H A 53 SER HBy 1.0 1.8 5.0 1093 924 A 52 GLY H A 53 SER H 1.0 1.8 5.0 1094 925 A 53 SER H A 52 GLY HAx 1.0 1.8 6.0 1095 925 A 52 GLY HAy A 53 SER H 1.0 1.8 6.0 1096 926 A 53 SER H A 52 GLY HAx 1.0 1.8 6.0 1097 926 A 52 GLY HAy A 53 SER H 1.0 1.8 6.0 1098 927 A 52 GLY H A 53 SER H 1.0 1.8 5.0 1099 928 A 53 SER H A 56 LYS HBx 1.0 1.8 6.0 1100 928 A 56 LYS HBy A 53 SER H 1.0 1.8 6.0 1101 929 A 53 SER HA A 52 GLY HAx 1.0 1.8 6.0 1102 929 A 52 GLY HAy A 53 SER HA 1.0 1.8 6.0 1103 930 A 56 LYS HA A 53 SER HBx 1.0 1.8 5.0 1104 931 A 53 SER HBx A 54 GLY H 1.0 1.8 5.0 1105 932 A 55 GLY H A 53 SER HBx 1.0 1.8 5.0 1106 933 A 53 SER HBx A 56 LYS HBx 1.0 1.8 6.0 1107 933 A 56 LYS HBy A 53 SER HBx 1.0 1.8 6.0 1108 934 A 56 LYS H A 53 SER HBx 1.0 1.8 5.0 1109 935 A 53 SER HBy A 54 GLY H 1.0 1.8 5.0 1110 936 A 55 GLY H A 53 SER HBy 1.0 1.8 5.0 1111 937 A 56 LYS H A 53 SER HBy 1.0 1.8 5.0 1112 938 A 53 SER HBy A 55 GLY HAx 1.0 1.8 6.0 1113 938 A 53 SER HBy A 55 GLY HAy 1.0 1.8 6.0 1114 939 A 56 LYS HA A 53 SER HBy 1.0 1.8 5.0 1115 940 A 53 SER HA A 54 GLY H 1.0 1.8 5.0 1116 941 A 54 GLY H A 53 SER HG 1.0 1.8 5.0 1117 942 A 53 SER H A 54 GLY H 1.0 1.8 5.0 1118 943 A 55 GLY H A 54 GLY H 1.0 1.8 5.0 1119 944 A 56 LYS H A 54 GLY H 1.0 1.8 5.0 1120 945 A 53 SER HA A 54 GLY HAx 1.0 1.8 5.0 1121 946 A 55 GLY H A 54 GLY HAx 1.0 1.8 5.0 1122 947 A 57 LEU HBx A 54 GLY HAx 1.0 1.8 5.0 1123 948 A 57 LEU HBy A 54 GLY HAx 1.0 1.8 5.0 1124 949 A 57 LEU H A 54 GLY HAx 1.0 1.8 5.0 1125 950 A 54 GLY HAy A 53 SER HA 1.0 1.8 5.0 1126 951 A 54 GLY HAy A 55 GLY H 1.0 1.8 5.0 1127 952 A 54 GLY HAy A 57 LEU HBx 1.0 1.8 5.0 1128 953 A 54 GLY HAy A 57 LEU HBy 1.0 1.8 5.0 1129 954 A 57 LEU H A 54 GLY HAy 1.0 1.8 5.0 1130 955 A 55 GLY H A 53 SER HA 1.0 1.8 5.0 1131 956 A 55 GLY H A 53 SER HBy 1.0 1.8 5.0 1132 957 A 55 GLY H A 53 SER HBx 1.0 1.8 5.0 1133 958 A 54 GLY HAy A 55 GLY H 1.0 1.8 5.0 1134 959 A 55 GLY H A 54 GLY H 1.0 1.8 5.0 1135 960 A 55 GLY H A 56 LYS HBx 1.0 1.8 6.0 1136 960 A 56 LYS HBy A 55 GLY H 1.0 1.8 6.0 1137 961 A 55 GLY H A 56 LYS H 1.0 1.8 5.0 1138 962 A 56 LYS H A 55 GLY HAx 1.0 1.8 6.0 1139 962 A 56 LYS H A 55 GLY HAy 1.0 1.8 6.0 1140 963 A 55 GLY HAy A 58 GLN HBx 1.0 1.8 5.3 1141 963 A 55 GLY HAx A 58 GLN HBx 1.0 1.8 5.3 1142 963 A 58 GLN HBy A 55 GLY HAx 1.0 1.8 5.3 1143 963 A 55 GLY HAy A 58 GLN HBy 1.0 1.8 5.3 1144 964 A 55 GLY HAy A 58 GLN HGx 1.0 1.8 7.0 1145 964 A 55 GLY HAx A 58 GLN HGx 1.0 1.8 7.0 1146 964 A 58 GLN HGy A 55 GLY HAx 1.0 1.8 7.0 1147 964 A 55 GLY HAy A 58 GLN HGy 1.0 1.8 7.0 1148 965 A 58 GLN H A 55 GLY HAx 1.0 1.8 6.0 1149 965 A 58 GLN H A 55 GLY HAy 1.0 1.8 6.0 1150 966 A 56 LYS H A 53 SER HBy 1.0 1.8 5.0 1151 967 A 56 LYS H A 53 SER HG 1.0 1.8 5.0 1152 968 A 56 LYS H A 53 SER H 1.0 1.8 5.0 1153 969 A 56 LYS H A 54 GLY H 1.0 1.8 5.0 1154 970 A 56 LYS H A 55 GLY HAx 1.0 1.8 6.0 1155 970 A 56 LYS H A 55 GLY HAy 1.0 1.8 6.0 1156 971 A 55 GLY H A 56 LYS H 1.0 1.8 5.0 1157 972 A 57 LEU HBx A 56 LYS H 1.0 1.8 5.0 1158 973 A 57 LEU H A 56 LYS H 1.0 1.8 5.0 1159 974 A 58 GLN H A 56 LYS H 1.0 1.8 5.0 1160 975 A 56 LYS HA A 59 GLU HBx 1.0 1.8 6.0 1161 975 A 56 LYS HA A 59 GLU HBy 1.0 1.8 6.0 1162 976 A 57 LEU H A 54 GLY HAx 1.0 1.8 5.0 1163 977 A 57 LEU H A 56 LYS HA 1.0 1.8 5.0 1164 978 A 57 LEU H A 56 LYS HBx 1.0 1.8 6.0 1165 978 A 56 LYS HBy A 57 LEU H 1.0 1.8 6.0 1166 979 A 57 LEU H A 56 LYS H 1.0 1.8 5.0 1167 980 A 57 LEU H A 58 GLN H 1.0 1.8 5.0 1168 981 A 57 LEU HA A 60 MET HBx 1.0 1.8 6.0 1169 981 A 60 MET HBy A 57 LEU HA 1.0 1.8 6.0 1170 982 A 57 LEU HBx A 58 GLN H 1.0 1.8 5.0 1171 983 A 57 LEU HBy A 58 GLN H 1.0 1.8 5.0 1172 984 A 60 MET HBy A 57 LEU HDy% 1.0 1.8 7.0 1173 984 A 57 LEU HDy% A 60 MET HBx 1.0 1.8 7.0 1174 985 A 60 MET HGy A 57 LEU HDy% 1.0 1.8 6.0 1175 986 A 57 LEU HDy% A 61 MET HBy 1.0 1.8 6.0 1176 987 A 58 GLN HA A 57 LEU HDx% 1.0 1.8 6.0 1177 988 A 58 GLN H A 55 GLY HAx 1.0 1.8 6.0 1178 988 A 58 GLN H A 55 GLY HAy 1.0 1.8 6.0 1179 989 A 58 GLN H A 56 LYS HA 1.0 1.8 5.0 1180 990 A 58 GLN H A 56 LYS H 1.0 1.8 5.0 1181 991 A 57 LEU HA A 58 GLN H 1.0 1.8 5.0 1182 992 A 57 LEU HBx A 58 GLN H 1.0 1.8 5.0 1183 993 A 57 LEU HBy A 58 GLN H 1.0 1.8 5.0 1184 994 A 58 GLN H A 57 LEU HDx% 1.0 1.8 6.0 1185 994 A 58 GLN H A 57 LEU HDy% 1.0 1.8 6.0 1186 995 A 58 GLN H A 57 LEU HG 1.0 1.8 5.0 1187 996 A 57 LEU H A 58 GLN H 1.0 1.8 5.0 1188 997 A 58 GLN H A 59 GLU H 1.0 1.8 5.0 1189 998 A 58 GLN HA A 61 MET HBy 1.0 1.8 6.0 1190 998 A 58 GLN HA A 61 MET HBx 1.0 1.8 6.0 1191 999 A 58 GLN HA A 57 LEU HDx% 1.0 1.8 6.0 1192 1000 A 58 GLN HA A 59 GLU H 1.0 1.8 5.0 1193 1001 A 56 LYS HA A 59 GLU H 1.0 1.8 5.0 1194 1002 A 59 GLU H A 56 LYS HBx 1.0 1.8 6.0 1195 1002 A 56 LYS HBy A 59 GLU H 1.0 1.8 6.0 1196 1003 A 57 LEU H A 59 GLU H 1.0 1.8 5.0 1197 1004 A 57 LEU HA A 59 GLU H 1.0 1.8 5.0 1198 1005 A 58 GLN HA A 59 GLU H 1.0 1.8 5.0 1199 1006 A 58 GLN H A 59 GLU H 1.0 1.8 5.0 1200 1007 A 60 MET H A 59 GLU H 1.0 1.8 5.0 1201 1008 A 59 GLU HA A 62 LYS HBy 1.0 1.8 6.0 1202 1008 A 59 GLU HA A 62 LYS HBx 1.0 1.8 6.0 1203 1009 A 60 MET H A 56 LYS HA 1.0 1.8 5.0 1204 1010 A 57 LEU HA A 60 MET H 1.0 1.8 5.0 1205 1011 A 60 MET H A 58 GLN H 1.0 1.8 5.0 1206 1012 A 60 MET H A 58 GLN HA 1.0 1.8 5.0 1207 1013 A 60 MET H A 59 GLU HA 1.0 1.8 5.0 1208 1014 A 60 MET H A 59 GLU H 1.0 1.8 5.0 1209 1015 A 57 LEU HA A 60 MET HBx 1.0 1.8 6.0 1210 1015 A 60 MET HBy A 57 LEU HA 1.0 1.8 6.0 1211 1016 A 60 MET HGx A 57 LEU HBx 1.0 1.8 5.0 1212 1017 A 58 GLN HA A 61 MET H 1.0 1.8 5.0 1213 1018 A 61 MET H A 58 GLN HBx 1.0 1.8 6.0 1214 1018 A 61 MET H A 58 GLN HBy 1.0 1.8 6.0 1215 1019 A 61 MET H A 60 MET HA 1.0 1.8 5.0 1216 1020 A 60 MET H A 61 MET H 1.0 1.8 5.0 1217 1021 A 61 MET H A 62 LYS H 1.0 1.8 5.0 1218 1022 A 64 PHE HBx A 61 MET HA 1.0 1.8 5.0 1219 1023 A 61 MET HA A 64 PHE HBy 1.0 1.8 5.0 1220 1024 A 64 PHE HD% A 61 MET HA 1.0 1.8 7.4 1221 1025 A 64 PHE H A 61 MET HA 1.0 1.8 5.0 1222 1026 A 57 LEU HDy% A 61 MET HGy 1.0 1.8 6.0 1223 1027 A 57 LEU HDy% A 61 MET HGx 1.0 1.8 6.0 1224 1028 A 58 GLN HA A 62 LYS H 1.0 1.8 5.0 1225 1029 A 59 GLU HA A 62 LYS H 1.0 1.8 5.0 1226 1030 A 62 LYS H A 59 GLU HBx 1.0 1.8 6.0 1227 1030 A 59 GLU HBy A 62 LYS H 1.0 1.8 6.0 1228 1031 A 60 MET H A 62 LYS H 1.0 1.8 5.0 1229 1032 A 60 MET HA A 62 LYS H 1.0 1.8 5.0 1230 1033 A 62 LYS H A 61 MET HA 1.0 1.8 5.0 1231 1034 A 61 MET HBx A 62 LYS H 1.0 1.8 5.0 1232 1035 A 62 LYS H A 61 MET HGy 1.0 1.8 5.0 1233 1036 A 61 MET H A 62 LYS H 1.0 1.8 5.0 1234 1037 A 62 LYS H A 63 GLU H 1.0 1.8 5.0 1235 1038 A 59 GLU HA A 62 LYS HBy 1.0 1.8 7.0 1236 1038 A 59 GLU HA A 62 LYS HBx 1.0 1.8 7.0 1237 1039 A 60 MET HA A 63 GLU H 1.0 1.8 5.0 1238 1040 A 63 GLU H A 60 MET HBx 1.0 1.8 6.0 1239 1040 A 60 MET HBy A 63 GLU H 1.0 1.8 6.0 1240 1041 A 61 MET H A 63 GLU H 1.0 1.8 5.0 1241 1042 A 63 GLU H A 62 LYS HBy 1.0 1.8 6.0 1242 1042 A 62 LYS HBx A 63 GLU H 1.0 1.8 6.0 1243 1043 A 63 GLU H A 62 LYS HA 1.0 1.8 6.0 1244 1044 A 62 LYS H A 63 GLU H 1.0 1.8 5.0 1245 1045 A 64 PHE H A 63 GLU H 1.0 1.8 5.0 1246 1046 A 63 GLU H A 65 GLN H 1.0 1.8 5.0 1247 1047 A 62 LYS HBx A 63 GLU HA 1.0 1.8 5.0 1248 1048 A 63 GLU HA A 66 GLN HBx 1.0 1.8 5.0 1249 1049 A 66 GLN H A 63 GLU HA 1.0 1.8 5.0 1250 1050 A 63 GLU HBy A 60 MET HA 1.0 1.8 5.0 1251 1051 A 63 GLU HBy A 64 PHE H 1.0 1.8 5.0 1252 1052 A 64 PHE H A 63 GLU HGx 1.0 1.8 5.0 1253 1052 A 64 PHE H A 63 GLU HGy 1.0 1.8 5.0 1254 1053 A 64 PHE H A 60 MET HA 1.0 1.8 5.0 1255 1054 A 64 PHE H A 61 MET HA 1.0 1.8 5.0 1256 1055 A 64 PHE H A 62 LYS H 1.0 1.8 5.0 1257 1056 A 64 PHE H A 63 GLU HA 1.0 1.8 5.0 1258 1057 A 63 GLU HBy A 64 PHE H 1.0 1.8 5.0 1259 1058 A 64 PHE H A 63 GLU HGx 1.0 1.8 6.0 1260 1058 A 64 PHE H A 63 GLU HGy 1.0 1.8 6.0 1261 1059 A 64 PHE H A 63 GLU H 1.0 1.8 5.0 1262 1060 A 64 PHE H A 65 GLN H 1.0 1.8 5.0 1263 1061 A 64 PHE HA A 67 VAL HB 1.0 1.8 5.0 1264 1062 A 67 VAL HGx% A 64 PHE HA 1.0 1.8 6.0 1265 1063 A 67 VAL HGy% A 64 PHE HA 1.0 1.8 6.0 1266 1064 A 64 PHE HBy A 65 GLN H 1.0 1.8 5.0 1267 1065 A 62 LYS HA A 65 GLN H 1.0 1.8 5.0 1268 1066 A 65 GLN H A 62 LYS HBy 1.0 1.8 6.0 1269 1066 A 62 LYS HBx A 65 GLN H 1.0 1.8 6.0 1270 1067 A 64 PHE HA A 65 GLN H 1.0 1.8 5.0 1271 1068 A 64 PHE HBx A 65 GLN H 1.0 1.8 5.0 1272 1069 A 64 PHE HBy A 65 GLN H 1.0 1.8 5.0 1273 1070 A 64 PHE HD% A 65 GLN H 1.0 1.8 7.4 1274 1071 A 64 PHE H A 65 GLN H 1.0 1.8 5.0 1275 1072 A 66 GLN H A 65 GLN H 1.0 1.8 5.0 1276 1073 A 68 LEU HBy A 65 GLN HA 1.0 1.8 5.0 1277 1074 A 65 GLN HA A 68 LEU HBx 1.0 1.8 5.0 1278 1075 A 65 GLN HA A 68 LEU HG 1.0 1.8 5.0 1279 1076 A 68 LEU HDx% A 65 GLN HA 1.0 1.8 6.0 1280 1077 A 64 PHE HD% A 65 GLN HA 1.0 1.8 7.4 1281 1078 A 66 GLN H A 65 GLN HA 1.0 1.8 5.0 1282 1079 A 68 LEU H A 65 GLN HA 1.0 1.8 5.0 1283 1080 A 66 GLN H A 65 GLN HBy 1.0 1.8 5.0 1284 1081 A 62 LYS HA A 65 GLN HBx 1.0 1.8 5.0 1285 1082 A 66 GLN H A 65 GLN HBx 1.0 1.8 5.0 1286 1083 A 62 LYS HA A 65 GLN HBy 1.0 1.8 5.0 1287 1084 A 64 PHE H A 66 GLN H 1.0 1.8 5.0 1288 1085 A 66 GLN H A 65 GLN HA 1.0 1.8 5.0 1289 1086 A 66 GLN H A 65 GLN H 1.0 1.8 5.0 1290 1087 A 66 GLN H A 67 VAL HB 1.0 1.8 5.0 1291 1088 A 67 VAL H A 66 GLN H 1.0 1.8 5.0 1292 1089 A 69 ASP HBx A 66 GLN HA 1.0 1.8 5.0 1293 1090 A 66 GLN HA A 69 ASP HBy 1.0 1.8 5.0 1294 1091 A 67 VAL H A 66 GLN HBx 1.0 1.8 5.0 1295 1092 A 67 VAL H A 66 GLN HBy 1.0 1.8 5.0 1296 1093 A 67 VAL H A 66 GLN HGx 1.0 1.8 5.0 1297 1094 A 67 VAL H A 66 GLN HGy 1.0 1.8 5.0 1298 1095 A 64 PHE HA A 67 VAL H 1.0 1.8 5.0 1299 1096 A 67 VAL H A 65 GLN H 1.0 1.8 5.0 1300 1097 A 67 VAL H A 66 GLN HBy 1.0 1.8 5.0 1301 1098 A 67 VAL H A 66 GLN H 1.0 1.8 5.0 1302 1099 A 70 GLU HBy A 67 VAL HA 1.0 1.8 5.0 1303 1100 A 67 VAL HA A 66 GLN HBy 1.0 1.8 5.0 1304 1101 A 68 LEU H A 67 VAL HA 1.0 1.8 5.0 1305 1102 A 67 VAL HA A 69 ASP H 1.0 1.8 5.0 1306 1103 A 67 VAL HA A 70 GLU HA 1.0 1.8 5.0 1307 1104 A 70 GLU HBx A 67 VAL HA 1.0 1.8 5.0 1308 1105 A 67 VAL HA A 70 GLU HGx 1.0 1.8 5.0 1309 1106 A 64 PHE HA A 67 VAL HB 1.0 1.8 5.0 1310 1107 A 64 PHE HD% A 67 VAL HB 1.0 1.8 7.4 1311 1108 A 64 PHE HD% A 67 VAL HGy% 1.0 1.8 8.4 1312 1109 A 67 VAL HGy% A 70 GLU H 1.0 1.8 6.0 1313 1110 A 67 VAL HGy% A 71 ILE HG1x 1.0 1.8 6.0 1314 1111 A 67 VAL HGy% A 64 PHE HA 1.0 1.8 6.0 1315 1112 A 67 VAL HGy% A 68 LEU HA 1.0 1.8 6.0 1316 1113 A 67 VAL HGx% A 64 PHE HA 1.0 1.8 6.0 1317 1114 A 64 PHE HD% A 67 VAL HGx% 1.0 1.8 8.4 1318 1115 A 67 VAL HGx% A 70 GLU HBy 1.0 1.8 6.0 1319 1116 A 68 LEU H A 66 GLN H 1.0 1.8 5.0 1320 1117 A 67 VAL H A 68 LEU H 1.0 1.8 5.0 1321 1118 A 71 ILE HB A 68 LEU HA 1.0 1.8 5.0 1322 1119 A 68 LEU HA A 70 GLU H 1.0 1.8 5.0 1323 1120 A 68 LEU HBy A 65 GLN HA 1.0 1.8 5.0 1324 1121 A 65 GLN HA A 68 LEU HBx 1.0 1.8 5.0 1325 1122 A 68 LEU HBx A 69 ASP H 1.0 1.8 5.0 1326 1123 A 68 LEU HDx% A 65 GLN HA 1.0 1.8 6.0 1327 1124 A 68 LEU HDx% A 69 ASP H 1.0 1.8 6.0 1328 1125 A 64 PHE HD% A 68 LEU HDy% 1.0 1.8 8.4 1329 1126 A 68 LEU HDy% A 65 GLN HA 1.0 1.8 6.0 1330 1127 A 68 LEU HDy% A 69 ASP H 1.0 1.8 6.0 1331 1128 A 64 PHE HD% A 68 LEU HG 1.0 1.8 7.4 1332 1129 A 65 GLN HA A 68 LEU HG 1.0 1.8 5.0 1333 1130 A 66 GLN HA A 69 ASP H 1.0 1.8 5.0 1334 1131 A 67 VAL H A 69 ASP H 1.0 1.8 5.0 1335 1132 A 68 LEU HA A 69 ASP H 1.0 1.8 5.0 1336 1133 A 68 LEU HBy A 69 ASP H 1.0 1.8 5.0 1337 1134 A 68 LEU HG A 69 ASP H 1.0 1.8 5.0 1338 1135 A 68 LEU H A 69 ASP H 1.0 1.8 5.0 1339 1136 A 69 ASP HA A 72 LYS HBx 1.0 1.8 5.0 1340 1137 A 69 ASP HA A 72 LYS HBy 1.0 1.8 5.0 1341 1138 A 69 ASP HA A 72 LYS HGx 1.0 1.8 6.0 1342 1138 A 69 ASP HA A 72 LYS HGy 1.0 1.8 6.0 1343 1139 A 69 ASP HA A 73 GLN H 1.0 1.8 5.0 1344 1140 A 66 GLN HA A 69 ASP HBy 1.0 1.8 5.0 1345 1141 A 69 ASP HBx A 66 GLN HA 1.0 1.8 5.0 1346 1142 A 67 VAL HA A 70 GLU H 1.0 1.8 5.0 1347 1143 A 69 ASP H A 70 GLU H 1.0 1.8 2.9 1348 1144 A 70 GLU H A 69 ASP HA 1.0 1.8 5.0 1349 1145 A 69 ASP HBy A 70 GLU H 1.0 1.8 5.0 1350 1146 A 69 ASP HBx A 70 GLU H 1.0 1.8 5.0 1351 1147 A 70 GLU H A 71 ILE H 1.0 1.8 5.0 1352 1148 A 70 GLU HA A 71 ILE H 1.0 1.8 5.0 1353 1149 A 70 GLU HBy A 67 VAL HA 1.0 1.8 5.0 1354 1150 A 70 GLU HBy A 71 ILE H 1.0 1.8 5.0 1355 1151 A 70 GLU HBx A 67 VAL HA 1.0 1.8 5.0 1356 1152 A 67 VAL HA A 70 GLU HGy 1.0 1.8 5.0 1357 1153 A 67 VAL HA A 70 GLU HGx 1.0 1.8 5.0 1358 1154 A 68 LEU HA A 71 ILE H 1.0 1.8 5.0 1359 1155 A 69 ASP H A 71 ILE H 1.0 1.8 5.0 1360 1156 A 70 GLU HA A 71 ILE H 1.0 1.8 5.0 1361 1157 A 70 GLU HBy A 71 ILE H 1.0 1.8 5.0 1362 1158 A 71 ILE H A 70 GLU HGy 1.0 1.8 5.0 1363 1159 A 70 GLU H A 71 ILE H 1.0 1.8 5.0 1364 1160 A 71 ILE H A 72 LYS H 1.0 1.8 5.0 1365 1161 A 71 ILE HA A 74 GLN HBx 1.0 1.8 6.0 1366 1161 A 74 GLN HBy A 71 ILE HA 1.0 1.8 6.0 1367 1162 A 71 ILE HG2% A 75 LEU H 1.0 1.8 6.0 1368 1163 A 69 ASP HA A 72 LYS H 1.0 1.8 5.0 1369 1164 A 70 GLU H A 72 LYS H 1.0 1.8 5.0 1370 1165 A 70 GLU HA A 72 LYS H 1.0 1.8 5.0 1371 1166 A 72 LYS H A 71 ILE HA 1.0 1.8 5.0 1372 1167 A 71 ILE HG2% A 72 LYS H 1.0 1.8 6.0 1373 1168 A 71 ILE H A 72 LYS H 1.0 1.8 5.0 1374 1169 A 73 GLN H A 72 LYS H 1.0 1.8 5.0 1375 1170 A 72 LYS H A 74 GLN H 1.0 1.8 5.0 1376 1171 A 69 ASP HA A 72 LYS HBx 1.0 1.8 5.0 1377 1172 A 69 ASP HA A 72 LYS HBy 1.0 1.8 5.0 1378 1173 A 69 ASP HA A 73 GLN H 1.0 1.8 5.0 1379 1174 A 70 GLU HA A 73 GLN H 1.0 1.8 5.0 1380 1175 A 73 GLN H A 71 ILE HA 1.0 1.8 5.0 1381 1176 A 73 GLN H A 71 ILE H 1.0 1.8 5.0 1382 1177 A 73 GLN H A 72 LYS HA 1.0 1.8 5.0 1383 1178 A 72 LYS HBy A 73 GLN H 1.0 1.8 5.0 1384 1179 A 73 GLN H A 72 LYS HGx 1.0 1.8 6.0 1385 1179 A 72 LYS HGy A 73 GLN H 1.0 1.8 6.0 1386 1180 A 73 GLN H A 72 LYS H 1.0 1.8 5.0 1387 1181 A 73 GLN H A 74 GLN H 1.0 1.8 5.0 1388 1182 A 70 GLU HA A 73 GLN HBx 1.0 1.8 6.0 1389 1182 A 70 GLU HA A 73 GLN HBy 1.0 1.8 6.0 1390 1183 A 70 GLU HA A 74 GLN H 1.0 1.8 5.0 1391 1184 A 71 ILE HA A 74 GLN H 1.0 1.8 5.0 1392 1185 A 71 ILE HB A 74 GLN H 1.0 1.8 5.0 1393 1186 A 71 ILE HG2% A 74 GLN H 1.0 1.8 6.0 1394 1187 A 74 GLN H A 72 LYS HA 1.0 1.8 5.0 1395 1188 A 72 LYS H A 74 GLN H 1.0 1.8 5.0 1396 1189 A 74 GLN H A 73 GLN HBx 1.0 1.8 6.0 1397 1189 A 74 GLN H A 73 GLN HBy 1.0 1.8 6.0 1398 1190 A 74 GLN H A 73 GLN HGx 1.0 1.8 5.0 1399 1191 A 75 LEU H A 74 GLN H 1.0 1.8 5.0 1400 1192 A 75 LEU H A 72 LYS HA 1.0 1.8 5.0 1401 1193 A 73 GLN H A 75 LEU H 1.0 1.8 5.0 1402 1194 A 75 LEU H A 74 GLN HA 1.0 1.8 5.0 1403 1195 A 75 LEU H A 74 GLN H 1.0 1.8 5.0 1404 1196 A 75 LEU H A 76 GLN H 1.0 1.8 5.0 1405 1197 A 76 GLN H A 75 LEU HA 1.0 1.8 5.0 1406 1198 A 72 LYS HA A 75 LEU HBx 1.0 1.8 5.0 1407 1199 A 72 LYS HA A 75 LEU HBy 1.0 1.8 5.0 1408 1200 A 75 LEU HDx% A 72 LYS HA 1.0 1.8 6.0 1409 1201 A 75 LEU HDy% A 71 ILE HA 1.0 1.8 6.0 1410 1202 A 75 LEU HDy% A 72 LYS HA 1.0 1.8 6.0 1411 1203 A 72 LYS HA A 75 LEU HG 1.0 1.8 5.0 1412 1204 A 76 GLN H A 73 GLN HA 1.0 1.8 5.0 1413 1205 A 74 GLN HA A 76 GLN H 1.0 1.8 5.0 1414 1206 A 74 GLN H A 76 GLN H 1.0 1.8 5.0 1415 1207 A 76 GLN H A 75 LEU HA 1.0 1.8 5.0 1416 1208 A 76 GLN H A 75 LEU HBx 1.0 1.8 5.0 1417 1209 A 76 GLN H A 75 LEU HBy 1.0 1.8 5.0 1418 1210 A 75 LEU HDy% A 76 GLN H 1.0 1.8 6.0 1419 1211 A 75 LEU H A 76 GLN H 1.0 1.8 5.0 1420 1212 A 76 GLN H A 77 GLY H 1.0 1.8 5.0 1421 1213 A 73 GLN HA A 76 GLN HBx 1.0 1.8 6.0 1422 1213 A 73 GLN HA A 76 GLN HBy 1.0 1.8 6.0 1423 1214 A 75 LEU HA A 77 GLY H 1.0 1.8 5.0 1424 1215 A 77 GLY H A 76 GLN HA 1.0 1.8 5.0 1425 1216 A 77 GLY H A 76 GLN HBx 1.0 1.8 6.0 1426 1216 A 77 GLY H A 76 GLN HBy 1.0 1.8 6.0 1427 1217 A 77 GLY H A 76 GLN HGx 1.0 1.8 6.0 1428 1217 A 77 GLY H A 76 GLN HGy 1.0 1.8 6.0 1429 1218 A 76 GLN H A 77 GLY H 1.0 1.8 5.0 1430 1219 A 77 GLY H A 78 GLY H 1.0 1.8 5.0 1431 1220 A 77 GLY H A 79 ASP H 1.0 1.8 5.0 1432 1221 A 78 GLY H A 77 GLY HAx 1.0 1.8 5.0 1433 1222 A 78 GLY H A 77 GLY HAy 1.0 1.8 5.0 1434 1223 A 78 GLY H A 77 GLY HAx 1.0 1.8 5.0 1435 1224 A 78 GLY H A 77 GLY HAy 1.0 1.8 5.0 1436 1225 A 77 GLY H A 78 GLY H 1.0 1.8 5.0 1437 1226 A 78 GLY H A 79 ASP H 1.0 1.8 5.0 1438 1227 A 79 ASP H A 78 GLY HAy 1.0 1.8 5.0 1439 1228 A 75 LEU HA A 79 ASP H 1.0 1.8 5.0 1440 1229 A 79 ASP H A 78 GLY HAx 1.0 1.8 5.0 1441 1230 A 79 ASP H A 78 GLY HAy 1.0 1.8 5.0 1442 1231 A 79 ASP HBy A 80 ASN H 1.0 1.8 5.0 1443 1232 A 80 ASN H A 79 ASP HBx 1.0 1.8 5.0 1444 1233 A 79 ASP HBy A 80 ASN H 1.0 1.8 5.0 1445 1234 A 82 LEU H A 80 ASN H 1.0 1.8 5.0 1446 1235 A 79 ASP HA A 80 ASN H 1.0 1.8 5.0 1447 1236 A 80 ASN HA A 83 HIS HBx 1.0 1.8 6.0 1448 1236 A 80 ASN HA A 83 HIS HBy 1.0 1.8 6.0 1449 1237 A 80 ASN HA A 83 HIS H 1.0 1.8 5.0 1450 1238 A 80 ASN HBy A 83 HIS HBx 1.0 1.8 7.0 1451 1238 A 80 ASN HBx A 83 HIS HBx 1.0 1.8 7.0 1452 1238 A 83 HIS HBy A 80 ASN HBx 1.0 1.8 7.0 1453 1238 A 83 HIS HBy A 80 ASN HBy 1.0 1.8 7.0 1454 1239 A 79 ASP HA A 81 SER H 1.0 1.8 5.0 1455 1240 A 80 ASN HA A 81 SER H 1.0 1.8 5.0 1456 1241 A 81 SER H A 80 ASN HBx 1.0 1.8 6.0 1457 1241 A 81 SER H A 80 ASN HBy 1.0 1.8 6.0 1458 1242 A 82 LEU H A 81 SER H 1.0 1.8 5.0 1459 1243 A 83 HIS H A 81 SER HA 1.0 1.8 5.0 1460 1244 A 81 SER HA A 84 ASN HBx 1.0 1.8 6.0 1461 1244 A 81 SER HA A 84 ASN HBy 1.0 1.8 6.0 1462 1245 A 81 SER HA A 84 ASN H 1.0 1.8 5.0 1463 1246 A 81 SER HA A 85 VAL H 1.0 1.8 5.0 1464 1247 A 80 ASN HA A 81 SER HBx 1.0 1.8 6.0 1465 1247 A 81 SER HBy A 80 ASN HA 1.0 1.8 6.0 1466 1248 A 82 LEU H A 81 SER HBx 1.0 1.8 6.0 1467 1248 A 81 SER HBy A 82 LEU H 1.0 1.8 6.0 1468 1249 A 79 ASP HA A 82 LEU H 1.0 1.8 5.0 1469 1250 A 80 ASN HA A 82 LEU H 1.0 1.8 5.0 1470 1251 A 81 SER H A 82 LEU HA 1.0 1.8 5.0 1471 1252 A 82 LEU HA A 85 VAL HB 1.0 1.8 5.0 1472 1253 A 85 VAL HGy% A 82 LEU HA 1.0 1.8 6.0 1473 1254 A 82 LEU HDy% A 81 SER HBx 1.0 1.8 7.0 1474 1254 A 81 SER HBy A 82 LEU HDy% 1.0 1.8 7.0 1475 1255 A 82 LEU HDy% A 85 VAL HB 1.0 1.8 6.0 1476 1256 A 82 LEU HDy% A 86 HIS HBy 1.0 1.8 6.0 1477 1257 A 80 ASN HA A 83 HIS H 1.0 1.8 5.0 1478 1258 A 83 HIS H A 80 ASN HBx 1.0 1.8 6.0 1479 1258 A 83 HIS H A 80 ASN HBy 1.0 1.8 6.0 1480 1259 A 83 HIS H A 81 SER HA 1.0 1.8 5.0 1481 1260 A 83 HIS H A 82 LEU HA 1.0 1.8 5.0 1482 1261 A 83 HIS H A 82 LEU HG 1.0 1.8 5.0 1483 1262 A 83 HIS H A 84 ASN H 1.0 1.8 5.0 1484 1263 A 83 HIS H A 85 VAL H 1.0 1.8 5.0 1485 1264 A 80 ASN HA A 83 HIS HA 1.0 1.8 5.0 1486 1265 A 83 HIS HA A 84 ASN HA 1.0 1.8 5.0 1487 1266 A 86 HIS H A 83 HIS HA 1.0 1.8 5.0 1488 1267 A 84 ASN H A 83 HIS HBx 1.0 1.8 6.0 1489 1267 A 84 ASN H A 83 HIS HBy 1.0 1.8 6.0 1490 1268 A 81 SER HA A 84 ASN H 1.0 1.8 5.0 1491 1269 A 82 LEU H A 84 ASN H 1.0 1.8 5.0 1492 1270 A 83 HIS HA A 84 ASN H 1.0 1.8 5.0 1493 1271 A 84 ASN H A 83 HIS HBx 1.0 1.8 6.0 1494 1271 A 84 ASN H A 83 HIS HBy 1.0 1.8 6.0 1495 1272 A 83 HIS H A 84 ASN H 1.0 1.8 5.0 1496 1273 A 84 ASN H A 85 VAL H 1.0 1.8 5.0 1497 1274 A 86 HIS H A 84 ASN H 1.0 1.8 5.0 1498 1275 A 85 VAL H A 82 LEU HA 1.0 1.8 5.0 1499 1276 A 82 LEU HBx A 85 VAL H 1.0 1.8 5.0 1500 1277 A 85 VAL H A 84 ASN HA 1.0 1.8 5.0 1501 1278 A 85 VAL H A 84 ASN HBx 1.0 1.8 6.0 1502 1278 A 84 ASN HBy A 85 VAL H 1.0 1.8 6.0 1503 1279 A 84 ASN H A 85 VAL H 1.0 1.8 5.0 1504 1280 A 86 HIS H A 85 VAL H 1.0 1.8 5.0 1505 1281 A 85 VAL HA A 88 ASN HBy 1.0 1.8 5.0 1506 1282 A 85 VAL HA A 88 ASN HBx 1.0 1.8 5.0 1507 1283 A 85 VAL HA A 86 HIS H 1.0 1.8 5.0 1508 1284 A 85 VAL HA A 88 ASN H 1.0 1.8 5.0 1509 1285 A 82 LEU HBy A 85 VAL HB 1.0 1.8 5.0 1510 1286 A 82 LEU HA A 85 VAL HB 1.0 1.8 5.0 1511 1287 A 85 VAL HA A 85 VAL HB 1.0 1.8 5.0 1512 1288 A 86 HIS H A 85 VAL HB 1.0 1.8 5.0 1513 1289 A 85 VAL HGy% A 86 HIS H 1.0 1.8 6.0 1514 1290 A 85 VAL HGy% A 82 LEU HA 1.0 1.8 6.0 1515 1291 A 85 VAL HGx% A 82 LEU HA 1.0 1.8 6.0 1516 1292 A 85 VAL HGx% A 86 HIS H 1.0 1.8 6.0 1517 1293 A 86 HIS H A 82 LEU HA 1.0 1.8 5.0 1518 1294 A 86 HIS H A 83 HIS HA 1.0 1.8 5.0 1519 1295 A 86 HIS H A 83 HIS HBx 1.0 1.8 6.0 1520 1295 A 86 HIS H A 83 HIS HBy 1.0 1.8 6.0 1521 1296 A 86 HIS H A 84 ASN HA 1.0 1.8 5.0 1522 1297 A 85 VAL HA A 86 HIS H 1.0 1.8 5.0 1523 1298 A 86 HIS H A 85 VAL HB 1.0 1.8 5.0 1524 1299 A 85 VAL HGx% A 86 HIS H 1.0 1.8 6.0 1525 1300 A 85 VAL HGy% A 86 HIS H 1.0 1.8 6.0 1526 1301 A 86 HIS H A 85 VAL H 1.0 1.8 5.0 1527 1302 A 86 HIS H A 88 ASN H 1.0 1.8 5.0 1528 1303 A 86 HIS HA A 87 GLU H 1.0 1.8 5.0 1529 1304 A 86 HIS HA A 89 ILE HB 1.0 1.8 5.0 1530 1305 A 86 HIS HA A 89 ILE HD1% 1.0 1.8 6.0 1531 1306 A 86 HIS HA A 89 ILE H 1.0 1.8 5.0 1532 1307 A 86 HIS HBx A 75 LEU HDx% 1.0 1.8 6.0 1533 1308 A 82 LEU HDx% A 86 HIS HBx 1.0 1.8 6.0 1534 1309 A 86 HIS HBx A 83 HIS HA 1.0 1.8 5.0 1535 1310 A 86 HIS HBx A 87 GLU H 1.0 1.8 5.0 1536 1311 A 86 HIS HBy A 75 LEU HDx% 1.0 1.8 6.0 1537 1312 A 82 LEU HDx% A 86 HIS HBy 1.0 1.8 6.0 1538 1313 A 86 HIS HBy A 83 HIS HA 1.0 1.8 5.0 1539 1314 A 86 HIS HBy A 87 GLU H 1.0 1.8 5.0 1540 1315 A 86 HIS HA A 87 GLU H 1.0 1.8 5.0 1541 1316 A 86 HIS HBx A 87 GLU H 1.0 1.8 5.0 1542 1317 A 86 HIS HBy A 87 GLU H 1.0 1.8 5.0 1543 1318 A 86 HIS H A 87 GLU H 1.0 1.8 5.0 1544 1319 A 87 GLU H A 88 ASN H 1.0 1.8 5.0 1545 1320 A 87 GLU H A 85 VAL H 1.0 1.8 5.0 1546 1321 A 87 GLU HA A 90 LYS HBx 1.0 1.8 6.0 1547 1321 A 90 LYS HBy A 87 GLU HA 1.0 1.8 6.0 1548 1322 A 90 LYS H A 87 GLU HA 1.0 1.8 5.0 1549 1323 A 87 GLU HA A 91 GLU H 1.0 1.8 5.0 1550 1324 A 84 ASN HA A 87 GLU HGx 1.0 1.8 6.0 1551 1324 A 84 ASN HA A 87 GLU HGy 1.0 1.8 6.0 1552 1325 A 88 ASN H A 87 GLU HGx 1.0 1.8 6.0 1553 1325 A 88 ASN H A 87 GLU HGy 1.0 1.8 6.0 1554 1326 A 85 VAL HA A 88 ASN H 1.0 1.8 5.0 1555 1327 A 85 VAL HB A 88 ASN H 1.0 1.8 5.0 1556 1328 A 88 ASN H A 87 GLU HBx 1.0 1.8 6.0 1557 1328 A 88 ASN H A 87 GLU HBy 1.0 1.8 6.0 1558 1329 A 88 ASN H A 87 GLU HGx 1.0 1.8 6.0 1559 1329 A 88 ASN H A 87 GLU HGy 1.0 1.8 6.0 1560 1330 A 87 GLU H A 88 ASN H 1.0 1.8 5.0 1561 1331 A 88 ASN H A 89 ILE HG1x 1.0 1.8 6.0 1562 1331 A 89 ILE HG1y A 88 ASN H 1.0 1.8 6.0 1563 1332 A 89 ILE H A 88 ASN H 1.0 1.8 5.0 1564 1333 A 90 LYS H A 88 ASN H 1.0 1.8 5.0 1565 1334 A 89 ILE H A 88 ASN HA 1.0 1.8 5.0 1566 1335 A 88 ASN HA A 91 GLU HBx 1.0 1.8 6.0 1567 1335 A 91 GLU HBy A 88 ASN HA 1.0 1.8 6.0 1568 1336 A 88 ASN HA A 91 GLU HGx 1.0 1.8 6.0 1569 1336 A 88 ASN HA A 91 GLU HGy 1.0 1.8 6.0 1570 1337 A 91 GLU H A 88 ASN HA 1.0 1.8 5.0 1571 1338 A 85 VAL HA A 88 ASN HBy 1.0 1.8 5.0 1572 1339 A 85 VAL HGx% A 88 ASN HBy 1.0 1.8 6.0 1573 1340 A 85 VAL HGx% A 88 ASN HBx 1.0 1.8 6.0 1574 1341 A 85 VAL HA A 88 ASN HBx 1.0 1.8 5.0 1575 1342 A 89 ILE H A 88 ASN HA 1.0 1.8 5.0 1576 1343 A 88 ASN HBy A 89 ILE H 1.0 1.8 5.0 1577 1344 A 88 ASN HBx A 89 ILE H 1.0 1.8 5.0 1578 1345 A 89 ILE H A 88 ASN H 1.0 1.8 5.0 1579 1346 A 90 LYS H A 89 ILE H 1.0 1.8 5.0 1580 1347 A 89 ILE HA A 92 ILE HB 1.0 1.8 5.0 1581 1348 A 89 ILE HA A 92 ILE HG1x 1.0 1.8 6.0 1582 1348 A 92 ILE HG1y A 89 ILE HA 1.0 1.8 6.0 1583 1349 A 89 ILE HA A 92 ILE H 1.0 1.8 5.0 1584 1350 A 89 ILE HA A 93 PHE H 1.0 1.8 5.0 1585 1351 A 86 HIS HA A 89 ILE HB 1.0 1.8 5.0 1586 1352 A 86 HIS HA A 89 ILE HD1% 1.0 1.8 6.0 1587 1353 A 93 PHE HE% A 89 ILE HD1% 1.0 1.8 8.4 1588 1354 A 93 PHE HE% A 89 ILE HG2% 1.0 1.8 8.4 1589 1355 A 89 ILE HG1y A 92 ILE HG1x 1.0 1.8 7.0 1590 1355 A 89 ILE HG1x A 92 ILE HG1x 1.0 1.8 7.0 1591 1355 A 92 ILE HG1y A 89 ILE HG1x 1.0 1.8 7.0 1592 1355 A 92 ILE HG1y A 89 ILE HG1y 1.0 1.8 7.0 1593 1356 A 86 HIS HA A 90 LYS H 1.0 1.8 5.0 1594 1357 A 90 LYS H A 87 GLU HA 1.0 1.8 5.0 1595 1358 A 90 LYS H A 88 ASN HA 1.0 1.8 5.0 1596 1359 A 89 ILE HA A 90 LYS H 1.0 1.8 5.0 1597 1360 A 89 ILE HB A 90 LYS H 1.0 1.8 5.0 1598 1361 A 89 ILE HG2% A 90 LYS H 1.0 1.8 6.0 1599 1362 A 90 LYS H A 89 ILE H 1.0 1.8 5.0 1600 1363 A 90 LYS H A 91 GLU H 1.0 1.8 5.0 1601 1364 A 90 LYS H A 92 ILE H 1.0 1.8 5.0 1602 1365 A 90 LYS HA A 91 GLU H 1.0 1.8 5.0 1603 1366 A 90 LYS HA A 93 PHE HBy 1.0 1.8 5.0 1604 1367 A 90 LYS HA A 93 PHE HBx 1.0 1.8 5.0 1605 1368 A 90 LYS HA A 93 PHE H 1.0 1.8 5.0 1606 1369 A 87 GLU HA A 90 LYS HBx 1.0 1.8 6.0 1607 1369 A 90 LYS HBy A 87 GLU HA 1.0 1.8 6.0 1608 1370 A 91 GLU H A 88 ASN HA 1.0 1.8 5.0 1609 1371 A 89 ILE HA A 91 GLU H 1.0 1.8 5.0 1610 1372 A 90 LYS H A 91 GLU H 1.0 1.8 5.0 1611 1373 A 91 GLU H A 90 LYS HBx 1.0 1.8 6.0 1612 1373 A 90 LYS HBy A 91 GLU H 1.0 1.8 6.0 1613 1374 A 91 GLU H A 90 LYS HDx 1.0 1.8 6.0 1614 1374 A 91 GLU H A 90 LYS HDy 1.0 1.8 6.0 1615 1375 A 91 GLU H A 90 LYS HDx 1.0 1.8 6.0 1616 1375 A 91 GLU H A 90 LYS HDy 1.0 1.8 6.0 1617 1376 A 91 GLU H A 90 LYS HGy 1.0 1.8 5.0 1618 1377 A 91 GLU H A 90 LYS HGx 1.0 1.8 5.0 1619 1378 A 92 ILE HB A 91 GLU H 1.0 1.8 6.0 1620 1379 A 91 GLU H A 92 ILE H 1.0 1.8 5.0 1621 1380 A 92 ILE H A 91 GLU HA 1.0 1.8 5.0 1622 1381 A 91 GLU HA A 94 HIS HBx 1.0 1.8 4.3 1623 1381 A 94 HIS HBy A 91 GLU HA 1.0 1.8 4.3 1624 1382 A 94 HIS H A 91 GLU HA 1.0 1.8 5.0 1625 1383 A 92 ILE HB A 92 ILE H 1.0 1.8 5.0 1626 1384 A 90 LYS HA A 92 ILE H 1.0 1.8 5.0 1627 1385 A 92 ILE H A 91 GLU HA 1.0 1.8 5.0 1628 1386 A 92 ILE H A 91 GLU HBx 1.0 1.8 6.0 1629 1386 A 91 GLU HBy A 92 ILE H 1.0 1.8 6.0 1630 1387 A 91 GLU H A 92 ILE H 1.0 1.8 5.0 1631 1388 A 92 ILE H A 93 PHE H 1.0 1.8 5.0 1632 1389 A 92 ILE HA A 94 HIS H 1.0 1.8 5.0 1633 1390 A 92 ILE HA A 95 HIS H 1.0 1.8 5.0 1634 1391 A 92 ILE HA A 93 PHE H 1.0 1.8 5.0 1635 1392 A 92 ILE HA A 95 HIS HBx 1.0 1.8 6.0 1636 1392 A 92 ILE HA A 95 HIS HBy 1.0 1.8 6.0 1637 1393 A 92 ILE HA A 95 HIS HD2 1.0 1.8 5.0 1638 1394 A 92 ILE HA A 96 LEU H 1.0 1.8 5.0 1639 1395 A 89 ILE HA A 92 ILE HB 1.0 1.8 5.0 1640 1396 A 92 ILE HB A 93 PHE HA 1.0 1.8 5.0 1641 1397 A 92 ILE HB A 93 PHE H 1.0 1.8 5.0 1642 1398 A 92 ILE HG2% A 93 PHE HA 1.0 1.8 6.0 1643 1399 A 92 ILE HG2% A 93 PHE HE% 1.0 1.8 8.4 1644 1400 A 89 ILE HG2% A 93 PHE H 1.0 1.8 6.0 1645 1401 A 90 LYS HA A 93 PHE H 1.0 1.8 5.0 1646 1402 A 93 PHE H A 91 GLU HA 1.0 1.8 5.0 1647 1403 A 92 ILE HA A 93 PHE H 1.0 1.8 5.0 1648 1404 A 92 ILE HB A 93 PHE H 1.0 1.8 5.0 1649 1405 A 92 ILE HG2% A 93 PHE H 1.0 1.8 6.0 1650 1406 A 93 PHE H A 94 HIS HBx 1.0 1.8 6.0 1651 1406 A 94 HIS HBy A 93 PHE H 1.0 1.8 6.0 1652 1407 A 94 HIS H A 93 PHE H 1.0 1.8 5.0 1653 1408 A 94 HIS H A 93 PHE HA 1.0 1.8 5.0 1654 1409 A 96 LEU HBx A 93 PHE HA 1.0 1.8 5.0 1655 1410 A 96 LEU HBy A 93 PHE HA 1.0 1.8 5.0 1656 1411 A 96 LEU HDx% A 93 PHE HA 1.0 1.8 6.0 1657 1412 A 96 LEU H A 93 PHE HA 1.0 1.8 5.0 1658 1413 A 90 LYS HA A 93 PHE HBy 1.0 1.8 5.0 1659 1414 A 90 LYS HA A 93 PHE HBx 1.0 1.8 5.0 1660 1415 A 90 LYS HA A 94 HIS H 1.0 1.8 5.0 1661 1416 A 94 HIS H A 91 GLU HA 1.0 1.8 5.0 1662 1417 A 92 ILE HA A 94 HIS H 1.0 1.8 5.0 1663 1418 A 94 HIS H A 93 PHE HA 1.0 1.8 5.0 1664 1419 A 94 HIS H A 93 PHE HBy 1.0 1.8 5.0 1665 1420 A 94 HIS H A 93 PHE HBx 1.0 1.8 5.0 1666 1421 A 93 PHE HD% A 94 HIS H 1.0 1.8 7.4 1667 1422 A 94 HIS H A 93 PHE H 1.0 1.8 5.0 1668 1423 A 96 LEU H A 94 HIS H 1.0 1.8 5.0 1669 1424 A 93 PHE HD% A 94 HIS HA 1.0 1.8 7.4 1670 1425 A 94 HIS HA A 97 GLU HBx 1.0 1.8 5.0 1671 1426 A 94 HIS HA A 97 GLU HBy 1.0 1.8 5.0 1672 1427 A 91 GLU HA A 94 HIS HBx 1.0 1.8 6.0 1673 1427 A 94 HIS HBy A 91 GLU HA 1.0 1.8 6.0 1674 1428 A 92 ILE HD1% A 95 HIS H 1.0 1.8 6.0 1675 1429 A 95 HIS H A 91 GLU HA 1.0 1.8 5.0 1676 1430 A 92 ILE HA A 95 HIS H 1.0 1.8 5.0 1677 1431 A 95 HIS H A 93 PHE HA 1.0 1.8 5.0 1678 1432 A 95 HIS H A 94 HIS HA 1.0 1.8 5.0 1679 1433 A 95 HIS H A 94 HIS HBx 1.0 1.8 6.0 1680 1433 A 95 HIS H A 94 HIS HBy 1.0 1.8 6.0 1681 1434 A 96 LEU HBy A 95 HIS H 1.0 1.8 5.0 1682 1435 A 97 GLU H A 95 HIS HA 1.0 1.8 5.0 1683 1436 A 96 LEU H A 95 HIS HA 1.0 1.8 5.0 1684 1437 A 98 GLU H A 95 HIS HA 1.0 1.8 5.0 1685 1438 A 99 LEU H A 95 HIS HA 1.0 1.8 5.0 1686 1439 A 92 ILE HA A 95 HIS HBx 1.0 1.8 5.0 1687 1440 A 96 LEU H A 95 HIS HBx 1.0 1.8 5.0 1688 1441 A 92 ILE HA A 95 HIS HBy 1.0 1.8 5.0 1689 1442 A 96 LEU H A 95 HIS HBy 1.0 1.8 5.0 1690 1443 A 92 ILE HA A 96 LEU H 1.0 1.8 5.0 1691 1444 A 96 LEU H A 93 PHE HA 1.0 1.8 5.0 1692 1445 A 96 LEU H A 94 HIS HA 1.0 1.8 5.0 1693 1446 A 96 LEU H A 95 HIS HA 1.0 1.8 5.0 1694 1447 A 96 LEU H A 95 HIS HBx 1.0 1.8 5.0 1695 1448 A 96 LEU H A 95 HIS HBy 1.0 1.8 5.0 1696 1449 A 96 LEU H A 97 GLU H 1.0 1.8 5.0 1697 1450 A 96 LEU HA A 99 LEU HBy 1.0 1.8 5.0 1698 1451 A 96 LEU HA A 99 LEU HBx 1.0 1.8 5.0 1699 1452 A 99 LEU H A 96 LEU HA 1.0 1.8 5.0 1700 1453 A 96 LEU HBx A 97 GLU H 1.0 1.8 5.0 1701 1454 A 96 LEU HBy A 97 GLU H 1.0 1.8 5.0 1702 1455 A 96 LEU HDx% A 93 PHE HE% 1.0 1.8 8.4 1703 1456 A 96 LEU HDx% A 93 PHE HA 1.0 1.8 6.0 1704 1457 A 97 GLU H A 94 HIS HBx 1.0 1.8 6.0 1705 1457 A 97 GLU H A 94 HIS HBy 1.0 1.8 6.0 1706 1458 A 97 GLU H A 93 PHE HA 1.0 1.8 5.0 1707 1459 A 97 GLU H A 94 HIS HA 1.0 1.8 5.0 1708 1460 A 97 GLU H A 95 HIS HA 1.0 1.8 5.0 1709 1461 A 97 GLU H A 96 LEU HA 1.0 1.8 5.0 1710 1462 A 96 LEU HBx A 97 GLU H 1.0 1.8 5.0 1711 1463 A 96 LEU HBy A 97 GLU H 1.0 1.8 5.0 1712 1464 A 96 LEU HDx% A 97 GLU H 1.0 1.8 6.0 1713 1465 A 96 LEU HDy% A 97 GLU H 1.0 1.8 6.0 1714 1466 A 96 LEU HG A 97 GLU H 1.0 1.8 5.0 1715 1467 A 96 LEU H A 97 GLU H 1.0 1.8 5.0 1716 1468 A 96 LEU H A 97 GLU H 1.0 1.8 5.0 1717 1469 A 97 GLU H A 98 GLU H 1.0 1.8 5.0 1718 1470 A 97 GLU H A 99 LEU H 1.0 1.8 5.0 1719 1471 A 97 GLU H A 100 VAL HGy% 1.0 1.8 6.0 1720 1472 A 97 GLU HA A 100 VAL HGy% 1.0 1.8 6.0 1721 1473 A 97 GLU HA A 98 GLU H 1.0 1.8 5.0 1722 1474 A 97 GLU HA A 100 VAL HGx% 1.0 1.8 6.0 1723 1475 A 97 GLU HA A 100 VAL H 1.0 1.8 5.0 1724 1476 A 98 GLU H A 97 GLU HBx 1.0 1.8 5.0 1725 1477 A 98 GLU H A 97 GLU HBy 1.0 1.8 5.0 1726 1478 A 98 GLU H A 94 HIS HA 1.0 1.8 5.0 1727 1479 A 98 GLU H A 95 HIS HA 1.0 1.8 5.0 1728 1480 A 98 GLU H A 96 LEU HA 1.0 1.8 5.0 1729 1481 A 96 LEU HBy A 98 GLU H 1.0 1.8 5.0 1730 1482 A 97 GLU HA A 98 GLU H 1.0 1.8 5.0 1731 1483 A 98 GLU H A 97 GLU HBx 1.0 1.8 5.0 1732 1484 A 97 GLU H A 98 GLU H 1.0 1.8 5.0 1733 1485 A 99 LEU H A 98 GLU H 1.0 1.8 5.0 1734 1486 A 98 GLU H A 100 VAL H 1.0 1.8 5.0 1735 1487 A 99 LEU H A 98 GLU HA 1.0 1.8 5.0 1736 1488 A 98 GLU HA A 101 HIS H 1.0 1.8 5.0 1737 1489 A 95 HIS HA A 98 GLU HBx 1.0 1.8 5.0 1738 1490 A 99 LEU H A 98 GLU HBx 1.0 1.8 5.0 1739 1491 A 95 HIS HA A 98 GLU HBy 1.0 1.8 5.0 1740 1492 A 99 LEU H A 98 GLU HBy 1.0 1.8 5.0 1741 1493 A 99 LEU H A 98 GLU HGx 1.0 1.8 5.0 1742 1494 A 99 LEU H A 98 GLU HGy 1.0 1.8 5.0 1743 1495 A 99 LEU H A 96 LEU HA 1.0 1.8 5.0 1744 1496 A 97 GLU HA A 99 LEU H 1.0 1.8 5.0 1745 1497 A 97 GLU H A 99 LEU H 1.0 1.8 5.0 1746 1498 A 99 LEU H A 98 GLU HA 1.0 1.8 5.0 1747 1499 A 99 LEU H A 98 GLU HBx 1.0 1.8 5.0 1748 1500 A 99 LEU H A 98 GLU HBy 1.0 1.8 5.0 1749 1501 A 99 LEU H A 98 GLU HGx 1.0 1.8 5.0 1750 1502 A 99 LEU H A 98 GLU HGy 1.0 1.8 5.0 1751 1503 A 99 LEU H A 98 GLU H 1.0 1.8 5.0 1752 1504 A 96 LEU HDy% A 99 LEU HA 1.0 1.8 6.0 1753 1505 A 96 LEU HA A 99 LEU HBy 1.0 1.8 5.0 1754 1506 A 96 LEU HA A 99 LEU HBx 1.0 1.8 5.0 1755 1507 A 99 LEU HDx% A 96 LEU HA 1.0 1.8 6.0 1756 1508 A 99 LEU HDy% A 96 LEU HA 1.0 1.8 6.0 1757 1509 A 96 LEU HA A 100 VAL H 1.0 1.8 5.0 1758 1510 A 97 GLU HA A 100 VAL H 1.0 1.8 5.0 1759 1511 A 99 LEU HA A 100 VAL H 1.0 1.8 5.0 1760 1512 A 99 LEU HBy A 100 VAL H 1.0 1.8 5.0 1761 1513 A 99 LEU HBx A 100 VAL H 1.0 1.8 5.0 1762 1514 A 100 VAL H A 99 LEU HG 1.0 1.8 5.0 1763 1515 A 100 VAL H A 101 HIS H 1.0 1.8 5.0 1764 1516 A 101 HIS H A 100 VAL HA 1.0 1.8 5.0 1765 1517 A 100 VAL HA A 101 HIS HA 1.0 1.8 5.0 1766 1518 A 100 VAL HA A 102 ARG H 1.0 1.8 5.0 1767 1519 A 97 GLU HA A 100 VAL HB 1.0 1.8 5.0 1768 1520 A 97 GLU HA A 100 VAL HGy% 1.0 1.8 6.0 1769 1521 A 100 VAL HGy% A 101 HIS H 1.0 1.8 6.0 1770 1522 A 97 GLU HA A 100 VAL HGx% 1.0 1.8 6.0 1771 1523 A 100 VAL HGx% A 97 GLU HBy 1.0 1.8 6.0 1772 1524 A 100 VAL HGx% A 98 GLU HA 1.0 1.8 6.0 1773 1525 A 100 VAL HGx% A 96 LEU HA 1.0 1.8 6.0 1774 1526 A 99 LEU HA A 100 VAL HGx% 1.0 1.8 6.0 1775 1527 A 100 VAL HGx% A 101 HIS HA 1.0 1.8 6.0 1776 1528 A 100 VAL HGx% A 101 HIS H 1.0 1.8 6.0 1777 1529 A 98 GLU HA A 101 HIS H 1.0 1.8 5.0 1778 1530 A 99 LEU HA A 101 HIS H 1.0 1.8 5.0 1779 1531 A 99 LEU H A 101 HIS H 1.0 1.8 5.0 1780 1532 A 101 HIS H A 100 VAL HA 1.0 1.8 5.0 1781 1533 A 100 VAL HB A 101 HIS H 1.0 1.8 5.0 1782 1534 A 100 VAL HGx% A 101 HIS H 1.0 1.8 6.0 1783 1535 A 100 VAL HGy% A 101 HIS H 1.0 1.8 6.0 1784 1536 A 101 HIS HA A 102 ARG H 1.0 1.8 5.0 1785 1537 A 100 VAL HA A 101 HIS HA 1.0 1.8 5.0 1786 1538 A 101 HIS HA A 102 ARG H 1.0 1.8 5.0 1787 1539 A 100 VAL HA A 102 ARG H 1.0 1.8 5.0 1788 1540 A 100 VAL HGx% A 102 ARG H 1.0 1.8 6.0 1789 1541 A 100 VAL HGy% A 102 ARG H 1.0 1.8 6.0 1790 1542 A 102 ARG H A 101 HIS HBx 1.0 1.8 5.0 1791 1543 A 102 ARG H A 101 HIS HBy 1.0 1.8 5.0 1792 1544 A 101 HIS H A 102 ARG H 1.0 1.8 5.0 1793 1545 A 101 HIS HA A 102 ARG HA 1.0 1.8 5.0 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 4 LYS C A 5 LEU N A 5 LEU CA A 5 LEU C 1.0 -80.0 -30.0 PHI 2 2 A 5 LEU C A 6 ASN N A 6 ASN CA A 6 ASN C 1.0 -83.0 -33.0 PHI 3 3 A 6 ASN C A 7 ASP N A 7 ASP CA A 7 ASP C 1.0 -94.0 -44.0 PHI 4 4 A 7 ASP C A 8 LEU N A 8 LEU CA A 8 LEU C 1.0 -92.0 -42.0 PHI 5 5 A 8 LEU C A 9 LEU N A 9 LEU CA A 9 LEU C 1.0 -83.0 -33.0 PHI 6 6 A 9 LEU C A 10 GLU N A 10 GLU CA A 10 GLU C 1.0 -97.0 -47.0 PHI 7 7 A 10 GLU C A 11 ASP N A 11 ASP CA A 11 ASP C 1.0 -97.0 -47.0 PHI 8 8 A 11 ASP C A 12 LEU N A 12 LEU CA A 12 LEU C 1.0 -81.0 -31.0 PHI 9 9 A 12 LEU C A 13 GLN N A 13 GLN CA A 13 GLN C 1.0 -80.0 -30.0 PHI 10 10 A 13 GLN C A 14 GLU N A 14 GLU CA A 14 GLU C 1.0 -95.0 -45.0 PHI 11 11 A 14 GLU C A 15 VAL N A 15 VAL CA A 15 VAL C 1.0 -95.0 -45.0 PHI 12 12 A 15 VAL C A 16 LEU N A 16 LEU CA A 16 LEU C 1.0 -92.0 -42.0 PHI 13 13 A 16 LEU C A 17 LYS N A 17 LYS CA A 17 LYS C 1.0 -78.0 -28.0 PHI 14 14 A 17 LYS C A 18 HIS N A 18 HIS CA A 18 HIS C 1.0 -106.0 -56.0 PHI 15 15 A 19 VAL C A 20 ASN N A 20 ASN CA A 20 ASN C 1.0 -89.0 -39.0 PHI 16 16 A 20 ASN C A 21 GLN N A 21 GLN CA A 21 GLN C 1.0 -94.0 -44.0 PHI 17 17 A 26 GLY C A 27 GLN N A 27 GLN CA A 27 GLN C 1.0 -88.0 -38.0 PHI 18 18 A 27 GLN C A 28 LYS N A 28 LYS CA A 28 LYS C 1.0 -108.0 -58.0 PHI 19 19 A 28 LYS C A 29 ASN N A 29 ASN CA A 29 ASN C 1.0 -100.0 -50.0 PHI 20 20 A 30 MET C A 31 ASN N A 31 ASN CA A 31 ASN C 1.0 -104.0 -54.0 PHI 21 21 A 32 LYS C A 33 VAL N A 33 VAL CA A 33 VAL C 1.0 -103.0 -53.0 PHI 22 22 A 33 VAL C A 34 ASP N A 34 ASP CA A 34 ASP C 1.0 -87.0 -37.0 PHI 23 23 A 35 HIS C A 36 HIS N A 36 HIS CA A 36 HIS C 1.0 -75.0 -25.0 PHI 24 24 A 36 HIS C A 37 LEU N A 37 LEU CA A 37 LEU C 1.0 -78.0 -28.0 PHI 25 25 A 38 GLN C A 39 ASN N A 39 ASN CA A 39 ASN C 1.0 -83.0 -33.0 PHI 26 26 A 39 ASN C A 40 VAL N A 40 VAL CA A 40 VAL C 1.0 -88.0 -38.0 PHI 27 27 A 40 VAL C A 41 ILE N A 41 ILE CA A 41 ILE C 1.0 -80.0 -30.0 PHI 28 28 A 41 ILE C A 42 GLU N A 42 GLU CA A 42 GLU C 1.0 -93.0 -43.0 PHI 29 29 A 42 GLU C A 43 ASP N A 43 ASP CA A 43 ASP C 1.0 -85.0 -35.0 PHI 30 30 A 43 ASP C A 44 ILE N A 44 ILE CA A 44 ILE C 1.0 -94.0 -44.0 PHI 31 31 A 44 ILE C A 45 HIS N A 45 HIS CA A 45 HIS C 1.0 -102.0 -52.0 PHI 32 32 A 45 HIS C A 46 ASP N A 46 ASP CA A 46 ASP C 1.0 -85.0 -35.0 PHI 33 33 A 46 ASP C A 47 PHE N A 47 PHE CA A 47 PHE C 1.0 -102.0 -52.0 PHI 34 34 A 47 PHE C A 48 MET N A 48 MET CA A 48 MET C 1.0 -98.0 -48.0 PHI 35 35 A 55 GLY C A 56 LYS N A 56 LYS CA A 56 LYS C 1.0 -94.0 -44.0 PHI 36 36 A 56 LYS C A 57 LEU N A 57 LEU CA A 57 LEU C 1.0 -88.0 -38.0 PHI 37 37 A 57 LEU C A 58 GLN N A 58 GLN CA A 58 GLN C 1.0 -85.0 -35.0 PHI 38 38 A 58 GLN C A 59 GLU N A 59 GLU CA A 59 GLU C 1.0 -87.0 -37.0 PHI 39 39 A 59 GLU C A 60 MET N A 60 MET CA A 60 MET C 1.0 -90.0 -40.0 PHI 40 40 A 60 MET C A 61 MET N A 61 MET CA A 61 MET C 1.0 -89.0 -39.0 PHI 41 41 A 61 MET C A 62 LYS N A 62 LYS CA A 62 LYS C 1.0 -84.0 -34.0 PHI 42 42 A 62 LYS C A 63 GLU N A 63 GLU CA A 63 GLU C 1.0 -76.0 -26.0 PHI 43 43 A 63 GLU C A 64 PHE N A 64 PHE CA A 64 PHE C 1.0 -83.0 -33.0 PHI 44 44 A 64 PHE C A 65 GLN N A 65 GLN CA A 65 GLN C 1.0 -77.0 -27.0 PHI 45 45 A 65 GLN C A 66 GLN N A 66 GLN CA A 66 GLN C 1.0 -91.0 -41.0 PHI 46 46 A 66 GLN C A 67 VAL N A 67 VAL CA A 67 VAL C 1.0 -88.0 -38.0 PHI 47 47 A 67 VAL C A 68 LEU N A 68 LEU CA A 68 LEU C 1.0 -78.0 -28.0 PHI 48 48 A 68 LEU C A 69 ASP N A 69 ASP CA A 69 ASP C 1.0 -88.0 -38.0 PHI 49 49 A 69 ASP C A 70 GLU N A 70 GLU CA A 70 GLU C 1.0 -85.0 -35.0 PHI 50 50 A 70 GLU C A 71 ILE N A 71 ILE CA A 71 ILE C 1.0 -87.0 -37.0 PHI 51 51 A 72 LYS C A 73 GLN N A 73 GLN CA A 73 GLN C 1.0 -90.0 -40.0 PHI 52 52 A 73 GLN C A 74 GLN N A 74 GLN CA A 74 GLN C 1.0 -94.0 -44.0 PHI 53 53 A 74 GLN C A 75 LEU N A 75 LEU CA A 75 LEU C 1.0 -82.0 -32.0 PHI 54 54 A 75 LEU C A 76 GLN N A 76 GLN CA A 76 GLN C 1.0 -85.0 -35.0 PHI 55 55 A 82 LEU C A 83 HIS N A 83 HIS CA A 83 HIS C 1.0 -95.0 -45.0 PHI 56 56 A 83 HIS C A 84 ASN N A 84 ASN CA A 84 ASN C 1.0 -112.0 -62.0 PHI 57 57 A 84 ASN C A 85 VAL N A 85 VAL CA A 85 VAL C 1.0 -108.0 -58.0 PHI 58 58 A 85 VAL C A 86 HIS N A 86 HIS CA A 86 HIS C 1.0 -83.0 -33.0 PHI 59 59 A 86 HIS C A 87 GLU N A 87 GLU CA A 87 GLU C 1.0 -109.0 -59.0 PHI 60 60 A 87 GLU C A 88 ASN N A 88 ASN CA A 88 ASN C 1.0 -91.0 -41.0 PHI 61 61 A 88 ASN C A 89 ILE N A 89 ILE CA A 89 ILE C 1.0 -82.0 -32.0 PHI 62 62 A 89 ILE C A 90 LYS N A 90 LYS CA A 90 LYS C 1.0 -93.0 -43.0 PHI 63 63 A 90 LYS C A 91 GLU N A 91 GLU CA A 91 GLU C 1.0 -99.0 -49.0 PHI 64 64 A 91 GLU C A 92 ILE N A 92 ILE CA A 92 ILE C 1.0 -87.0 -37.0 PHI 65 65 A 93 PHE C A 94 HIS N A 94 HIS CA A 94 HIS C 1.0 -87.0 -37.0 PHI 66 66 A 94 HIS C A 95 HIS N A 95 HIS CA A 95 HIS C 1.0 -114.0 -64.0 PHI 67 67 A 95 HIS C A 96 LEU N A 96 LEU CA A 96 LEU C 1.0 -97.0 -47.0 PHI 68 68 A 96 LEU C A 97 GLU N A 97 GLU CA A 97 GLU C 1.0 -100.0 -50.0 PHI 69 69 A 97 GLU C A 98 GLU N A 98 GLU CA A 98 GLU C 1.0 -95.0 -45.0 PHI 70 70 A 98 GLU C A 99 LEU N A 99 LEU CA A 99 LEU C 1.0 -102.0 -52.0 PHI 71 71 A 1 MET C A 2 TYR N A 2 TYR CA A 2 TYR C 1.0 -138.0 -18.0 PHI 72 72 A 3 GLY C A 4 LYS N A 4 LYS CA A 4 LYS C 1.0 -138.0 -18.0 PHI 73 73 A 21 GLN C A 22 HIS N A 22 HIS CA A 22 HIS C 1.0 -153.0 -33.0 PHI 74 74 A 22 HIS C A 23 TRP N A 23 TRP CA A 23 TRP C 1.0 -128.0 -8.0 PHI 75 75 A 23 TRP C A 24 GLN N A 24 GLN CA A 24 GLN C 1.0 -151.0 -31.0 PHI 76 76 A 48 MET C A 49 GLN N A 49 GLN CA A 49 GLN C 1.0 -141.0 -21.0 PHI 77 77 A 52 GLY C A 53 SER N A 53 SER CA A 53 SER C 1.0 -120.0 0.0 PHI 78 78 A 78 GLY C A 79 ASP N A 79 ASP CA A 79 ASP C 1.0 -154.0 -34.0 PHI 79 79 A 79 ASP C A 80 ASN N A 80 ASN CA A 80 ASN C 1.0 -102.0 -52.0 PHI 80 80 A 80 ASN C A 81 SER N A 81 SER CA A 81 SER C 1.0 -89.0 -39.0 PHI 81 81 A 81 SER C A 82 LEU N A 82 LEU CA A 82 LEU C 1.0 -130.0 -10.0 PHI 82 82 A 99 LEU C A 100 VAL N A 100 VAL CA A 100 VAL C 1.0 -142.0 -22.0 PHI 83 83 A 100 VAL C A 101 HIS N A 101 HIS CA A 101 HIS C 1.0 -148.0 -28.0 PHI 84 84 A 101 HIS C A 102 ARG N A 102 ARG CA A 102 ARG C 1.0 -144.0 -24.0 PHI stop_ save_