data_nef_c15215_2jp1 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 11 CYS SG 1 48 CYS SG 2 11 CYS SG 2 48 CYS SG stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 VAL start . . 2 A 2 GLY middle . false 3 A 3 SER middle . . 4 A 4 GLU middle . . 5 A 5 VAL middle . . 6 A 6 SER middle . . 7 A 7 ASP middle . . 8 A 8 LYS middle . . 9 A 9 ARG middle . . 10 A 10 THR middle . . 11 A 11 CYS middle -HG . 12 A 12 VAL middle . . 13 A 13 SER middle . . 14 A 14 LEU middle . . 15 A 15 THR middle . . 16 A 16 THR middle . . 17 A 17 GLN middle . . 18 A 18 ARG middle . . 19 A 19 LEU middle . . 20 A 20 PRO middle . false 21 A 21 VAL middle . . 22 A 22 SER middle . . 23 A 23 ARG middle . . 24 A 24 ILE middle . . 25 A 25 LYS middle . . 26 A 26 THR middle . . 27 A 27 TYR middle . . 28 A 28 THR middle . . 29 A 29 ILE middle . . 30 A 30 THR middle . . 31 A 31 GLU middle . . 32 A 32 GLY middle . false 33 A 33 SER middle . . 34 A 34 LEU middle . . 35 A 35 ARG middle . . 36 A 36 ALA middle . . 37 A 37 VAL middle . . 38 A 38 ILE middle . . 39 A 39 PHE middle . . 40 A 40 ILE middle . . 41 A 41 THR middle . . 42 A 42 LYS middle . . 43 A 43 ARG middle . . 44 A 44 GLY middle . false 45 A 45 LEU middle . . 46 A 46 LYS middle . . 47 A 47 VAL middle . . 48 A 48 CYS middle -HG . 49 A 49 ALA middle . . 50 A 50 ASP middle . . 51 A 51 PRO middle . false 52 A 52 GLN middle . . 53 A 53 ALA middle . . 54 A 54 THR middle . . 55 A 55 TRP middle . . 56 A 56 VAL middle . . 57 A 57 ARG middle . . 58 A 58 ASP middle . . 59 A 59 VAL middle . . 60 A 60 VAL middle . . 61 A 61 ARG middle . . 62 A 62 SER middle . . 63 A 63 MET middle . . 64 A 64 ASP middle . . 65 A 65 ARG middle . . 66 A 66 LYS middle . . 67 A 67 SER middle . . 68 A 68 ASN middle . . 69 A 69 THR middle . . 70 A 70 ARG middle . . 71 A 71 ASN middle . . 72 A 72 ASN middle . . 73 A 73 MET middle . . 74 A 74 ILE middle . . 75 A 75 GLN middle . . 76 A 76 THR middle . . 77 A 77 LYS middle . . 78 A 78 PRO middle . false 79 A 79 THR middle . . 80 A 80 GLY middle . false 81 A 81 THR middle . . 82 A 82 GLN middle . . 83 A 83 GLN middle . . 84 A 84 SER middle . . 85 A 85 THR middle . . 86 A 86 ASN middle . . 87 A 87 THR middle . . 88 A 88 ALA middle . . 89 A 89 VAL middle . . 90 A 90 THR middle . . 91 A 91 LEU middle . . 92 A 92 THR middle . . 93 A 93 GLY end . false 94 B 1 VAL start . . 95 B 2 GLY middle . false 96 B 3 SER middle . . 97 B 4 GLU middle . . 98 B 5 VAL middle . . 99 B 6 SER middle . . 100 B 7 ASP middle . . 101 B 8 LYS middle . . 102 B 9 ARG middle . . 103 B 10 THR middle . . 104 B 11 CYS middle -HG . 105 B 12 VAL middle . . 106 B 13 SER middle . . 107 B 14 LEU middle . . 108 B 15 THR middle . . 109 B 16 THR middle . . 110 B 17 GLN middle . . 111 B 18 ARG middle . . 112 B 19 LEU middle . . 113 B 20 PRO middle . false 114 B 21 VAL middle . . 115 B 22 SER middle . . 116 B 23 ARG middle . . 117 B 24 ILE middle . . 118 B 25 LYS middle . . 119 B 26 THR middle . . 120 B 27 TYR middle . . 121 B 28 THR middle . . 122 B 29 ILE middle . . 123 B 30 THR middle . . 124 B 31 GLU middle . . 125 B 32 GLY middle . false 126 B 33 SER middle . . 127 B 34 LEU middle . . 128 B 35 ARG middle . . 129 B 36 ALA middle . . 130 B 37 VAL middle . . 131 B 38 ILE middle . . 132 B 39 PHE middle . . 133 B 40 ILE middle . . 134 B 41 THR middle . . 135 B 42 LYS middle . . 136 B 43 ARG middle . . 137 B 44 GLY middle . false 138 B 45 LEU middle . . 139 B 46 LYS middle . . 140 B 47 VAL middle . . 141 B 48 CYS middle -HG . 142 B 49 ALA middle . . 143 B 50 ASP middle . . 144 B 51 PRO middle . false 145 B 52 GLN middle . . 146 B 53 ALA middle . . 147 B 54 THR middle . . 148 B 55 TRP middle . . 149 B 56 VAL middle . . 150 B 57 ARG middle . . 151 B 58 ASP middle . . 152 B 59 VAL middle . . 153 B 60 VAL middle . . 154 B 61 ARG middle . . 155 B 62 SER middle . . 156 B 63 MET middle . . 157 B 64 ASP middle . . 158 B 65 ARG middle . . 159 B 66 LYS middle . . 160 B 67 SER middle . . 161 B 68 ASN middle . . 162 B 69 THR middle . . 163 B 70 ARG middle . . 164 B 71 ASN middle . . 165 B 72 ASN middle . . 166 B 73 MET middle . . 167 B 74 ILE middle . . 168 B 75 GLN middle . . 169 B 76 THR middle . . 170 B 77 LYS middle . . 171 B 78 PRO middle . false 172 B 79 THR middle . . 173 B 80 GLY middle . false 174 B 81 THR middle . . 175 B 82 GLN middle . . 176 B 83 GLN middle . . 177 B 84 SER middle . . 178 B 85 THR middle . . 179 B 86 ASN middle . . 180 B 87 THR middle . . 181 B 88 ALA middle . . 182 B 89 VAL middle . . 183 B 90 THR middle . . 184 B 91 LEU middle . . 185 B 92 THR middle . . 186 B 93 GLY end . false stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 VAL HA H 1 3.794 0.020 A 1 VAL HB H 1 2.180 0.020 A 1 VAL HGx% H 1 1.008 0.020 A 1 VAL CA C 13 62.000 0.1 A 1 VAL CB C 13 32.880 0.1 A 1 VAL CG1 C 13 19.871 0.1 A 2 GLY HA2 H 1 4.053 0.020 A 2 GLY HA3 H 1 4.053 0.020 A 2 GLY C C 13 173.916 0.1 A 2 GLY CA C 13 45.426 0.1 A 3 SER H H 1 8.302 0.020 A 3 SER C C 13 174.533 0.1 A 3 SER CA C 13 58.433 0.1 A 3 SER CB C 13 63.896 0.1 A 3 SER N N 15 116.043 0.1 A 4 GLU H H 1 8.490 0.020 A 4 GLU HA H 1 4.312 0.020 A 4 GLU HBy H 1 2.013 0.020 A 4 GLU HBx H 1 1.930 0.020 A 4 GLU HG2 H 1 2.234 0.020 A 4 GLU HG3 H 1 2.234 0.020 A 4 GLU C C 13 176.520 0.1 A 4 GLU CA C 13 57.075 0.1 A 4 GLU CB C 13 30.291 0.1 A 4 GLU CG C 13 36.367 0.1 A 4 GLU N N 15 122.854 0.1 A 5 VAL H H 1 8.093 0.020 A 5 VAL HA H 1 4.151 0.020 A 5 VAL HB H 1 2.036 0.020 A 5 VAL HGx% H 1 0.914 0.020 A 5 VAL C C 13 176.155 0.1 A 5 VAL CA C 13 62.489 0.1 A 5 VAL CB C 13 32.808 0.1 A 5 VAL CG1 C 13 21.165 0.1 A 5 VAL CG2 C 13 20.773 0.1 A 5 VAL N N 15 120.323 0.1 A 6 SER H H 1 8.226 0.020 A 6 SER HA H 1 4.443 0.020 A 6 SER HB2 H 1 3.847 0.020 A 6 SER HB3 H 1 3.847 0.020 A 6 SER C C 13 174.327 0.1 A 6 SER CA C 13 58.369 0.1 A 6 SER CB C 13 63.546 0.1 A 6 SER N N 15 118.840 0.1 A 7 ASP H H 1 8.243 0.020 A 7 ASP HA H 1 4.619 0.020 A 7 ASP HB2 H 1 2.621 0.020 A 7 ASP HB3 H 1 2.621 0.020 A 7 ASP C C 13 176.086 0.1 A 7 ASP CA C 13 54.486 0.1 A 7 ASP CB C 13 41.544 0.1 A 7 ASP N N 15 122.694 0.1 A 8 LYS H H 1 8.145 0.020 A 8 LYS HA H 1 4.361 0.020 A 8 LYS HBy H 1 1.856 0.020 A 8 LYS HBx H 1 1.761 0.020 A 8 LYS HD2 H 1 1.641 0.020 A 8 LYS HD3 H 1 1.641 0.020 A 8 LYS HE2 H 1 3.172 0.020 A 8 LYS HE3 H 1 3.172 0.020 A 8 LYS HG2 H 1 1.417 0.020 A 8 LYS HG3 H 1 1.417 0.020 A 8 LYS C C 13 176.429 0.1 A 8 LYS CA C 13 56.104 0.1 A 8 LYS CB C 13 30.543 0.1 A 8 LYS CD C 13 26.984 0.1 A 8 LYS CE C 13 43.485 0.1 A 8 LYS N N 15 120.696 0.1 A 9 ARG H H 1 8.262 0.020 A 9 ARG HA H 1 4.554 0.020 A 9 ARG HB2 H 1 1.860 0.020 A 9 ARG HB3 H 1 1.860 0.020 A 9 ARG HD2 H 1 3.145 0.020 A 9 ARG HD3 H 1 3.145 0.020 A 9 ARG HG2 H 1 1.632 0.020 A 9 ARG HG3 H 1 1.632 0.020 A 9 ARG C C 13 176.132 0.1 A 9 ARG CA C 13 56.499 0.1 A 9 ARG CB C 13 31.585 0.1 A 9 ARG CD C 13 43.881 0.1 A 9 ARG CG C 13 27.703 0.1 A 9 ARG N N 15 121.821 0.1 A 10 THR H H 1 8.367 0.020 A 10 THR HA H 1 4.586 0.020 A 10 THR HB H 1 4.228 0.020 A 10 THR HG2% H 1 1.209 0.020 A 10 THR C C 13 173.802 0.1 A 10 THR CA C 13 62.000 0.1 A 10 THR CB C 13 69.760 0.1 A 10 THR CG2 C 13 21.561 0.1 A 10 THR N N 15 117.841 0.1 A 11 CYS H H 1 8.360 0.020 A 11 CYS HA H 1 6.069 0.020 A 11 CYS HBy H 1 3.116 0.020 A 11 CYS HBx H 1 2.686 0.020 A 11 CYS C C 13 173.687 0.1 A 11 CYS CA C 13 55.428 0.1 A 11 CYS CB C 13 49.956 0.1 A 11 CYS N N 15 121.176 0.1 A 12 VAL H H 1 9.119 0.020 A 12 VAL HA H 1 4.637 0.020 A 12 VAL HB H 1 2.021 0.020 A 12 VAL HGx% H 1 0.828 0.020 A 12 VAL C C 13 173.893 0.1 A 12 VAL CA C 13 60.387 0.1 A 12 VAL CB C 13 35.468 0.1 A 12 VAL CG1 C 13 20.266 0.1 A 12 VAL N N 15 118.024 0.1 A 13 SER H H 1 8.512 0.020 A 13 SER HA H 1 5.275 0.020 A 13 SER HB2 H 1 3.697 0.020 A 13 SER HB3 H 1 3.697 0.020 A 13 SER C C 13 172.591 0.1 A 13 SER CA C 13 57.782 0.1 A 13 SER CB C 13 65.805 0.1 A 13 SER N N 15 118.270 0.1 A 14 LEU H H 1 8.896 0.020 A 14 LEU HA H 1 4.656 0.020 A 14 LEU HBy H 1 1.645 0.020 A 14 LEU HBx H 1 1.288 0.020 A 14 LEU HDx% H 1 0.801 0.020 A 14 LEU HDy% H 1 0.725 0.020 A 14 LEU HG H 1 1.447 0.020 A 14 LEU C C 13 175.766 0.1 A 14 LEU CA C 13 54.493 0.1 A 14 LEU CB C 13 45.103 0.1 A 14 LEU N N 15 125.549 0.1 A 15 THR H H 1 7.961 0.020 A 15 THR HA H 1 4.694 0.020 A 15 THR HB H 1 4.194 0.020 A 15 THR HG2% H 1 1.210 0.020 A 15 THR C C 13 174.167 0.1 A 15 THR CA C 13 62.225 0.1 A 15 THR N N 15 119.411 0.1 A 16 THR H H 1 8.085 0.020 A 16 THR HA H 1 4.636 0.020 A 16 THR HB H 1 4.365 0.020 A 16 THR HG2% H 1 1.033 0.020 A 16 THR C C 13 174.601 0.1 A 16 THR CA C 13 60.752 0.1 A 16 THR CB C 13 70.730 0.1 A 16 THR CG2 C 13 20.914 0.1 A 16 THR N N 15 116.177 0.1 A 17 GLN H H 1 8.126 0.020 A 17 GLN HA H 1 4.627 0.020 A 17 GLN HBy H 1 2.110 0.020 A 17 GLN HBx H 1 1.969 0.020 A 17 GLN HG2 H 1 2.340 0.020 A 17 GLN HG3 H 1 2.340 0.020 A 17 GLN C C 13 174.944 0.1 A 17 GLN CA C 13 56.167 0.1 A 17 GLN CB C 13 29.644 0.1 A 17 GLN CG C 13 33.850 0.1 A 17 GLN N N 15 119.442 0.1 A 18 ARG H H 1 8.126 0.020 A 18 ARG HA H 1 4.342 0.020 A 18 ARG HB2 H 1 1.761 0.020 A 18 ARG HB3 H 1 1.761 0.020 A 18 ARG HD2 H 1 3.151 0.020 A 18 ARG HD3 H 1 3.151 0.020 A 18 ARG HG2 H 1 1.036 0.020 A 18 ARG HG3 H 1 1.036 0.020 A 18 ARG C C 13 176.223 0.1 A 18 ARG CA C 13 56.751 0.1 A 18 ARG CB C 13 30.543 0.1 A 18 ARG CD C 13 43.485 0.1 A 18 ARG N N 15 119.839 0.1 A 19 LEU H H 1 8.534 0.020 A 19 LEU HA H 1 4.815 0.020 A 19 LEU HBy H 1 1.868 0.020 A 19 LEU HBx H 1 1.229 0.020 A 19 LEU HDx% H 1 0.920 0.020 A 19 LEU HDy% H 1 0.817 0.020 A 19 LEU HG H 1 1.742 0.020 A 19 LEU CA C 13 52.221 0.1 A 19 LEU CB C 13 43.485 0.1 A 19 LEU CD1 C 13 25.366 0.1 A 19 LEU CD2 C 13 23.424 0.1 A 19 LEU CG C 13 26.984 0.1 A 19 LEU N N 15 125.977 0.1 A 20 PRO HA H 1 4.658 0.020 A 20 PRO HDy H 1 3.750 0.020 A 20 PRO HDx H 1 3.511 0.020 A 20 PRO HGy H 1 2.062 0.020 A 20 PRO HGx H 1 1.948 0.020 A 20 PRO C C 13 175.629 0.1 A 20 PRO CA C 13 63.584 0.1 A 20 PRO CD C 13 50.604 0.1 A 20 PRO CG C 13 27.379 0.1 A 21 VAL H H 1 7.741 0.020 A 21 VAL HA H 1 4.303 0.020 A 21 VAL HB H 1 1.963 0.020 A 21 VAL HGx% H 1 0.782 0.020 A 21 VAL HGy% H 1 0.677 0.020 A 21 VAL CA C 13 60.957 0.1 A 21 VAL CB C 13 34.426 0.1 A 21 VAL CG1 C 13 21.812 0.1 A 21 VAL CG2 C 13 19.871 0.1 A 21 VAL N N 15 119.268 0.1 A 22 SER C C 13 174.099 0.1 A 22 SER CA C 13 59.068 0.1 A 23 ARG H H 1 7.716 0.020 A 23 ARG HA H 1 4.476 0.020 A 23 ARG HBy H 1 1.879 0.020 A 23 ARG HBx H 1 1.736 0.020 A 23 ARG HD2 H 1 3.172 0.020 A 23 ARG HD3 H 1 3.172 0.020 A 23 ARG HG2 H 1 1.546 0.020 A 23 ARG HG3 H 1 1.546 0.020 A 23 ARG C C 13 174.258 0.1 A 23 ARG CA C 13 54.882 0.1 A 23 ARG CB C 13 31.909 0.1 A 23 ARG CD C 13 43.557 0.1 A 23 ARG CG C 13 26.732 0.1 A 23 ARG N N 15 120.206 0.1 A 24 ILE H H 1 8.008 0.020 A 24 ILE HA H 1 4.297 0.020 A 24 ILE HB H 1 1.771 0.020 A 24 ILE HD1% H 1 0.852 0.020 A 24 ILE HG1y H 1 1.642 0.020 A 24 ILE HG1x H 1 1.073 0.020 A 24 ILE HG2% H 1 0.913 0.020 A 24 ILE C C 13 175.858 0.1 A 24 ILE CA C 13 62.252 0.1 A 24 ILE CB C 13 39.279 0.1 A 24 ILE CD1 C 13 14.047 0.1 A 24 ILE CG1 C 13 28.600 0.1 A 24 ILE CG2 C 13 17.590 0.1 A 24 ILE N N 15 120.553 0.1 A 25 LYS H H 1 8.373 0.020 A 25 LYS HA H 1 4.644 0.020 A 25 LYS HB2 H 1 1.691 0.020 A 25 LYS HB3 H 1 1.691 0.020 A 25 LYS HD2 H 1 1.639 0.020 A 25 LYS HD3 H 1 1.639 0.020 A 25 LYS HE2 H 1 2.906 0.020 A 25 LYS HE3 H 1 2.906 0.020 A 25 LYS HG2 H 1 0.846 0.020 A 25 LYS HG3 H 1 0.846 0.020 A 25 LYS C C 13 174.875 0.1 A 25 LYS CA C 13 54.882 0.1 A 25 LYS CB C 13 35.720 0.1 A 25 LYS CD C 13 28.997 0.1 A 25 LYS CE C 13 41.939 0.1 A 25 LYS CG C 13 24.791 0.1 A 25 LYS N N 15 127.119 0.1 A 26 THR H H 1 7.969 0.020 A 26 THR HA H 1 5.299 0.020 A 26 THR HB H 1 3.657 0.020 A 26 THR HG2% H 1 0.754 0.020 A 26 THR C C 13 173.550 0.1 A 26 THR CA C 13 60.382 0.1 A 26 THR CB C 13 71.610 0.1 A 26 THR CG2 C 13 22.090 0.1 A 26 THR N N 15 115.385 0.1 A 27 TYR H H 1 8.851 0.020 A 27 TYR HA H 1 4.797 0.020 A 27 TYR HBy H 1 2.833 0.020 A 27 TYR HBx H 1 2.556 0.020 A 27 TYR HD1 H 1 6.873 0.020 A 27 TYR HD2 H 1 6.873 0.020 A 27 TYR HE1 H 1 6.643 0.020 A 27 TYR HE2 H 1 6.643 0.020 A 27 TYR C C 13 174.350 0.1 A 27 TYR CA C 13 57.075 0.1 A 27 TYR CB C 13 41.939 0.1 A 27 TYR CD1 C 13 133.121 0.1 A 27 TYR CE1 C 13 118.303 0.1 A 27 TYR N N 15 123.550 0.1 A 28 THR H H 1 8.440 0.020 A 28 THR HA H 1 4.927 0.020 A 28 THR HB H 1 3.882 0.020 A 28 THR HG2% H 1 0.989 0.020 A 28 THR C C 13 173.550 0.1 A 28 THR CA C 13 61.621 0.1 A 28 THR CB C 13 70.658 0.1 A 28 THR CG2 C 13 21.561 0.1 A 28 THR N N 15 116.878 0.1 A 29 ILE H H 1 8.854 0.020 A 29 ILE HA H 1 4.245 0.020 A 29 ILE HB H 1 1.392 0.020 A 29 ILE HD1% H 1 0.347 0.020 A 29 ILE HG1y H 1 1.129 0.020 A 29 ILE HG1x H 1 0.650 0.020 A 29 ILE HG2% H 1 0.470 0.020 A 29 ILE C C 13 174.464 0.1 A 29 ILE CA C 13 60.310 0.1 A 29 ILE CB C 13 41.544 0.1 A 29 ILE CD1 C 13 14.090 0.1 A 29 ILE CG1 C 13 27.307 0.1 A 29 ILE CG2 C 13 17.606 0.1 A 29 ILE N N 15 125.787 0.1 A 30 THR H H 1 8.375 0.020 A 30 THR HA H 1 5.023 0.020 A 30 THR HB H 1 4.001 0.020 A 30 THR HG2% H 1 1.073 0.020 A 30 THR C C 13 173.916 0.1 A 30 THR CA C 13 60.444 0.1 A 30 THR CB C 13 70.982 0.1 A 30 THR CG2 C 13 21.884 0.1 A 30 THR N N 15 120.267 0.1 A 31 GLU H H 1 8.482 0.020 A 31 GLU HA H 1 4.545 0.020 A 31 GLU HB2 H 1 1.858 0.020 A 31 GLU HB3 H 1 1.858 0.020 A 31 GLU HGy H 1 2.154 0.020 A 31 GLU HGx H 1 2.015 0.020 A 31 GLU C C 13 175.584 0.1 A 31 GLU CA C 13 54.876 0.1 A 31 GLU CB C 13 31.262 0.1 A 31 GLU CG C 13 35.792 0.1 A 31 GLU N N 15 126.489 0.1 A 32 GLY H H 1 8.907 0.020 A 32 GLY HAy H 1 3.967 0.020 A 32 GLY HAx H 1 3.636 0.020 A 32 GLY C C 13 174.921 0.1 A 32 GLY CA C 13 47.690 0.1 A 32 GLY N N 15 116.180 0.1 A 33 SER H H 1 8.531 0.020 A 33 SER HA H 1 4.333 0.020 A 33 SER C C 13 173.482 0.1 A 33 SER CA C 13 59.340 0.1 A 33 SER CB C 13 62.228 0.1 A 33 SER N N 15 121.325 0.1 A 34 LEU H H 1 8.080 0.020 A 34 LEU HA H 1 4.472 0.020 A 34 LEU HBy H 1 2.067 0.020 A 34 LEU HBx H 1 1.443 0.020 A 34 LEU HDx% H 1 0.851 0.020 A 34 LEU HDy% H 1 0.825 0.020 A 34 LEU HG H 1 0.782 0.020 A 34 LEU C C 13 174.761 0.1 A 34 LEU CA C 13 54.882 0.1 A 34 LEU CB C 13 43.485 0.1 A 34 LEU CD1 C 13 24.467 0.1 A 34 LEU CD2 C 13 24.719 0.1 A 34 LEU CG C 13 26.408 0.1 A 34 LEU N N 15 124.562 0.1 A 35 ARG H H 1 8.217 0.020 A 35 ARG HA H 1 5.047 0.020 A 35 ARG HBy H 1 1.726 0.020 A 35 ARG HBx H 1 1.594 0.020 A 35 ARG HD2 H 1 3.042 0.020 A 35 ARG HD3 H 1 3.042 0.020 A 35 ARG HGy H 1 1.456 0.020 A 35 ARG HGx H 1 1.361 0.020 A 35 ARG C C 13 174.281 0.1 A 35 ARG CA C 13 54.985 0.1 A 35 ARG CB C 13 32.484 0.1 A 35 ARG CD C 13 43.485 0.1 A 35 ARG CG C 13 27.631 0.1 A 35 ARG N N 15 126.833 0.1 A 36 ALA H H 1 9.031 0.020 A 36 ALA HA H 1 5.238 0.020 A 36 ALA HB% H 1 1.045 0.020 A 36 ALA C C 13 174.875 0.1 A 36 ALA CA C 13 50.280 0.1 A 36 ALA CB C 13 21.489 0.1 A 36 ALA N N 15 126.943 0.1 A 37 VAL H H 1 8.770 0.020 A 37 VAL HA H 1 4.640 0.020 A 37 VAL HB H 1 1.554 0.020 A 37 VAL HGx% H 1 0.605 0.020 A 37 VAL HGy% H 1 0.305 0.020 A 37 VAL C C 13 173.482 0.1 A 37 VAL CA C 13 61.281 0.1 A 37 VAL CB C 13 34.749 0.1 A 37 VAL CG1 C 13 21.479 0.1 A 37 VAL CG2 C 13 21.813 0.1 A 37 VAL N N 15 120.696 0.1 A 38 ILE H H 1 8.933 0.020 A 38 ILE HA H 1 4.776 0.020 A 38 ILE HB H 1 1.736 0.020 A 38 ILE HD1% H 1 0.622 0.020 A 38 ILE HG1y H 1 1.396 0.020 A 38 ILE HG1x H 1 1.004 0.020 A 38 ILE HG2% H 1 0.742 0.020 A 38 ILE C C 13 174.236 0.1 A 38 ILE CA C 13 60.310 0.1 A 38 ILE CB C 13 40.249 0.1 A 38 ILE CD1 C 13 15.018 0.1 A 38 ILE CG1 C 13 29.572 0.1 A 38 ILE CG2 C 13 18.900 0.1 A 38 ILE N N 15 126.405 0.1 A 39 PHE H H 1 9.538 0.020 A 39 PHE HA H 1 5.248 0.020 A 39 PHE HBy H 1 3.003 0.020 A 39 PHE HBx H 1 2.778 0.020 A 39 PHE HD1 H 1 7.061 0.020 A 39 PHE HD2 H 1 7.061 0.020 A 39 PHE HE1 H 1 7.102 0.020 A 39 PHE HE2 H 1 7.102 0.020 A 39 PHE C C 13 175.401 0.1 A 39 PHE CA C 13 56.200 0.1 A 39 PHE CB C 13 41.544 0.1 A 39 PHE CD1 C 13 132.635 0.1 A 39 PHE CE1 C 13 132.118 0.1 A 39 PHE N N 15 124.549 0.1 A 40 ILE H H 1 9.235 0.020 A 40 ILE HA H 1 4.597 0.020 A 40 ILE HB H 1 1.960 0.020 A 40 ILE HD1% H 1 0.768 0.020 A 40 ILE HG1y H 1 1.576 0.020 A 40 ILE HG1x H 1 1.071 0.020 A 40 ILE HG2% H 1 0.871 0.020 A 40 ILE C C 13 174.967 0.1 A 40 ILE CA C 13 61.353 0.1 A 40 ILE CB C 13 38.632 0.1 A 40 ILE CD1 C 13 13.723 0.1 A 40 ILE CG1 C 13 28.220 0.1 A 40 ILE CG2 C 13 18.325 0.1 A 40 ILE N N 15 124.385 0.1 A 41 THR H H 1 8.422 0.020 A 41 THR HA H 1 4.885 0.020 A 41 THR HB H 1 4.588 0.020 A 41 THR HG2% H 1 1.153 0.020 A 41 THR C C 13 174.258 0.1 A 41 THR CA C 13 59.441 0.1 A 41 THR CG2 C 13 20.914 0.1 A 41 THR N N 15 116.557 0.1 A 42 LYS H H 1 8.565 0.020 A 42 LYS HA H 1 4.537 0.020 A 42 LYS HB2 H 1 1.711 0.020 A 42 LYS HB3 H 1 1.711 0.020 A 42 LYS HD2 H 1 1.506 0.020 A 42 LYS HD3 H 1 1.506 0.020 A 42 LYS C C 13 176.909 0.1 A 42 LYS CA C 13 58.952 0.1 A 42 LYS CB C 13 32.831 0.1 A 42 LYS CE C 13 42.281 0.1 A 42 LYS CG C 13 25.239 0.1 A 42 LYS N N 15 116.233 0.1 A 43 ARG H H 1 7.651 0.020 A 43 ARG HA H 1 4.527 0.020 A 43 ARG HBy H 1 2.036 0.020 A 43 ARG HBx H 1 1.515 0.020 A 43 ARG HD2 H 1 3.175 0.020 A 43 ARG HD3 H 1 3.175 0.020 A 43 ARG HGy H 1 1.614 0.020 A 43 ARG HGx H 1 1.512 0.020 A 43 ARG C C 13 175.698 0.1 A 43 ARG CA C 13 55.332 0.1 A 43 ARG CB C 13 31.514 0.1 A 43 ARG CD C 13 43.234 0.1 A 43 ARG CG C 13 27.703 0.1 A 43 ARG N N 15 113.920 0.1 A 44 GLY H H 1 7.375 0.020 A 44 GLY HAy H 1 4.875 0.020 A 44 GLY HAx H 1 3.814 0.020 A 44 GLY C C 13 172.202 0.1 A 44 GLY CA C 13 45.822 0.1 A 44 GLY N N 15 107.335 0.1 A 45 LEU H H 1 8.290 0.020 A 45 LEU HA H 1 5.401 0.020 A 45 LEU HB2 H 1 1.503 0.020 A 45 LEU HB3 H 1 1.503 0.020 A 45 LEU HDx% H 1 0.727 0.020 A 45 LEU HDy% H 1 0.703 0.020 A 45 LEU HG H 1 1.603 0.020 A 45 LEU C C 13 175.469 0.1 A 45 LEU CA C 13 54.163 0.1 A 45 LEU CB C 13 46.400 0.1 A 45 LEU CD1 C 13 26.000 0.1 A 45 LEU CD2 C 13 26.660 0.1 A 45 LEU CG C 13 27.954 0.1 A 45 LEU N N 15 120.529 0.1 A 46 LYS H H 1 9.100 0.020 A 46 LYS HA H 1 5.241 0.020 A 46 LYS HB2 H 1 1.782 0.020 A 46 LYS HB3 H 1 1.782 0.020 A 46 LYS HD2 H 1 1.440 0.020 A 46 LYS HD3 H 1 1.440 0.020 A 46 LYS HE2 H 1 2.632 0.020 A 46 LYS HE3 H 1 2.632 0.020 A 46 LYS HG2 H 1 1.385 0.020 A 46 LYS HG3 H 1 1.385 0.020 A 46 LYS C C 13 174.144 0.1 A 46 LYS CA C 13 55.529 0.1 A 46 LYS CB C 13 36.367 0.1 A 46 LYS CD C 13 29.896 0.1 A 46 LYS CE C 13 41.939 0.1 A 46 LYS CG C 13 25.438 0.1 A 46 LYS N N 15 125.408 0.1 A 47 VAL H H 1 9.103 0.020 A 47 VAL HA H 1 5.149 0.020 A 47 VAL HB H 1 1.903 0.020 A 47 VAL HGx% H 1 0.849 0.020 A 47 VAL HGy% H 1 0.764 0.020 A 47 VAL C C 13 174.921 0.1 A 47 VAL CA C 13 60.957 0.1 A 47 VAL CB C 13 34.426 0.1 A 47 VAL CG1 C 13 21.489 0.1 A 47 VAL CG2 C 13 20.914 0.1 A 47 VAL N N 15 125.281 0.1 A 48 CYS H H 1 9.298 0.020 A 48 CYS HA H 1 5.863 0.020 A 48 CYS HB2 H 1 2.952 0.020 A 48 CYS HB3 H 1 2.952 0.020 A 48 CYS C C 13 173.299 0.1 A 48 CYS CA C 13 55.100 0.1 A 48 CYS CB C 13 48.662 0.1 A 48 CYS N N 15 123.265 0.1 A 49 ALA H H 1 8.910 0.020 A 49 ALA HA H 1 4.960 0.020 A 49 ALA HB% H 1 1.323 0.020 A 49 ALA C C 13 175.538 0.1 A 49 ALA CA C 13 51.600 0.1 A 49 ALA CB C 13 22.136 0.1 A 49 ALA N N 15 124.332 0.1 A 50 ASP H H 1 8.447 0.020 A 50 ASP HA H 1 5.038 0.020 A 50 ASP HBy H 1 2.809 0.020 A 50 ASP HBx H 1 2.547 0.020 A 50 ASP CA C 13 52.500 0.1 A 50 ASP CB C 13 42.191 0.1 A 50 ASP N N 15 121.552 0.1 A 51 PRO HA H 1 4.502 0.020 A 51 PRO HDy H 1 3.828 0.020 A 51 PRO HDx H 1 3.735 0.020 A 51 PRO C C 13 176.749 0.1 A 51 PRO CA C 13 63.546 0.1 A 51 PRO CD C 13 50.927 0.1 A 52 GLN H H 1 8.357 0.020 A 52 GLN HA H 1 4.232 0.020 A 52 GLN HB2 H 1 1.923 0.020 A 52 GLN HB3 H 1 1.923 0.020 A 52 GLN HG2 H 1 2.268 0.020 A 52 GLN HG3 H 1 2.268 0.020 A 52 GLN C C 13 175.744 0.1 A 52 GLN CA C 13 55.852 0.1 A 52 GLN CB C 13 29.320 0.1 A 52 GLN CG C 13 34.174 0.1 A 52 GLN N N 15 119.268 0.1 A 53 ALA H H 1 8.097 0.020 A 53 ALA HA H 1 4.213 0.020 A 53 ALA HB% H 1 1.257 0.020 A 53 ALA C C 13 177.731 0.1 A 53 ALA CA C 13 52.868 0.1 A 53 ALA CB C 13 19.224 0.1 A 53 ALA N N 15 124.446 0.1 A 54 THR H H 1 7.987 0.020 A 54 THR HA H 1 4.621 0.020 A 54 THR HB H 1 4.235 0.020 A 54 THR HG2% H 1 1.271 0.020 A 54 THR C C 13 174.396 0.1 A 54 THR CA C 13 62.357 0.1 A 54 THR CB C 13 70.407 0.1 A 54 THR CG2 C 13 21.884 0.1 A 54 THR N N 15 112.417 0.1 A 55 TRP H H 1 7.944 0.020 A 55 TRP HA H 1 4.699 0.020 A 55 TRP HB2 H 1 3.218 0.020 A 55 TRP HB3 H 1 3.218 0.020 A 55 TRP HD1 H 1 7.197 0.020 A 55 TRP HE1 H 1 10.017 0.020 A 55 TRP HE3 H 1 7.516 0.020 A 55 TRP HH2 H 1 7.062 0.020 A 55 TRP HZ2 H 1 7.340 0.020 A 55 TRP HZ3 H 1 6.979 0.020 A 55 TRP CA C 13 57.470 0.1 A 55 TRP CB C 13 29.986 0.1 A 55 TRP CD1 C 13 127.556 0.1 A 55 TRP CE3 C 13 121.247 0.1 A 55 TRP CH2 C 13 124.644 0.1 A 55 TRP CZ2 C 13 114.744 0.1 A 55 TRP CZ3 C 13 122.056 0.1 A 55 TRP N N 15 122.979 0.1 A 56 VAL HA H 1 3.927 0.020 A 56 VAL HB H 1 1.913 0.020 A 56 VAL HGx% H 1 0.797 0.020 A 56 VAL CA C 13 62.647 0.1 A 56 VAL CB C 13 32.880 0.1 A 56 VAL CG1 C 13 21.237 0.1 A 57 ARG HD2 H 1 3.161 0.020 A 57 ARG HD3 H 1 3.161 0.020 A 57 ARG HG2 H 1 1.759 0.020 A 57 ARG HG3 H 1 1.759 0.020 A 57 ARG C C 13 176.263 0.1 A 57 ARG CA C 13 56.414 0.1 A 57 ARG CB C 13 32.302 0.1 A 57 ARG CD C 13 43.557 0.1 A 57 ARG CG C 13 30.938 0.1 A 58 ASP H H 1 8.135 0.020 A 58 ASP HA H 1 4.580 0.020 A 58 ASP HBy H 1 2.667 0.020 A 58 ASP HBx H 1 2.577 0.020 A 58 ASP C C 13 176.269 0.1 A 58 ASP CA C 13 54.558 0.1 A 58 ASP CB C 13 41.616 0.1 A 58 ASP N N 15 121.282 0.1 A 59 VAL H H 1 7.989 0.020 A 59 VAL HA H 1 4.004 0.020 A 59 VAL HB H 1 2.036 0.020 A 59 VAL HGx% H 1 0.900 0.020 A 59 VAL C C 13 176.292 0.1 A 59 VAL CA C 13 62.899 0.1 A 59 VAL CB C 13 33.131 0.1 A 59 VAL CG1 C 13 21.165 0.1 A 59 VAL N N 15 120.125 0.1 A 60 VAL H H 1 8.058 0.020 A 60 VAL HA H 1 4.054 0.020 A 60 VAL HB H 1 2.025 0.020 A 60 VAL HGx% H 1 0.865 0.020 A 60 VAL C C 13 176.383 0.1 A 60 VAL CA C 13 62.739 0.1 A 60 VAL CB C 13 33.131 0.1 A 60 VAL CG1 C 13 21.165 0.1 A 60 VAL N N 15 123.265 0.1 A 61 ARG H H 1 8.266 0.020 A 61 ARG C C 13 176.452 0.1 A 61 ARG CA C 13 56.278 0.1 A 61 ARG N N 15 124.264 0.1 A 62 SER H H 1 8.188 0.020 A 62 SER C C 13 174.807 0.1 A 62 SER CA C 13 58.832 0.1 A 62 SER N N 15 116.498 0.1 A 63 MET H H 1 8.292 0.020 A 63 MET HA H 1 4.463 0.020 A 63 MET HBy H 1 2.085 0.020 A 63 MET HBx H 1 2.001 0.020 A 63 MET HGy H 1 2.577 0.020 A 63 MET HGx H 1 2.502 0.020 A 63 MET C C 13 175.898 0.1 A 63 MET CA C 13 55.833 0.1 A 63 MET CB C 13 33.131 0.1 A 63 MET CG C 13 32.160 0.1 A 63 MET N N 15 121.730 0.1 A 64 ASP H H 1 8.175 0.020 A 64 ASP C C 13 175.953 0.1 A 64 ASP CA C 13 54.527 0.1 A 64 ASP CB C 13 41.724 0.1 A 64 ASP N N 15 121.226 0.1 A 65 ARG H H 1 8.143 0.020 A 65 ARG C C 13 175.744 0.1 A 65 ARG CA C 13 56.197 0.1 A 65 ARG CB C 13 30.970 0.1 A 65 ARG CD C 13 43.548 0.1 A 65 ARG N N 15 121.410 0.1 A 66 LYS H H 1 8.372 0.020 A 66 LYS C C 13 175.378 0.1 A 66 LYS CA C 13 53.472 0.1 A 66 LYS N N 15 120.050 0.1 A 67 SER H H 1 8.017 0.020 A 67 SER CA C 13 61.374 0.1 A 67 SER N N 15 113.877 0.1 A 68 ASN H H 1 7.833 0.020 A 68 ASN CA C 13 57.453 0.1 A 68 ASN N N 15 111.545 0.1 A 69 THR H H 1 7.808 0.020 A 69 THR C C 13 175.721 0.1 A 69 THR CA C 13 62.723 0.1 A 69 THR CB C 13 74.023 0.1 A 69 THR CG2 C 13 21.093 0.1 A 69 THR N N 15 112.504 0.1 A 70 ARG H H 1 8.050 0.020 A 70 ARG C C 13 176.000 0.1 A 70 ARG CA C 13 56.481 0.1 A 70 ARG CB C 13 30.632 0.1 A 70 ARG CD C 13 43.548 0.1 A 70 ARG N N 15 123.643 0.1 A 71 ASN H H 1 8.311 0.020 A 71 ASN C C 13 174.944 0.1 A 71 ASN CA C 13 53.494 0.1 A 71 ASN CB C 13 38.821 0.1 A 71 ASN N N 15 119.298 0.1 A 72 ASN H H 1 8.304 0.020 A 72 ASN C C 13 175.081 0.1 A 72 ASN CA C 13 53.577 0.1 A 72 ASN CB C 13 38.905 0.1 A 72 ASN N N 15 118.905 0.1 A 73 MET H H 1 8.139 0.020 A 73 MET C C 13 176.000 0.1 A 73 MET CA C 13 55.886 0.1 A 73 MET N N 15 120.037 0.1 A 74 ILE H H 1 7.967 0.020 A 74 ILE HA H 1 4.146 0.020 A 74 ILE HB H 1 1.842 0.020 A 74 ILE HD1% H 1 0.828 0.020 A 74 ILE HG1y H 1 1.438 0.020 A 74 ILE HG1x H 1 1.154 0.020 A 74 ILE C C 13 176.000 0.1 A 74 ILE CA C 13 61.312 0.1 A 74 ILE CB C 13 38.955 0.1 A 74 ILE CD1 C 13 12.753 0.1 A 74 ILE CG1 C 13 27.307 0.1 A 74 ILE CG2 C 13 17.547 0.1 A 74 ILE N N 15 121.468 0.1 A 75 GLN H H 1 8.362 0.020 A 75 GLN C C 13 175.935 0.1 A 75 GLN CA C 13 55.819 0.1 A 75 GLN CB C 13 33.925 0.1 A 75 GLN N N 15 124.361 0.1 A 76 THR H H 1 8.113 0.020 A 76 THR C C 13 174.144 0.1 A 76 THR CA C 13 61.935 0.1 A 76 THR CB C 13 69.971 0.1 A 76 THR CG2 C 13 21.431 0.1 A 76 THR N N 15 116.049 0.1 A 77 LYS H H 1 8.215 0.020 A 77 LYS N N 15 124.479 0.1 A 78 PRO HA H 1 4.490 0.020 A 78 PRO HBy H 1 2.279 0.020 A 78 PRO HBx H 1 1.930 0.020 A 78 PRO HDy H 1 3.819 0.020 A 78 PRO HDx H 1 3.642 0.020 A 78 PRO HG2 H 1 2.006 0.020 A 78 PRO HG3 H 1 2.006 0.020 A 78 PRO C C 13 177.137 0.1 A 78 PRO CA C 13 63.546 0.1 A 78 PRO CB C 13 32.484 0.1 A 78 PRO CD C 13 50.927 0.1 A 78 PRO CG C 13 27.307 0.1 A 79 THR H H 1 8.171 0.020 A 79 THR C C 13 175.218 0.1 A 79 THR CA C 13 61.896 0.1 A 79 THR CB C 13 70.007 0.1 A 79 THR CG2 C 13 21.346 0.1 A 79 THR N N 15 113.964 0.1 A 80 GLY H H 1 8.320 0.020 A 80 GLY C C 13 174.418 0.1 A 80 GLY CA C 13 45.559 0.1 A 80 GLY N N 15 110.746 0.1 A 81 THR H H 1 8.015 0.020 A 81 THR C C 13 174.738 0.1 A 81 THR CA C 13 62.044 0.1 A 81 THR CB C 13 69.971 0.1 A 81 THR CG2 C 13 21.431 0.1 A 81 THR N N 15 113.559 0.1 A 82 GLN H H 1 8.384 0.020 A 82 GLN C C 13 175.835 0.1 A 82 GLN CA C 13 56.155 0.1 A 82 GLN CB C 13 33.925 0.1 A 82 GLN N N 15 122.552 0.1 A 83 GLN H H 1 8.359 0.020 A 83 GLN C C 13 176.000 0.1 A 83 GLN CA C 13 56.039 0.1 A 83 GLN CB C 13 33.840 0.1 A 83 GLN N N 15 121.467 0.1 A 84 SER H H 1 8.333 0.020 A 84 SER C C 13 174.784 0.1 A 84 SER CA C 13 58.485 0.1 A 84 SER CB C 13 63.881 0.1 A 84 SER N N 15 116.931 0.1 A 85 THR H H 1 8.104 0.020 A 85 THR C C 13 174.327 0.1 A 85 THR CA C 13 61.954 0.1 A 85 THR CB C 13 69.802 0.1 A 85 THR CG2 C 13 21.431 0.1 A 85 THR N N 15 115.198 0.1 A 86 ASN H H 1 8.352 0.020 A 86 ASN C C 13 175.309 0.1 A 86 ASN CA C 13 53.463 0.1 A 86 ASN CB C 13 39.243 0.1 A 86 ASN N N 15 120.953 0.1 A 87 THR H H 1 8.010 0.020 A 87 THR C C 13 174.144 0.1 A 87 THR CA C 13 62.029 0.1 A 87 THR CB C 13 69.718 0.1 A 87 THR CG2 C 13 21.600 0.1 A 87 THR N N 15 114.479 0.1 A 88 ALA H H 1 8.162 0.020 A 88 ALA HA H 1 4.377 0.020 A 88 ALA HB% H 1 1.356 0.020 A 88 ALA C C 13 177.457 0.1 A 88 ALA CA C 13 52.650 0.1 A 88 ALA CB C 13 19.224 0.1 A 88 ALA N N 15 126.262 0.1 A 89 VAL H H 1 7.961 0.020 A 89 VAL HA H 1 4.158 0.020 A 89 VAL HB H 1 2.049 0.020 A 89 VAL HGx% H 1 0.905 0.020 A 89 VAL C C 13 176.109 0.1 A 89 VAL CA C 13 62.252 0.1 A 89 VAL CB C 13 33.131 0.1 A 89 VAL CG1 C 13 20.842 0.1 A 89 VAL N N 15 119.268 0.1 A 90 THR H H 1 8.136 0.020 A 90 THR HB H 1 4.145 0.020 A 90 THR HG2% H 1 1.150 0.020 A 90 THR C C 13 174.258 0.1 A 90 THR CA C 13 61.720 0.1 A 90 THR CB C 13 69.887 0.1 A 90 THR CG2 C 13 21.431 0.1 A 90 THR N N 15 118.357 0.1 A 91 LEU H H 1 8.314 0.020 A 91 LEU HB2 H 1 1.610 0.020 A 91 LEU HB3 H 1 1.610 0.020 A 91 LEU C C 13 177.206 0.1 A 91 LEU CA C 13 55.336 0.1 A 91 LEU CB C 13 42.620 0.1 A 91 LEU N N 15 125.341 0.1 A 92 THR H H 1 8.018 0.020 A 92 THR HA H 1 4.330 0.020 A 92 THR HG2% H 1 1.188 0.020 A 92 THR C C 13 174.053 0.1 A 92 THR CB C 13 69.959 0.1 A 92 THR CG2 C 13 21.489 0.1 A 92 THR N N 15 113.846 0.1 A 93 GLY H H 1 7.858 0.020 A 93 GLY HA2 H 1 3.755 0.020 A 93 GLY HA3 H 1 3.755 0.020 A 93 GLY N N 15 117.099 0.1 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-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 4 GLU HBy A 4 GLU HG2 1.0 . 2.94 2 1 A 4 GLU HBy A 4 GLU HG3 1.0 . 2.94 3 2 A 4 GLU HBx A 4 GLU HG2 1.0 . 2.94 4 2 A 4 GLU HG3 A 4 GLU HBx 1.0 . 2.94 5 3 A 5 VAL HA A 5 VAL HGx% 1.0 . 3.03 6 3 A 5 VAL HA A 5 VAL HG21 1.0 . 3.03 7 4 A 7 ASP H A 6 SER HB2 1.0 . 5.50 8 4 A 6 SER HB3 A 7 ASP H 1.0 . 5.50 9 5 A 8 LYS HA A 8 LYS HD2 1.0 . 5.41 10 5 A 8 LYS HA A 8 LYS HD3 1.0 . 5.41 11 6 A 8 LYS HA A 8 LYS HE2 1.0 . 5.50 12 6 A 8 LYS HA A 8 LYS HE3 1.0 . 5.50 13 7 A 8 LYS HA A 9 ARG HG2 1.0 . 3.73 14 7 A 8 LYS HA A 9 ARG HG3 1.0 . 3.73 15 8 A 8 LYS HD3 A 8 LYS HBy 1.0 . 3.05 16 8 A 8 LYS HBy A 8 LYS HD2 1.0 . 3.05 17 9 A 8 LYS HD3 A 8 LYS HBx 1.0 . 3.05 18 9 A 8 LYS HBx A 8 LYS HD2 1.0 . 3.05 19 10 A 8 LYS H A 8 LYS HG2 1.0 . 4.36 20 10 A 8 LYS H A 8 LYS HG3 1.0 . 4.36 21 11 A 8 LYS HBy A 8 LYS HD2 1.0 . 2.55 22 11 A 8 LYS HBx A 8 LYS HD2 1.0 . 2.55 23 11 A 8 LYS HD3 A 8 LYS HBx 1.0 . 2.55 24 11 A 8 LYS HD3 A 8 LYS HBy 1.0 . 2.55 25 12 A 8 LYS HBx A 8 LYS HE2 1.0 . 3.82 26 12 A 8 LYS HBy A 8 LYS HE2 1.0 . 3.82 27 12 A 8 LYS HE3 A 8 LYS HBx 1.0 . 3.82 28 12 A 8 LYS HE3 A 8 LYS HBy 1.0 . 3.82 29 13 A 9 ARG HA A 8 LYS HBx 1.0 . 5.34 30 13 A 8 LYS HBy A 9 ARG HA 1.0 . 5.34 31 14 A 8 LYS HD2 A 8 LYS HE2 1.0 . 2.70 32 14 A 8 LYS HD3 A 8 LYS HE2 1.0 . 2.70 33 14 A 8 LYS HE3 A 8 LYS HD2 1.0 . 2.70 34 14 A 8 LYS HD3 A 8 LYS HE3 1.0 . 2.70 35 15 A 8 LYS HE2 A 8 LYS HG2 1.0 . 4.10 36 15 A 8 LYS HE3 A 8 LYS HG2 1.0 . 4.10 37 15 A 8 LYS HG3 A 8 LYS HE2 1.0 . 4.10 38 15 A 8 LYS HE3 A 8 LYS HG3 1.0 . 4.10 39 16 A 9 ARG HA A 49 ALA H 1.0 . 5.20 40 17 A 9 ARG HA A 50 ASP HA 1.0 . 5.28 41 18 A 9 ARG HA A 50 ASP H 1.0 . 5.50 42 19 A 9 ARG HA A 9 ARG HD2 1.0 . 4.10 43 19 A 9 ARG HA A 9 ARG HD3 1.0 . 4.10 44 20 A 9 ARG HA A 9 ARG HG2 1.0 . 4.00 45 20 A 9 ARG HG3 A 9 ARG HA 1.0 . 4.00 46 21 A 10 THR H A 9 ARG HB2 1.0 . 4.42 47 21 A 9 ARG HB3 A 10 THR H 1.0 . 4.42 48 22 A 10 THR HG2% A 9 ARG HB2 1.0 . 5.09 49 22 A 9 ARG HB3 A 10 THR HG2% 1.0 . 5.09 50 23 A 48 CYS HA A 9 ARG HB2 1.0 . 5.50 51 23 A 9 ARG HB3 A 48 CYS HA 1.0 . 5.50 52 24 A 49 ALA H A 9 ARG HB2 1.0 . 5.28 53 24 A 49 ALA H A 9 ARG HB3 1.0 . 5.28 54 25 A 50 ASP HA A 9 ARG HB2 1.0 . 5.50 55 25 A 50 ASP HA A 9 ARG HB3 1.0 . 5.50 56 26 A 50 ASP H A 9 ARG HB2 1.0 . 4.77 57 26 A 50 ASP H A 9 ARG HB3 1.0 . 4.77 58 27 A 9 ARG HB2 A 9 ARG HD2 1.0 . 3.76 59 27 A 9 ARG HB3 A 9 ARG HD2 1.0 . 3.76 60 27 A 9 ARG HD3 A 9 ARG HB2 1.0 . 3.76 61 27 A 9 ARG HD3 A 9 ARG HB3 1.0 . 3.76 62 28 A 9 ARG HB3 A 9 ARG HG2 1.0 . 2.53 63 28 A 9 ARG HB2 A 9 ARG HG2 1.0 . 2.53 64 28 A 9 ARG HG3 A 9 ARG HB2 1.0 . 2.53 65 28 A 9 ARG HG3 A 9 ARG HB3 1.0 . 2.53 66 29 A 10 THR H A 9 ARG HG2 1.0 . 4.78 67 29 A 9 ARG HG3 A 10 THR H 1.0 . 4.78 68 30 A 49 ALA H A 9 ARG HG2 1.0 . 5.39 69 30 A 9 ARG HG3 A 49 ALA H 1.0 . 5.39 70 31 A 50 ASP HA A 9 ARG HG2 1.0 . 5.50 71 31 A 9 ARG HG3 A 50 ASP HA 1.0 . 5.50 72 32 A 10 THR HB A 11 CYS H 1.0 . 5.22 73 33 A 49 ALA H A 10 THR HB 1.0 . 5.17 74 34 A 10 THR H B 14 LEU HBx 1.0 . 4.46 75 34 A 10 THR H B 14 LEU HBy 1.0 . 4.46 76 35 A 10 THR H A 49 ALA HA 1.0 . 5.50 77 36 A 49 ALA H A 10 THR H 1.0 . 4.95 78 37 A 11 CYS CB A 48 CYS SG 1.0 . 3.10 79 38 A 11 CYS HA B 45 LEU HD11 1.0 . 4.44 80 38 A 11 CYS HA B 45 LEU HD21 1.0 . 4.44 81 39 A 11 CYS HA A 47 VAL H 1.0 . 5.50 82 40 A 11 CYS HA A 47 VAL HGx% 1.0 . 5.10 83 40 A 11 CYS HA A 47 VAL HGy% 1.0 . 5.10 84 41 A 48 CYS HA A 11 CYS HA 1.0 . 4.35 85 42 A 11 CYS HA A 48 CYS H 1.0 . 5.39 86 43 A 11 CYS HA A 48 CYS HB2 1.0 . 5.50 87 43 A 11 CYS HA A 48 CYS HB3 1.0 . 5.50 88 44 A 49 ALA H A 11 CYS HA 1.0 . 4.26 89 45 A 12 VAL H A 11 CYS HBy 1.0 . 4.61 90 46 A 46 LYS HG3 A 11 CYS HBy 1.0 . 5.06 91 46 A 11 CYS HBy A 46 LYS HG2 1.0 . 5.06 92 47 A 48 CYS HA A 11 CYS HBy 1.0 . 5.50 93 48 A 49 ALA H A 11 CYS HBy 1.0 . 5.50 94 49 A 12 VAL H A 11 CYS HBx 1.0 . 4.61 95 50 A 46 LYS HG3 A 11 CYS HBx 1.0 . 5.06 96 50 A 11 CYS HBx A 46 LYS HG2 1.0 . 5.06 97 51 A 48 CYS HA A 11 CYS HBx 1.0 . 5.50 98 52 A 49 ALA H A 11 CYS HBx 1.0 . 5.50 99 53 A 11 CYS H A 12 VAL H 1.0 . 5.41 100 54 A 11 CYS H A 47 VAL HGx% 1.0 . 5.44 101 54 A 11 CYS H A 47 VAL HGy% 1.0 . 5.44 102 55 A 49 ALA H A 11 CYS H 1.0 . 5.50 103 56 A 11 CYS H A 49 ALA HB% 1.0 . 5.50 104 57 A 12 VAL H A 11 CYS HBx 1.0 . 3.98 105 57 A 12 VAL H A 11 CYS HBy 1.0 . 3.98 106 58 A 49 ALA H A 11 CYS HBx 1.0 . 4.78 107 58 A 49 ALA H A 11 CYS HBy 1.0 . 4.78 108 59 A 11 CYS SG A 48 CYS CB 1.0 . 3.10 109 60 A 48 CYS SG A 11 CYS SG 1.0 . 2.10 110 61 A 12 VAL HA A 13 SER HB2 1.0 . 4.49 111 61 A 12 VAL HA A 13 SER HB3 1.0 . 4.49 112 62 A 12 VAL HA A 46 LYS HD2 1.0 . 4.89 113 62 A 12 VAL HA A 46 LYS HD3 1.0 . 4.89 114 63 A 12 VAL HB A 13 SER H 1.0 . 4.54 115 64 A 12 VAL H A 12 VAL HGx% 1.0 . 3.98 116 64 A 12 VAL H A 12 VAL HG21 1.0 . 3.98 117 65 A 12 VAL H A 13 SER H 1.0 . 5.16 118 66 A 12 VAL H A 46 LYS HA 1.0 . 5.25 119 67 A 12 VAL H A 46 LYS HD2 1.0 . 4.86 120 67 A 12 VAL H A 46 LYS HD3 1.0 . 4.86 121 68 A 12 VAL H A 46 LYS HE2 1.0 . 5.27 122 68 A 12 VAL H A 46 LYS HE3 1.0 . 5.27 123 69 A 12 VAL H A 46 LYS HG2 1.0 . 4.98 124 69 A 12 VAL H A 46 LYS HG3 1.0 . 4.98 125 70 A 12 VAL H A 47 VAL HB 1.0 . 5.08 126 71 A 48 CYS HA A 12 VAL H 1.0 . 4.49 127 72 A 49 ALA H A 12 VAL H 1.0 . 5.19 128 73 A 13 SER H A 12 VAL HGx% 1.0 . 4.25 129 73 A 13 SER H A 12 VAL HG21 1.0 . 4.25 130 74 A 12 VAL HGx% A 13 SER HB2 1.0 . 4.37 131 74 A 12 VAL HG21 A 13 SER HB2 1.0 . 4.37 132 74 A 13 SER HB3 A 12 VAL HGx% 1.0 . 4.37 133 74 A 13 SER HB3 A 12 VAL HG21 1.0 . 4.37 134 75 A 13 SER H A 14 LEU H 1.0 . 4.62 135 76 A 13 SER H A 46 LYS HA 1.0 . 4.96 136 77 A 13 SER H A 46 LYS HG2 1.0 . 5.50 137 77 A 46 LYS HG3 A 13 SER H 1.0 . 5.50 138 78 A 14 LEU H A 13 SER HB2 1.0 . 4.28 139 78 A 13 SER HB3 A 14 LEU H 1.0 . 4.28 140 79 A 15 THR HG2% A 13 SER HB2 1.0 . 4.99 141 79 A 13 SER HB3 A 15 THR HG2% 1.0 . 4.99 142 80 A 45 LEU H A 13 SER HB2 1.0 . 5.50 143 80 A 13 SER HB3 A 45 LEU H 1.0 . 5.50 144 81 A 13 SER HB2 A 46 LYS HB2 1.0 . 5.13 145 81 A 13 SER HB3 A 46 LYS HB2 1.0 . 5.13 146 81 A 46 LYS HB3 A 13 SER HB2 1.0 . 5.13 147 81 A 13 SER HB3 A 46 LYS HB3 1.0 . 5.13 148 82 A 13 SER HB2 A 46 LYS HD2 1.0 . 4.48 149 82 A 13 SER HB3 A 46 LYS HD2 1.0 . 4.48 150 82 A 46 LYS HD3 A 13 SER HB2 1.0 . 4.48 151 82 A 13 SER HB3 A 46 LYS HD3 1.0 . 4.48 152 83 A 13 SER HB3 A 46 LYS HE2 1.0 . 5.50 153 83 A 46 LYS HE3 A 13 SER HB2 1.0 . 5.50 154 83 A 13 SER HB3 A 46 LYS HE3 1.0 . 5.50 155 83 A 13 SER HB2 A 46 LYS HE2 1.0 . 5.50 156 84 A 47 VAL H A 13 SER HB2 1.0 . 5.26 157 84 A 47 VAL H A 13 SER HB3 1.0 . 5.26 158 85 A 14 LEU H A 14 LEU HG 1.0 . 4.49 159 86 A 14 LEU H A 14 LEU HDx% 1.0 . 4.60 160 86 A 14 LEU H A 14 LEU HDy% 1.0 . 4.60 161 87 A 14 LEU H A 45 LEU H 1.0 . 4.88 162 88 A 14 LEU H A 45 LEU HB2 1.0 . 5.50 163 88 A 14 LEU H A 45 LEU HB3 1.0 . 5.50 164 89 A 46 LYS HA A 14 LEU H 1.0 . 3.74 165 90 A 14 LEU H A 46 LYS H 1.0 . 4.97 166 91 B 10 THR H A 14 LEU HBy 1.0 . 4.46 167 91 A 14 LEU HBx B 10 THR H 1.0 . 4.46 168 92 A 45 LEU H A 14 LEU HBy 1.0 . 4.63 169 92 A 45 LEU H A 14 LEU HBx 1.0 . 4.63 170 93 A 16 THR H A 14 LEU HDx% 1.0 . 5.44 171 93 A 14 LEU HDy% A 16 THR H 1.0 . 5.44 172 94 A 46 LYS HA A 14 LEU HDx% 1.0 . 5.13 173 94 A 46 LYS HA A 14 LEU HDy% 1.0 . 5.13 174 95 A 16 THR H A 15 THR HB 1.0 . 4.91 175 96 A 15 THR HG2% A 16 THR H 1.0 . 4.94 176 97 A 16 THR HA A 16 THR HG2% 1.0 . 4.05 177 98 A 16 THR HB A 17 GLN H 1.0 . 4.23 178 99 A 16 THR H A 16 THR HG2% 1.0 . 4.89 179 100 A 16 THR H A 44 GLY HAy 1.0 . 5.50 180 101 A 16 THR H A 44 GLY HAx 1.0 . 5.50 181 102 A 16 THR H A 44 GLY HAx 1.0 . 4.81 182 102 A 16 THR H A 44 GLY HAy 1.0 . 4.81 183 103 A 45 LEU H A 16 THR H 1.0 . 4.48 184 104 A 16 THR HG2% A 17 GLN H 1.0 . 4.81 185 105 A 16 THR HG2% A 18 ARG HB2 1.0 . 5.50 186 105 A 16 THR HG2% A 18 ARG HB3 1.0 . 5.50 187 106 A 16 THR HG2% B 51 PRO HDx 1.0 . 4.81 188 106 A 16 THR HG2% B 51 PRO HDy 1.0 . 4.81 189 107 A 16 THR HG2% A 44 GLY HAx 1.0 . 4.83 190 107 A 16 THR HG2% A 44 GLY HAy 1.0 . 4.83 191 108 A 16 THR HG2% A 45 LEU HB2 1.0 . 4.82 192 108 A 45 LEU HB3 A 16 THR HG2% 1.0 . 4.82 193 109 A 17 GLN HG3 A 17 GLN HBy 1.0 . 2.82 194 109 A 17 GLN HBy A 17 GLN HG2 1.0 . 2.82 195 110 A 17 GLN HG3 A 17 GLN HBx 1.0 . 2.82 196 110 A 17 GLN HBx A 17 GLN HG2 1.0 . 2.82 197 111 A 17 GLN H A 17 GLN HG2 1.0 . 5.21 198 111 A 17 GLN H A 17 GLN HG3 1.0 . 5.21 199 112 A 17 GLN H A 18 ARG HB2 1.0 . 5.21 200 112 A 17 GLN H A 18 ARG HB3 1.0 . 5.21 201 113 A 17 GLN HBy A 17 GLN HG2 1.0 . 2.42 202 113 A 17 GLN HG3 A 17 GLN HBx 1.0 . 2.42 203 113 A 17 GLN HG3 A 17 GLN HBy 1.0 . 2.42 204 113 A 17 GLN HBx A 17 GLN HG2 1.0 . 2.42 205 114 A 18 ARG H A 17 GLN HBx 1.0 . 4.18 206 114 A 17 GLN HBy A 18 ARG H 1.0 . 4.18 207 115 A 18 ARG HA A 17 GLN HG2 1.0 . 4.20 208 115 A 17 GLN HG3 A 18 ARG HA 1.0 . 4.20 209 116 A 18 ARG H A 17 GLN HG2 1.0 . 4.69 210 116 A 17 GLN HG3 A 18 ARG H 1.0 . 4.69 211 117 A 17 GLN HG3 A 18 ARG HB2 1.0 . 5.49 212 117 A 18 ARG HB3 A 17 GLN HG2 1.0 . 5.49 213 117 A 18 ARG HB3 A 17 GLN HG3 1.0 . 5.49 214 117 A 17 GLN HG2 A 18 ARG HB2 1.0 . 5.49 215 118 A 18 ARG HA A 18 ARG HD2 1.0 . 3.80 216 118 A 18 ARG HA A 18 ARG HD3 1.0 . 3.80 217 119 A 18 ARG HA A 19 LEU HG 1.0 . 5.50 218 120 A 18 ARG HA A 19 LEU HBy 1.0 . 5.20 219 120 A 18 ARG HA A 19 LEU HBx 1.0 . 5.20 220 121 A 18 ARG HA A 19 LEU HDx% 1.0 . 5.40 221 121 A 18 ARG HA A 19 LEU HDy% 1.0 . 5.40 222 122 A 18 ARG H A 18 ARG HB2 1.0 . 3.55 223 122 A 18 ARG HB3 A 18 ARG H 1.0 . 3.55 224 123 A 18 ARG H A 18 ARG HD2 1.0 . 5.34 225 123 A 18 ARG H A 18 ARG HD3 1.0 . 5.34 226 124 A 18 ARG H A 18 ARG HG2 1.0 . 5.50 227 124 A 18 ARG H A 18 ARG HG3 1.0 . 5.50 228 125 A 18 ARG H A 19 LEU H 1.0 . 5.08 229 126 A 18 ARG HB3 A 18 ARG HD2 1.0 . 3.15 230 126 A 18 ARG HB2 A 18 ARG HD2 1.0 . 3.15 231 126 A 18 ARG HD3 A 18 ARG HB2 1.0 . 3.15 232 126 A 18 ARG HB3 A 18 ARG HD3 1.0 . 3.15 233 127 A 19 LEU HA A 18 ARG HB2 1.0 . 5.47 234 127 A 18 ARG HB3 A 19 LEU HA 1.0 . 5.47 235 128 A 19 LEU H A 18 ARG HB2 1.0 . 4.30 236 128 A 18 ARG HB3 A 19 LEU H 1.0 . 4.30 237 129 A 18 ARG HB3 A 19 LEU HDx% 1.0 . 4.47 238 129 A 18 ARG HB2 A 19 LEU HDx% 1.0 . 4.47 239 129 A 19 LEU HDy% A 18 ARG HB2 1.0 . 4.47 240 129 A 18 ARG HB3 A 19 LEU HDy% 1.0 . 4.47 241 130 A 18 ARG HB2 B 52 GLN HGx 1.0 . 5.02 242 130 A 18 ARG HB3 B 52 GLN HGx 1.0 . 5.02 243 130 B 52 GLN HGy A 18 ARG HB2 1.0 . 5.02 244 130 A 18 ARG HB3 B 52 GLN HGy 1.0 . 5.02 245 131 A 44 GLY H A 18 ARG HB2 1.0 . 5.00 246 131 A 18 ARG HB3 A 44 GLY H 1.0 . 5.00 247 132 A 19 LEU H A 18 ARG HD2 1.0 . 5.50 248 132 A 18 ARG HD3 A 19 LEU H 1.0 . 5.50 249 133 A 44 GLY H A 18 ARG HD2 1.0 . 5.50 250 133 A 18 ARG HD3 A 44 GLY H 1.0 . 5.50 251 134 A 44 GLY H A 18 ARG HG2 1.0 . 5.04 252 134 A 18 ARG HG3 A 44 GLY H 1.0 . 5.04 253 135 A 18 ARG HG3 A 44 GLY HAx 1.0 . 5.17 254 135 A 44 GLY HAy A 18 ARG HG2 1.0 . 5.17 255 135 A 44 GLY HAy A 18 ARG HG3 1.0 . 5.17 256 135 A 18 ARG HG2 A 44 GLY HAx 1.0 . 5.17 257 136 A 45 LEU H A 18 ARG HG2 1.0 . 4.55 258 136 A 45 LEU H A 18 ARG HG3 1.0 . 4.55 259 137 A 19 LEU HA A 19 LEU HDx% 1.0 . 5.17 260 138 A 19 LEU HDy% A 19 LEU HA 1.0 . 5.17 261 139 A 19 LEU HA A 19 LEU HDx% 1.0 . 4.13 262 139 A 19 LEU HDy% A 19 LEU HA 1.0 . 4.13 263 140 A 19 LEU HG A 19 LEU H 1.0 . 5.50 264 141 A 19 LEU H A 19 LEU HDx% 1.0 . 5.31 265 142 A 19 LEU HDy% A 19 LEU H 1.0 . 5.31 266 143 A 19 LEU H A 19 LEU HDx% 1.0 . 4.67 267 143 A 19 LEU HDy% A 19 LEU H 1.0 . 4.67 268 144 A 19 LEU HBx A 20 PRO HDy 1.0 . 4.21 269 144 A 20 PRO HDx A 19 LEU HBy 1.0 . 4.21 270 144 A 19 LEU HBx A 20 PRO HDx 1.0 . 4.21 271 144 A 19 LEU HBy A 20 PRO HDy 1.0 . 4.21 272 145 A 19 LEU HDy% A 20 PRO HDy 1.0 . 3.96 273 145 A 19 LEU HDx% A 20 PRO HDy 1.0 . 3.96 274 145 A 20 PRO HDx A 19 LEU HDx% 1.0 . 3.96 275 145 A 19 LEU HDy% A 20 PRO HDx 1.0 . 3.96 276 146 A 19 LEU HDy% A 20 PRO HGy 1.0 . 4.92 277 146 A 19 LEU HDx% A 20 PRO HGy 1.0 . 4.92 278 146 A 20 PRO HGx A 19 LEU HDx% 1.0 . 4.92 279 146 A 19 LEU HDy% A 20 PRO HGx 1.0 . 4.92 280 147 B 51 PRO HA A 19 LEU HDx% 1.0 . 5.31 281 147 A 19 LEU HDy% B 51 PRO HA 1.0 . 5.31 282 148 B 52 GLN H A 19 LEU HDx% 1.0 . 5.44 283 148 A 19 LEU HDy% B 52 GLN H 1.0 . 5.44 284 149 A 19 LEU HDy% B 52 GLN HBx 1.0 . 5.44 285 149 A 19 LEU HDx% B 52 GLN HBx 1.0 . 5.44 286 149 B 52 GLN HBy A 19 LEU HDx% 1.0 . 5.44 287 149 A 19 LEU HDy% B 52 GLN HBy 1.0 . 5.44 288 150 A 20 PRO HA A 21 VAL HB 1.0 . 4.98 289 151 A 20 PRO HA A 21 VAL HGy% 1.0 . 4.77 290 151 A 20 PRO HA A 21 VAL HGx% 1.0 . 4.77 291 152 A 21 VAL H A 20 PRO HDy 1.0 . 5.47 292 153 A 20 PRO HDx A 21 VAL H 1.0 . 5.47 293 154 A 21 VAL H A 20 PRO HGy 1.0 . 4.87 294 154 A 20 PRO HGx A 21 VAL H 1.0 . 4.87 295 155 A 21 VAL HGx% A 21 VAL H 1.0 . 4.03 296 156 A 21 VAL H A 21 VAL HGy% 1.0 . 4.03 297 157 A 21 VAL H A 21 VAL HGy% 1.0 . 3.41 298 157 A 21 VAL HGx% A 21 VAL H 1.0 . 3.41 299 158 A 21 VAL H A 42 LYS H 1.0 . 5.50 300 159 A 41 THR HA A 21 VAL HGy% 1.0 . 4.95 301 159 A 21 VAL HGx% A 41 THR HA 1.0 . 4.95 302 160 A 42 LYS H A 21 VAL HGy% 1.0 . 5.38 303 160 A 21 VAL HGx% A 42 LYS H 1.0 . 5.38 304 161 A 43 ARG H A 21 VAL HGy% 1.0 . 5.44 305 161 A 21 VAL HGx% A 43 ARG H 1.0 . 5.44 306 162 A 23 ARG HA A 23 ARG HD2 1.0 . 3.71 307 162 A 23 ARG HA A 23 ARG HD3 1.0 . 3.71 308 163 A 23 ARG HA A 24 ILE H 1.0 . 3.37 309 164 A 23 ARG H A 23 ARG HG2 1.0 . 5.50 310 164 A 23 ARG H A 23 ARG HG3 1.0 . 5.50 311 165 A 24 ILE H A 23 ARG H 1.0 . 4.79 312 166 A 23 ARG HBy A 23 ARG HD2 1.0 . 3.32 313 166 A 23 ARG HBx A 23 ARG HD2 1.0 . 3.32 314 166 A 23 ARG HD3 A 23 ARG HBy 1.0 . 3.32 315 166 A 23 ARG HD3 A 23 ARG HBx 1.0 . 3.32 316 167 A 23 ARG HBx A 24 ILE HG1x 1.0 . 5.18 317 167 A 23 ARG HBy A 24 ILE HG1x 1.0 . 5.18 318 167 A 24 ILE HG1y A 23 ARG HBy 1.0 . 5.18 319 167 A 23 ARG HBx A 24 ILE HG1y 1.0 . 5.18 320 168 A 24 ILE H A 23 ARG HD2 1.0 . 5.43 321 168 A 23 ARG HD3 A 24 ILE H 1.0 . 5.43 322 169 A 23 ARG HD3 A 23 ARG HG2 1.0 . 2.75 323 169 A 23 ARG HD2 A 23 ARG HG2 1.0 . 2.75 324 169 A 23 ARG HG3 A 23 ARG HD2 1.0 . 2.75 325 169 A 23 ARG HD3 A 23 ARG HG3 1.0 . 2.75 326 170 A 24 ILE HA A 24 ILE HD1% 1.0 . 3.54 327 171 A 24 ILE HA A 24 ILE HG1x 1.0 . 3.71 328 171 A 24 ILE HG1y A 24 ILE HA 1.0 . 3.71 329 172 A 24 ILE HA A 24 ILE HG2% 1.0 . 3.57 330 173 A 24 ILE HA A 25 LYS H 1.0 . 3.40 331 174 A 24 ILE HA A 25 LYS HB2 1.0 . 5.50 332 174 A 24 ILE HA A 25 LYS HB3 1.0 . 5.50 333 175 A 24 ILE HA A 40 ILE HB 1.0 . 5.50 334 176 A 24 ILE HA A 40 ILE H 1.0 . 5.36 335 177 A 24 ILE HD1% A 24 ILE HB 1.0 . 3.42 336 178 A 24 ILE HB A 25 LYS HA 1.0 . 5.50 337 179 A 25 LYS H A 24 ILE HB 1.0 . 5.18 338 180 A 24 ILE H A 24 ILE HB 1.0 . 3.48 339 181 A 24 ILE H A 24 ILE HG1y 1.0 . 4.81 340 182 A 24 ILE H A 24 ILE HG1x 1.0 . 4.81 341 183 A 24 ILE H A 24 ILE HD1% 1.0 . 4.01 342 184 A 24 ILE H A 24 ILE HG1x 1.0 . 4.09 343 184 A 24 ILE H A 24 ILE HG1y 1.0 . 4.09 344 185 A 24 ILE H A 24 ILE HG2% 1.0 . 4.61 345 186 A 24 ILE H A 25 LYS H 1.0 . 4.99 346 187 A 24 ILE H A 25 LYS HD2 1.0 . 4.60 347 187 A 24 ILE H A 25 LYS HD3 1.0 . 4.60 348 188 A 24 ILE HD1% A 25 LYS H 1.0 . 3.88 349 189 A 24 ILE HD1% A 39 PHE HBx 1.0 . 5.26 350 189 A 24 ILE HD1% A 39 PHE HBy 1.0 . 5.26 351 190 A 24 ILE HD1% A 40 ILE HA 1.0 . 5.50 352 191 A 42 LYS H A 24 ILE HD1% 1.0 . 5.50 353 192 A 25 LYS H A 24 ILE HG1x 1.0 . 5.32 354 192 A 24 ILE HG1y A 25 LYS H 1.0 . 5.32 355 193 A 41 THR HA A 24 ILE HG1x 1.0 . 5.13 356 193 A 41 THR HA A 24 ILE HG1y 1.0 . 5.13 357 194 A 24 ILE HG1y A 24 ILE HG2% 1.0 . 3.70 358 195 A 24 ILE HG2% A 24 ILE HG1x 1.0 . 3.70 359 196 A 24 ILE HD1% A 24 ILE HG2% 1.0 . 2.40 360 197 A 24 ILE HG2% A 24 ILE HG1x 1.0 . 3.08 361 197 A 24 ILE HG1y A 24 ILE HG2% 1.0 . 3.08 362 198 A 24 ILE HG2% A 25 LYS H 1.0 . 4.32 363 199 A 24 ILE HG2% A 26 THR HA 1.0 . 5.50 364 200 A 24 ILE HG2% A 26 THR HB 1.0 . 5.30 365 201 A 24 ILE HG2% A 39 PHE HA 1.0 . 4.81 366 202 A 24 ILE HG2% A 39 PHE HBx 1.0 . 4.89 367 202 A 24 ILE HG2% A 39 PHE HBy 1.0 . 4.89 368 203 A 24 ILE HG2% A 40 ILE H 1.0 . 4.90 369 204 A 25 LYS HA A 25 LYS HD2 1.0 . 4.77 370 204 A 25 LYS HA A 25 LYS HD3 1.0 . 4.77 371 205 A 25 LYS HA A 25 LYS HE2 1.0 . 4.96 372 205 A 25 LYS HA A 25 LYS HE3 1.0 . 4.96 373 206 A 25 LYS HA A 25 LYS HG2 1.0 . 3.37 374 206 A 25 LYS HA A 25 LYS HG3 1.0 . 3.37 375 207 A 25 LYS HA A 26 THR HA 1.0 . 5.50 376 208 A 25 LYS H A 25 LYS HB2 1.0 . 3.80 377 208 A 25 LYS H A 25 LYS HB3 1.0 . 3.80 378 209 A 25 LYS H A 26 THR H 1.0 . 4.69 379 210 A 25 LYS H A 39 PHE HA 1.0 . 5.17 380 211 A 25 LYS H A 40 ILE HB 1.0 . 4.35 381 212 A 25 LYS H A 40 ILE H 1.0 . 4.61 382 213 A 25 LYS H A 40 ILE HG1x 1.0 . 4.39 383 213 A 25 LYS H A 40 ILE HG1y 1.0 . 4.39 384 214 A 25 LYS H A 40 ILE HG2% 1.0 . 4.94 385 215 A 41 THR HA A 25 LYS H 1.0 . 4.99 386 216 A 25 LYS HB2 A 25 LYS HD2 1.0 . 2.40 387 216 A 25 LYS HB3 A 25 LYS HD2 1.0 . 2.40 388 216 A 25 LYS HD3 A 25 LYS HB2 1.0 . 2.40 389 216 A 25 LYS HB3 A 25 LYS HD3 1.0 . 2.40 390 217 A 25 LYS HB2 A 25 LYS HE2 1.0 . 4.44 391 217 A 25 LYS HB3 A 25 LYS HE2 1.0 . 4.44 392 217 A 25 LYS HE3 A 25 LYS HB2 1.0 . 4.44 393 217 A 25 LYS HB3 A 25 LYS HE3 1.0 . 4.44 394 218 A 26 THR HA A 25 LYS HB2 1.0 . 5.50 395 218 A 25 LYS HB3 A 26 THR HA 1.0 . 5.50 396 219 A 26 THR H A 25 LYS HB2 1.0 . 3.90 397 219 A 25 LYS HB3 A 26 THR H 1.0 . 3.90 398 220 A 27 TYR HE% A 25 LYS HB2 1.0 . 5.38 399 220 A 25 LYS HB3 A 27 TYR HE% 1.0 . 5.38 400 221 A 40 ILE HB A 25 LYS HB2 1.0 . 4.30 401 221 A 25 LYS HB3 A 40 ILE HB 1.0 . 4.30 402 222 A 40 ILE H A 25 LYS HB2 1.0 . 4.58 403 222 A 25 LYS HB3 A 40 ILE H 1.0 . 4.58 404 223 A 26 THR H A 25 LYS HE2 1.0 . 5.50 405 223 A 25 LYS HE3 A 26 THR H 1.0 . 5.50 406 224 A 25 LYS HG3 B 31 GLU HBx 1.0 . 4.33 407 224 A 25 LYS HG2 B 31 GLU HBx 1.0 . 4.33 408 224 B 31 GLU HBy A 25 LYS HG2 1.0 . 4.33 409 224 A 25 LYS HG3 B 31 GLU HBy 1.0 . 4.33 410 225 A 26 THR HA A 26 THR HG2% 1.0 . 3.71 411 226 A 26 THR HA A 27 TYR H 1.0 . 3.52 412 227 A 26 THR HA A 27 TYR HD% 1.0 . 5.50 413 228 A 26 THR HA A 37 VAL HGx% 1.0 . 5.50 414 229 A 26 THR HA A 37 VAL HGy% 1.0 . 5.50 415 230 A 26 THR HA A 39 PHE HA 1.0 . 3.64 416 231 A 26 THR HA A 39 PHE HBx 1.0 . 5.34 417 231 A 39 PHE HBy A 26 THR HA 1.0 . 5.34 418 232 A 40 ILE H A 26 THR HA 1.0 . 5.49 419 233 A 26 THR HA A 40 ILE HG1x 1.0 . 5.34 420 233 A 26 THR HA A 40 ILE HG1y 1.0 . 5.34 421 234 A 26 THR HB A 27 TYR HA 1.0 . 5.50 422 235 A 26 THR HB A 27 TYR H 1.0 . 4.82 423 236 A 26 THR HB A 37 VAL HGy% 1.0 . 5.11 424 236 A 26 THR HB A 37 VAL HGx% 1.0 . 5.11 425 237 A 26 THR HB A 39 PHE HA 1.0 . 5.50 426 238 A 26 THR HB A 39 PHE HE% 1.0 . 5.50 427 239 A 26 THR HB A 26 THR H 1.0 . 4.14 428 240 A 26 THR H A 26 THR HG2% 1.0 . 4.33 429 241 A 26 THR H A 27 TYR H 1.0 . 5.24 430 242 A 26 THR HG2% A 27 TYR H 1.0 . 3.95 431 243 A 39 PHE HA A 26 THR HG2% 1.0 . 4.59 432 244 A 26 THR HG2% A 39 PHE HE% 1.0 . 3.79 433 245 A 27 TYR HA A 38 ILE HB 1.0 . 5.50 434 246 B 29 ILE HD11 A 27 TYR HBy 1.0 . 4.81 435 247 A 28 THR H A 27 TYR HBy 1.0 . 4.83 436 248 A 29 ILE HD1% A 27 TYR HBy 1.0 . 5.50 437 249 A 38 ILE HB A 27 TYR HBy 1.0 . 5.50 438 250 A 38 ILE H A 27 TYR HBy 1.0 . 5.46 439 251 A 38 ILE HD1% A 27 TYR HBy 1.0 . 4.79 440 252 A 38 ILE HG2% A 27 TYR HBy 1.0 . 5.42 441 253 B 29 ILE HD11 A 27 TYR HBx 1.0 . 4.81 442 254 A 28 THR H A 27 TYR HBx 1.0 . 4.83 443 255 A 29 ILE HD1% A 27 TYR HBx 1.0 . 5.50 444 256 A 38 ILE HB A 27 TYR HBx 1.0 . 5.50 445 257 A 38 ILE H A 27 TYR HBx 1.0 . 5.46 446 258 A 38 ILE HD1% A 27 TYR HBx 1.0 . 4.79 447 259 A 38 ILE HG2% A 27 TYR HBx 1.0 . 5.42 448 260 A 27 TYR H A 27 TYR HD% 1.0 . 4.35 449 261 A 27 TYR HE% A 27 TYR H 1.0 . 5.48 450 262 A 27 TYR H A 28 THR H 1.0 . 4.77 451 263 A 27 TYR H A 28 THR HG2% 1.0 . 5.27 452 264 A 27 TYR H A 37 VAL HGx% 1.0 . 4.82 453 265 A 27 TYR H A 37 VAL HGy% 1.0 . 4.82 454 266 A 27 TYR H A 38 ILE HB 1.0 . 4.47 455 267 A 27 TYR H A 38 ILE HG1x 1.0 . 5.34 456 267 A 27 TYR H A 38 ILE HG1y 1.0 . 5.34 457 268 A 40 ILE H A 27 TYR H 1.0 . 5.50 458 269 B 29 ILE HD11 A 27 TYR HBx 1.0 . 4.16 459 269 B 29 ILE HD11 A 27 TYR HBy 1.0 . 4.16 460 270 A 27 TYR HBy B 29 ILE HG1x 1.0 . 4.90 461 270 A 27 TYR HBx B 29 ILE HG1x 1.0 . 4.90 462 270 B 29 ILE HG1y A 27 TYR HBx 1.0 . 4.90 463 270 A 27 TYR HBy B 29 ILE HG1y 1.0 . 4.90 464 271 B 29 ILE HG21 A 27 TYR HBx 1.0 . 4.75 465 271 A 27 TYR HBy B 29 ILE HG21 1.0 . 4.75 466 272 A 28 THR H A 27 TYR HBx 1.0 . 4.25 467 272 A 28 THR H A 27 TYR HBy 1.0 . 4.25 468 273 A 29 ILE HD1% A 27 TYR HBx 1.0 . 4.73 469 273 A 29 ILE HD1% A 27 TYR HBy 1.0 . 4.73 470 274 A 38 ILE HB A 27 TYR HBx 1.0 . 4.82 471 274 A 38 ILE HB A 27 TYR HBy 1.0 . 4.82 472 275 A 38 ILE H A 27 TYR HBx 1.0 . 4.70 473 275 A 38 ILE H A 27 TYR HBy 1.0 . 4.70 474 276 A 38 ILE HD1% A 27 TYR HBx 1.0 . 4.16 475 276 A 38 ILE HD1% A 27 TYR HBy 1.0 . 4.16 476 277 A 40 ILE HD1% A 27 TYR HBx 1.0 . 5.34 477 277 A 27 TYR HBy A 40 ILE HD1% 1.0 . 5.34 478 278 A 27 TYR HD% B 29 ILE HD11 1.0 . 4.20 479 279 A 27 TYR HD% B 29 ILE HG21 1.0 . 4.24 480 280 A 27 TYR HD% A 28 THR H 1.0 . 5.00 481 281 A 27 TYR HD% A 29 ILE HD1% 1.0 . 5.00 482 282 A 27 TYR HD% A 38 ILE HB 1.0 . 5.50 483 283 A 27 TYR HD% A 38 ILE H 1.0 . 5.50 484 284 A 27 TYR HD% A 38 ILE HD1% 1.0 . 4.86 485 285 A 27 TYR HD% A 38 ILE HG2% 1.0 . 5.16 486 286 A 27 TYR HD% A 40 ILE HD1% 1.0 . 4.56 487 287 A 27 TYR HE% B 29 ILE HD11 1.0 . 4.62 488 288 A 27 TYR HE% B 29 ILE HG21 1.0 . 4.18 489 289 A 27 TYR HE% A 28 THR H 1.0 . 5.50 490 290 A 27 TYR HE% A 38 ILE HG2% 1.0 . 5.50 491 291 A 40 ILE HB A 27 TYR HE% 1.0 . 5.50 492 292 A 27 TYR HE% A 40 ILE HD1% 1.0 . 4.20 493 293 A 27 TYR HE% A 40 ILE HG1x 1.0 . 5.34 494 293 A 40 ILE HG1y A 27 TYR HE% 1.0 . 5.34 495 294 A 28 THR HG2% A 28 THR HA 1.0 . 3.89 496 295 A 28 THR HA A 37 VAL HA 1.0 . 4.82 497 296 A 28 THR HA A 37 VAL HB 1.0 . 5.50 498 297 A 37 VAL HGx% A 28 THR HA 1.0 . 4.85 499 298 A 28 THR HA A 37 VAL HGy% 1.0 . 4.85 500 299 A 28 THR HA A 37 VAL HGy% 1.0 . 4.17 501 299 A 37 VAL HGx% A 28 THR HA 1.0 . 4.17 502 300 A 38 ILE H A 28 THR HA 1.0 . 4.61 503 301 A 38 ILE HD1% A 28 THR HA 1.0 . 5.20 504 302 A 28 THR HB A 29 ILE H 1.0 . 4.69 505 303 A 28 THR HB A 37 VAL HGy% 1.0 . 5.44 506 303 A 37 VAL HGx% A 28 THR HB 1.0 . 5.44 507 304 A 28 THR H A 28 THR HG2% 1.0 . 4.68 508 305 A 28 THR H A 29 ILE HD1% 1.0 . 5.50 509 306 A 28 THR H A 37 VAL HGy% 1.0 . 5.44 510 306 A 37 VAL HGx% A 28 THR H 1.0 . 5.44 511 307 A 28 THR HG2% A 29 ILE H 1.0 . 3.94 512 308 A 28 THR HG2% A 37 VAL HB 1.0 . 5.11 513 309 A 29 ILE HD1% A 29 ILE HA 1.0 . 5.06 514 310 A 29 ILE HA A 30 THR H 1.0 . 3.36 515 311 A 29 ILE HB B 38 ILE HB 1.0 . 5.48 516 312 A 29 ILE HB B 38 ILE HD11 1.0 . 3.65 517 313 A 29 ILE HB B 38 ILE HG21 1.0 . 4.06 518 314 A 29 ILE HD1% A 29 ILE HB 1.0 . 4.04 519 315 A 30 THR H A 29 ILE HB 1.0 . 4.79 520 316 A 29 ILE HB A 36 ALA H 1.0 . 4.46 521 317 A 29 ILE HB A 36 ALA HB% 1.0 . 4.24 522 318 A 37 VAL HA A 29 ILE HB 1.0 . 5.50 523 319 A 29 ILE H A 29 ILE HB 1.0 . 4.18 524 320 A 29 ILE HD1% A 29 ILE H 1.0 . 4.85 525 321 A 29 ILE H A 29 ILE HG1y 1.0 . 4.38 526 321 A 29 ILE H A 29 ILE HG1x 1.0 . 4.38 527 322 A 29 ILE H A 29 ILE HG2% 1.0 . 4.76 528 323 A 29 ILE H A 30 THR HB 1.0 . 5.50 529 324 A 29 ILE H A 30 THR H 1.0 . 5.02 530 325 A 29 ILE H A 35 ARG HA 1.0 . 5.50 531 326 A 29 ILE H A 36 ALA H 1.0 . 4.62 532 327 A 29 ILE HD1% B 27 TYR HBx 1.0 . 4.81 533 328 A 29 ILE HD1% B 27 TYR HBy 1.0 . 4.81 534 329 A 29 ILE HD1% B 27 TYR HBy 1.0 . 4.16 535 329 A 29 ILE HD1% B 27 TYR HBx 1.0 . 4.16 536 330 A 29 ILE HD1% B 27 TYR HD% 1.0 . 4.20 537 331 A 29 ILE HD1% B 27 TYR HE% 1.0 . 4.62 538 332 A 29 ILE HD1% B 38 ILE HB 1.0 . 4.56 539 333 A 29 ILE HD1% B 38 ILE HG1y 1.0 . 4.14 540 333 A 29 ILE HD1% B 38 ILE HG1x 1.0 . 4.14 541 334 A 29 ILE HD1% B 38 ILE HG21 1.0 . 3.30 542 335 A 29 ILE HD1% A 30 THR H 1.0 . 5.13 543 336 A 29 ILE HD1% A 36 ALA H 1.0 . 5.50 544 337 A 38 ILE HB A 29 ILE HD1% 1.0 . 5.50 545 338 A 29 ILE HD1% A 38 ILE HG1x 1.0 . 4.96 546 338 A 29 ILE HD1% A 38 ILE HG1y 1.0 . 4.96 547 339 A 29 ILE HG1x B 27 TYR HBy 1.0 . 4.90 548 339 A 29 ILE HG1y B 27 TYR HBy 1.0 . 4.90 549 339 B 27 TYR HBx A 29 ILE HG1y 1.0 . 4.90 550 339 A 29 ILE HG1x B 27 TYR HBx 1.0 . 4.90 551 340 A 30 THR H A 29 ILE HG1y 1.0 . 5.34 552 340 A 30 THR H A 29 ILE HG1x 1.0 . 5.34 553 341 A 29 ILE HG2% B 27 TYR HBy 1.0 . 4.75 554 341 A 29 ILE HG2% B 27 TYR HBx 1.0 . 4.75 555 342 A 29 ILE HG2% B 27 TYR HD% 1.0 . 4.24 556 343 A 29 ILE HG2% B 27 TYR HE% 1.0 . 4.18 557 344 A 29 ILE HG2% B 38 ILE HG1y 1.0 . 5.34 558 344 A 29 ILE HG2% B 38 ILE HG1x 1.0 . 5.34 559 345 B 38 ILE HG21 A 29 ILE HG2% 1.0 . 3.29 560 346 A 29 ILE HG2% B 40 ILE HG1x 1.0 . 4.42 561 347 A 29 ILE HG2% B 40 ILE HG1y 1.0 . 4.42 562 348 A 29 ILE HG2% B 40 ILE HD11 1.0 . 3.57 563 349 A 29 ILE HD1% A 29 ILE HG2% 1.0 . 3.38 564 350 A 29 ILE HG2% A 29 ILE HG1y 1.0 . 3.16 565 350 A 29 ILE HG1x A 29 ILE HG2% 1.0 . 3.16 566 351 A 29 ILE HG2% A 30 THR HB 1.0 . 5.50 567 352 A 30 THR H A 29 ILE HG2% 1.0 . 4.11 568 353 A 29 ILE HG2% A 31 GLU HGy 1.0 . 5.50 569 354 A 29 ILE HG2% A 31 GLU HGx 1.0 . 5.50 570 355 A 36 ALA H A 29 ILE HG2% 1.0 . 5.33 571 356 A 30 THR HA A 30 THR HG2% 1.0 . 3.46 572 357 A 30 THR HA A 31 GLU H 1.0 . 3.28 573 358 A 30 THR HA A 34 LEU H 1.0 . 4.99 574 359 A 30 THR HA A 35 ARG HBx 1.0 . 5.20 575 359 A 30 THR HA A 35 ARG HBy 1.0 . 5.20 576 360 A 30 THR HA A 35 ARG HD2 1.0 . 5.12 577 360 A 30 THR HA A 35 ARG HD3 1.0 . 5.12 578 361 A 30 THR HA A 35 ARG HGy 1.0 . 4.58 579 361 A 30 THR HA A 35 ARG HGx 1.0 . 4.58 580 362 A 36 ALA H A 30 THR HA 1.0 . 5.50 581 363 A 30 THR HB A 31 GLU H 1.0 . 4.25 582 364 A 30 THR H A 30 THR HB 1.0 . 4.03 583 365 A 30 THR H A 30 THR HG2% 1.0 . 4.30 584 366 A 30 THR H A 36 ALA H 1.0 . 5.50 585 367 A 30 THR HG2% A 31 GLU H 1.0 . 3.95 586 368 A 30 THR HG2% A 32 GLY H 1.0 . 5.50 587 369 B 40 ILE HD11 A 31 GLU HGy 1.0 . 3.95 588 370 B 40 ILE HG21 A 31 GLU HGy 1.0 . 3.88 589 371 B 40 ILE HD11 A 31 GLU HGx 1.0 . 3.95 590 372 B 40 ILE HG21 A 31 GLU HGx 1.0 . 3.88 591 373 A 31 GLU H A 31 GLU HB2 1.0 . 3.83 592 373 A 31 GLU H A 31 GLU HB3 1.0 . 3.83 593 374 A 31 GLU H A 31 GLU HGy 1.0 . 4.31 594 374 A 31 GLU H A 31 GLU HGx 1.0 . 4.31 595 375 A 31 GLU H A 32 GLY H 1.0 . 5.50 596 376 A 31 GLU H A 34 LEU HG 1.0 . 4.44 597 377 A 31 GLU H A 34 LEU H 1.0 . 4.32 598 378 A 31 GLU H A 34 LEU HBy 1.0 . 5.34 599 378 A 31 GLU H A 34 LEU HBx 1.0 . 5.34 600 379 A 35 ARG HA A 31 GLU H 1.0 . 5.50 601 380 A 31 GLU H A 35 ARG HD2 1.0 . 5.50 602 380 A 31 GLU H A 35 ARG HD3 1.0 . 5.50 603 381 A 36 ALA H A 31 GLU H 1.0 . 5.39 604 382 A 31 GLU HB3 B 25 LYS HGx 1.0 . 4.33 605 382 A 31 GLU HB2 B 25 LYS HGx 1.0 . 4.33 606 382 B 25 LYS HGy A 31 GLU HB2 1.0 . 4.33 607 382 A 31 GLU HB3 B 25 LYS HGy 1.0 . 4.33 608 383 B 38 ILE HG21 A 31 GLU HB2 1.0 . 4.49 609 383 B 38 ILE HG21 A 31 GLU HB3 1.0 . 4.49 610 384 B 40 ILE HD11 A 31 GLU HB2 1.0 . 3.79 611 384 B 40 ILE HD11 A 31 GLU HB3 1.0 . 3.79 612 385 B 40 ILE HG21 A 31 GLU HB2 1.0 . 3.93 613 385 B 40 ILE HG21 A 31 GLU HB3 1.0 . 3.93 614 386 A 32 GLY H A 31 GLU HB2 1.0 . 5.45 615 386 A 32 GLY H A 31 GLU HB3 1.0 . 5.45 616 387 A 34 LEU H A 31 GLU HB2 1.0 . 4.61 617 387 A 34 LEU H A 31 GLU HB3 1.0 . 4.61 618 388 A 31 GLU HB3 A 34 LEU HDx% 1.0 . 4.50 619 388 A 31 GLU HB2 A 34 LEU HDx% 1.0 . 4.50 620 388 A 34 LEU HDy% A 31 GLU HB2 1.0 . 4.50 621 388 A 31 GLU HB3 A 34 LEU HDy% 1.0 . 4.50 622 389 B 40 ILE HG21 A 31 GLU HGy 1.0 . 3.35 623 389 B 40 ILE HG21 A 31 GLU HGx 1.0 . 3.35 624 390 A 31 GLU HGx A 32 GLY HAy 1.0 . 5.18 625 390 A 31 GLU HGy A 32 GLY HAy 1.0 . 5.18 626 390 A 32 GLY HAx A 31 GLU HGy 1.0 . 5.18 627 390 A 31 GLU HGx A 32 GLY HAx 1.0 . 5.18 628 391 A 33 SER H A 31 GLU HGy 1.0 . 5.21 629 391 A 31 GLU HGx A 33 SER H 1.0 . 5.21 630 392 A 31 GLU HGx A 34 LEU HDx% 1.0 . 3.57 631 392 A 31 GLU HGy A 34 LEU HDx% 1.0 . 3.57 632 392 A 34 LEU HDy% A 31 GLU HGy 1.0 . 3.57 633 392 A 31 GLU HGx A 34 LEU HDy% 1.0 . 3.57 634 393 A 34 LEU H A 32 GLY H 1.0 . 5.50 635 394 A 34 LEU H A 32 GLY HAy 1.0 . 4.08 636 394 A 34 LEU H A 32 GLY HAx 1.0 . 4.08 637 395 A 32 GLY HAx A 56 VAL HGx% 1.0 . 5.28 638 395 A 32 GLY HAy A 56 VAL HGx% 1.0 . 5.28 639 395 A 56 VAL HG21 A 32 GLY HAy 1.0 . 5.28 640 395 A 32 GLY HAx A 56 VAL HG21 1.0 . 5.28 641 396 A 33 SER HA A 56 VAL HB 1.0 . 3.85 642 397 A 33 SER H A 34 LEU HBy 1.0 . 5.34 643 397 A 34 LEU HBx A 33 SER H 1.0 . 5.34 644 398 A 34 LEU HA A 34 LEU HDx% 1.0 . 4.64 645 399 A 34 LEU HDy% A 34 LEU HA 1.0 . 4.64 646 400 A 34 LEU HA A 34 LEU HDx% 1.0 . 3.63 647 400 A 34 LEU HDy% A 34 LEU HA 1.0 . 3.63 648 401 A 34 LEU HA A 52 GLN H 1.0 . 3.79 649 402 A 34 LEU HG A 35 ARG H 1.0 . 4.02 650 403 A 34 LEU H A 34 LEU HG 1.0 . 3.89 651 404 A 34 LEU H A 34 LEU HBy 1.0 . 3.44 652 404 A 34 LEU H A 34 LEU HBx 1.0 . 3.44 653 405 A 34 LEU H A 52 GLN H 1.0 . 5.00 654 406 B 40 ILE HD11 A 34 LEU HBy 1.0 . 3.91 655 406 B 40 ILE HD11 A 34 LEU HBx 1.0 . 3.91 656 407 A 52 GLN H A 34 LEU HBy 1.0 . 4.11 657 407 A 34 LEU HBx A 52 GLN H 1.0 . 4.11 658 408 A 34 LEU HBx A 52 GLN HG2 1.0 . 5.34 659 408 A 34 LEU HBy A 52 GLN HG2 1.0 . 5.34 660 408 A 52 GLN HG3 A 34 LEU HBy 1.0 . 5.34 661 408 A 34 LEU HBx A 52 GLN HG3 1.0 . 5.34 662 409 B 40 ILE HD11 A 34 LEU HDx% 1.0 . 2.75 663 409 B 40 ILE HD11 A 34 LEU HDy% 1.0 . 2.75 664 410 A 34 LEU HDx% B 40 ILE HG1y 1.0 . 2.95 665 410 B 40 ILE HG1x A 34 LEU HDx% 1.0 . 2.95 666 410 A 34 LEU HDy% B 40 ILE HG1x 1.0 . 2.95 667 410 A 34 LEU HDy% B 40 ILE HG1y 1.0 . 2.95 668 411 B 40 ILE HG21 A 34 LEU HDx% 1.0 . 2.64 669 411 B 40 ILE HG21 A 34 LEU HDy% 1.0 . 2.64 670 412 A 34 LEU HDx% B 45 LEU HD11 1.0 . 2.56 671 412 A 34 LEU HDy% B 45 LEU HD11 1.0 . 2.56 672 412 B 45 LEU HD21 A 34 LEU HDx% 1.0 . 2.56 673 412 B 45 LEU HD21 A 34 LEU HDy% 1.0 . 2.56 674 413 A 35 ARG H A 34 LEU HDx% 1.0 . 4.18 675 413 A 34 LEU HDy% A 35 ARG H 1.0 . 4.18 676 414 A 36 ALA HA A 34 LEU HDx% 1.0 . 5.42 677 414 A 34 LEU HDy% A 36 ALA HA 1.0 . 5.42 678 415 A 36 ALA H A 34 LEU HDx% 1.0 . 5.44 679 415 A 36 ALA H A 34 LEU HDy% 1.0 . 5.44 680 416 A 50 ASP H A 34 LEU HDx% 1.0 . 4.78 681 416 A 50 ASP H A 34 LEU HDy% 1.0 . 4.78 682 417 A 52 GLN H A 34 LEU HDx% 1.0 . 5.36 683 417 A 34 LEU HDy% A 52 GLN H 1.0 . 5.36 684 418 A 35 ARG HA A 35 ARG HD2 1.0 . 5.50 685 418 A 35 ARG HA A 35 ARG HD3 1.0 . 5.50 686 419 A 36 ALA H A 35 ARG HBy 1.0 . 4.87 687 420 A 36 ALA H A 35 ARG HBx 1.0 . 4.87 688 421 A 35 ARG H A 35 ARG HD2 1.0 . 5.50 689 421 A 35 ARG HD3 A 35 ARG H 1.0 . 5.50 690 422 A 36 ALA H A 35 ARG H 1.0 . 5.25 691 423 A 36 ALA HB% A 35 ARG H 1.0 . 5.32 692 424 A 50 ASP H A 35 ARG H 1.0 . 5.10 693 425 A 35 ARG H A 50 ASP HBx 1.0 . 5.34 694 425 A 35 ARG H A 50 ASP HBy 1.0 . 5.34 695 426 A 35 ARG H A 51 PRO HDy 1.0 . 5.35 696 426 A 35 ARG H A 51 PRO HDx 1.0 . 5.35 697 427 A 35 ARG H A 52 GLN HG2 1.0 . 5.50 698 427 A 35 ARG H A 52 GLN HG3 1.0 . 5.50 699 428 A 36 ALA HB% A 35 ARG HBx 1.0 . 5.34 700 428 A 36 ALA HB% A 35 ARG HBy 1.0 . 5.34 701 429 A 35 ARG HBx A 37 VAL HGy% 1.0 . 4.98 702 429 A 35 ARG HBy A 37 VAL HGy% 1.0 . 4.98 703 429 A 37 VAL HGx% A 35 ARG HBx 1.0 . 4.98 704 429 A 37 VAL HGx% A 35 ARG HBy 1.0 . 4.98 705 430 A 36 ALA H A 35 ARG HD2 1.0 . 5.50 706 430 A 36 ALA H A 35 ARG HD3 1.0 . 5.50 707 431 B 38 ILE HD11 A 36 ALA HA 1.0 . 5.05 708 432 B 38 ILE HG21 A 36 ALA HA 1.0 . 5.05 709 433 A 37 VAL HA A 36 ALA HA 1.0 . 5.50 710 434 A 37 VAL HB A 36 ALA HA 1.0 . 5.50 711 435 A 36 ALA HA A 37 VAL H 1.0 . 3.53 712 436 A 36 ALA HA A 37 VAL HGy% 1.0 . 4.64 713 436 A 37 VAL HGx% A 36 ALA HA 1.0 . 4.64 714 437 A 48 CYS H A 36 ALA HA 1.0 . 5.04 715 438 A 49 ALA HA A 36 ALA HA 1.0 . 4.32 716 439 A 49 ALA HB% A 36 ALA HA 1.0 . 4.45 717 440 A 50 ASP H A 36 ALA HA 1.0 . 4.56 718 441 A 36 ALA HA A 50 ASP HBx 1.0 . 5.34 719 441 A 36 ALA HA A 50 ASP HBy 1.0 . 5.34 720 442 B 38 ILE HD11 A 36 ALA H 1.0 . 5.30 721 443 B 38 ILE HG21 A 36 ALA H 1.0 . 5.10 722 444 A 36 ALA H A 36 ALA HB% 1.0 . 4.02 723 445 A 36 ALA H A 37 VAL HGy% 1.0 . 5.44 724 445 A 37 VAL HGx% A 36 ALA H 1.0 . 5.44 725 446 B 38 ILE HG21 A 36 ALA HB% 1.0 . 2.95 726 447 A 36 ALA HB% A 37 VAL H 1.0 . 3.76 727 448 A 48 CYS H A 36 ALA HB% 1.0 . 5.02 728 449 A 49 ALA HA A 36 ALA HB% 1.0 . 4.79 729 450 A 50 ASP H A 36 ALA HB% 1.0 . 4.87 730 451 A 37 VAL HGx% A 37 VAL HA 1.0 . 3.99 731 452 A 37 VAL HA A 37 VAL HGy% 1.0 . 3.99 732 453 A 38 ILE H A 37 VAL HB 1.0 . 4.86 733 454 A 39 PHE HE% A 37 VAL HB 1.0 . 4.89 734 455 A 48 CYS HA A 37 VAL HB 1.0 . 5.50 735 456 A 48 CYS H A 37 VAL HB 1.0 . 5.12 736 457 A 37 VAL HB A 48 CYS HB2 1.0 . 4.73 737 457 A 48 CYS HB3 A 37 VAL HB 1.0 . 4.73 738 458 A 37 VAL HB A 37 VAL H 1.0 . 4.10 739 459 A 37 VAL HGx% A 37 VAL H 1.0 . 4.42 740 460 A 37 VAL H A 37 VAL HGy% 1.0 . 4.42 741 461 A 37 VAL H A 37 VAL HGy% 1.0 . 3.73 742 461 A 37 VAL HGx% A 37 VAL H 1.0 . 3.73 743 462 A 39 PHE HE% A 37 VAL H 1.0 . 5.50 744 463 A 48 CYS H A 37 VAL H 1.0 . 4.55 745 464 A 37 VAL H A 48 CYS HB2 1.0 . 4.72 746 464 A 48 CYS HB3 A 37 VAL H 1.0 . 4.72 747 465 A 49 ALA HA A 37 VAL H 1.0 . 4.34 748 466 A 49 ALA H A 37 VAL H 1.0 . 5.19 749 467 A 49 ALA HB% A 37 VAL H 1.0 . 4.64 750 468 A 50 ASP H A 37 VAL H 1.0 . 5.22 751 469 A 37 VAL HGx% A 38 ILE H 1.0 . 4.13 752 470 A 37 VAL HGx% A 39 PHE HE% 1.0 . 4.37 753 471 A 48 CYS H A 37 VAL HGx% 1.0 . 5.30 754 472 A 38 ILE H A 37 VAL HGy% 1.0 . 4.13 755 473 A 39 PHE HE% A 37 VAL HGy% 1.0 . 4.37 756 474 A 48 CYS H A 37 VAL HGy% 1.0 . 5.30 757 475 A 38 ILE HA A 37 VAL HGy% 1.0 . 4.75 758 475 A 37 VAL HGx% A 38 ILE HA 1.0 . 4.75 759 476 A 39 PHE HA A 37 VAL HGy% 1.0 . 4.58 760 476 A 39 PHE HA A 37 VAL HGx% 1.0 . 4.58 761 477 A 39 PHE HE% A 37 VAL HGy% 1.0 . 3.61 762 477 A 37 VAL HGx% A 39 PHE HE% 1.0 . 3.61 763 478 A 48 CYS H A 37 VAL HGy% 1.0 . 4.64 764 478 A 48 CYS H A 37 VAL HGx% 1.0 . 4.64 765 479 A 37 VAL HGy% A 48 CYS HB2 1.0 . 4.44 766 479 A 37 VAL HGx% A 48 CYS HB2 1.0 . 4.44 767 479 A 48 CYS HB3 A 37 VAL HGy% 1.0 . 4.44 768 479 A 48 CYS HB3 A 37 VAL HGx% 1.0 . 4.44 769 480 A 37 VAL HGx% A 50 ASP HBx 1.0 . 5.28 770 480 A 37 VAL HGy% A 50 ASP HBx 1.0 . 5.28 771 480 A 50 ASP HBy A 37 VAL HGy% 1.0 . 5.28 772 480 A 37 VAL HGx% A 50 ASP HBy 1.0 . 5.28 773 481 A 38 ILE HD1% A 38 ILE HA 1.0 . 4.56 774 482 A 38 ILE HG2% A 38 ILE HA 1.0 . 4.19 775 483 A 46 LYS H A 38 ILE HA 1.0 . 4.98 776 484 A 38 ILE HA A 47 VAL HA 1.0 . 4.96 777 485 A 48 CYS H A 38 ILE HA 1.0 . 4.73 778 486 A 38 ILE HB B 29 ILE HB 1.0 . 5.48 779 487 A 38 ILE HB B 29 ILE HD11 1.0 . 4.56 780 488 A 38 ILE HB A 38 ILE HD1% 1.0 . 3.93 781 489 A 38 ILE HG1y A 39 PHE H 1.0 . 5.50 782 490 A 48 CYS H A 38 ILE HG1y 1.0 . 5.50 783 491 A 39 PHE H A 38 ILE HG1x 1.0 . 5.50 784 492 A 48 CYS H A 38 ILE HG1x 1.0 . 5.50 785 493 A 38 ILE HB A 38 ILE H 1.0 . 4.16 786 494 A 38 ILE H A 38 ILE HG1y 1.0 . 4.76 787 495 A 38 ILE H A 38 ILE HG1x 1.0 . 4.76 788 496 A 38 ILE H A 38 ILE HD1% 1.0 . 4.41 789 497 A 38 ILE H A 38 ILE HG1x 1.0 . 4.08 790 497 A 38 ILE H A 38 ILE HG1y 1.0 . 4.08 791 498 A 38 ILE H A 38 ILE HG2% 1.0 . 4.25 792 499 A 38 ILE H A 39 PHE H 1.0 . 5.38 793 500 A 38 ILE H A 40 ILE HD1% 1.0 . 5.50 794 501 A 38 ILE HD1% B 29 ILE HB 1.0 . 3.65 795 502 A 38 ILE HD1% B 36 ALA HA 1.0 . 5.05 796 503 A 38 ILE HD1% B 36 ALA H 1.0 . 5.30 797 504 A 38 ILE HD1% B 48 CYS H 1.0 . 5.50 798 505 B 29 ILE HD11 A 38 ILE HG1x 1.0 . 4.14 799 505 B 29 ILE HD11 A 38 ILE HG1y 1.0 . 4.14 800 506 B 29 ILE HG21 A 38 ILE HG1x 1.0 . 5.34 801 506 A 38 ILE HG1y B 29 ILE HG21 1.0 . 5.34 802 507 A 39 PHE H A 38 ILE HG1x 1.0 . 4.66 803 507 A 38 ILE HG1y A 39 PHE H 1.0 . 4.66 804 508 A 47 VAL HA A 38 ILE HG1x 1.0 . 5.34 805 508 A 38 ILE HG1y A 47 VAL HA 1.0 . 5.34 806 509 A 47 VAL HB A 38 ILE HG1x 1.0 . 5.34 807 509 A 47 VAL HB A 38 ILE HG1y 1.0 . 5.34 808 510 A 38 ILE HG2% B 29 ILE HB 1.0 . 4.06 809 511 B 29 ILE HD11 A 38 ILE HG2% 1.0 . 3.30 810 512 A 38 ILE HG2% B 29 ILE HG21 1.0 . 3.29 811 513 A 38 ILE HG2% B 31 GLU HBx 1.0 . 4.49 812 513 B 31 GLU HBy A 38 ILE HG2% 1.0 . 4.49 813 514 A 38 ILE HG2% B 36 ALA HA 1.0 . 5.05 814 515 A 38 ILE HG2% B 36 ALA H 1.0 . 5.10 815 516 A 38 ILE HG2% B 36 ALA HB1 1.0 . 2.95 816 517 A 38 ILE HG2% A 38 ILE HG1y 1.0 . 3.82 817 518 A 38 ILE HG2% A 38 ILE HG1x 1.0 . 3.82 818 519 A 38 ILE HD1% A 38 ILE HG2% 1.0 . 2.78 819 520 A 38 ILE HG2% A 38 ILE HG1x 1.0 . 3.31 820 520 A 38 ILE HG2% A 38 ILE HG1y 1.0 . 3.31 821 521 A 38 ILE HG2% A 39 PHE H 1.0 . 3.99 822 522 A 38 ILE HG2% A 39 PHE HD% 1.0 . 5.50 823 523 A 40 ILE HA A 38 ILE HG2% 1.0 . 5.26 824 524 A 40 ILE H A 38 ILE HG2% 1.0 . 4.16 825 525 A 46 LYS H A 38 ILE HG2% 1.0 . 5.29 826 526 A 39 PHE HA A 39 PHE HE% 1.0 . 5.49 827 527 A 39 PHE HA A 40 ILE HG1y 1.0 . 5.50 828 528 A 39 PHE HA A 40 ILE HG1x 1.0 . 5.50 829 529 A 40 ILE H A 39 PHE HA 1.0 . 3.55 830 530 A 39 PHE HA A 40 ILE HD1% 1.0 . 5.17 831 531 A 40 ILE H A 39 PHE HBy 1.0 . 5.02 832 532 A 46 LYS H A 39 PHE HBy 1.0 . 5.07 833 533 A 46 LYS HB3 A 39 PHE HBy 1.0 . 5.07 834 533 A 39 PHE HBy A 46 LYS HB2 1.0 . 5.07 835 534 A 40 ILE H A 39 PHE HBx 1.0 . 5.02 836 535 A 46 LYS H A 39 PHE HBx 1.0 . 5.07 837 536 A 46 LYS HB3 A 39 PHE HBx 1.0 . 5.07 838 536 A 39 PHE HBx A 46 LYS HB2 1.0 . 5.07 839 537 A 39 PHE H A 39 PHE HD% 1.0 . 4.43 840 538 A 40 ILE HA A 39 PHE H 1.0 . 5.50 841 539 A 40 ILE H A 39 PHE H 1.0 . 5.39 842 540 A 39 PHE H A 45 LEU HA 1.0 . 5.20 843 541 A 39 PHE H A 45 LEU HDx% 1.0 . 5.44 844 541 A 39 PHE H A 45 LEU HDy% 1.0 . 5.44 845 542 A 46 LYS H A 39 PHE H 1.0 . 4.60 846 543 A 39 PHE H A 46 LYS HB2 1.0 . 4.82 847 543 A 46 LYS HB3 A 39 PHE H 1.0 . 4.82 848 544 A 39 PHE H A 46 LYS HG2 1.0 . 4.78 849 544 A 46 LYS HG3 A 39 PHE H 1.0 . 4.78 850 545 A 47 VAL HA A 39 PHE H 1.0 . 4.65 851 546 A 48 CYS H A 39 PHE H 1.0 . 4.95 852 547 A 40 ILE H A 39 PHE HBx 1.0 . 4.29 853 547 A 40 ILE H A 39 PHE HBy 1.0 . 4.29 854 548 A 41 THR HG2% A 39 PHE HBx 1.0 . 5.32 855 548 A 39 PHE HBy A 41 THR HG2% 1.0 . 5.32 856 549 A 46 LYS H A 39 PHE HBx 1.0 . 4.43 857 549 A 46 LYS H A 39 PHE HBy 1.0 . 4.43 858 550 A 39 PHE HBy A 46 LYS HD2 1.0 . 5.34 859 550 A 39 PHE HBx A 46 LYS HD2 1.0 . 5.34 860 550 A 46 LYS HD3 A 39 PHE HBx 1.0 . 5.34 861 550 A 46 LYS HD3 A 39 PHE HBy 1.0 . 5.34 862 551 A 40 ILE H A 39 PHE HD% 1.0 . 5.29 863 552 A 39 PHE HD% A 46 LYS HB2 1.0 . 5.40 864 552 A 46 LYS HB3 A 39 PHE HD% 1.0 . 5.40 865 553 A 39 PHE HD% A 46 LYS HD2 1.0 . 4.86 866 553 A 46 LYS HD3 A 39 PHE HD% 1.0 . 4.86 867 554 A 39 PHE HE% A 46 LYS HE2 1.0 . 4.92 868 554 A 46 LYS HE3 A 39 PHE HE% 1.0 . 4.92 869 555 A 48 CYS H A 39 PHE HE% 1.0 . 5.30 870 556 A 40 ILE HA A 40 ILE HD1% 1.0 . 4.52 871 557 A 40 ILE HA A 40 ILE HG1x 1.0 . 3.55 872 557 A 40 ILE HA A 40 ILE HG1y 1.0 . 3.55 873 558 A 40 ILE HA A 41 THR HG2% 1.0 . 4.35 874 559 A 40 ILE HA A 45 LEU HB2 1.0 . 5.50 875 559 A 45 LEU HB3 A 40 ILE HA 1.0 . 5.50 876 560 A 40 ILE HA A 45 LEU HDx% 1.0 . 4.71 877 560 A 40 ILE HA A 45 LEU HDy% 1.0 . 4.71 878 561 A 46 LYS H A 40 ILE HA 1.0 . 5.06 879 562 A 40 ILE HB A 40 ILE HD1% 1.0 . 3.81 880 563 A 40 ILE HB A 41 THR H 1.0 . 4.91 881 564 A 40 ILE HG1y B 29 ILE HG21 1.0 . 4.42 882 565 B 29 ILE HG21 A 40 ILE HG1x 1.0 . 4.42 883 566 A 40 ILE HB A 40 ILE H 1.0 . 4.07 884 567 A 40 ILE H A 40 ILE HD1% 1.0 . 5.01 885 568 A 40 ILE H A 40 ILE HG1x 1.0 . 4.31 886 568 A 40 ILE H A 40 ILE HG1y 1.0 . 4.31 887 569 A 40 ILE H A 40 ILE HG2% 1.0 . 4.16 888 570 B 29 ILE HG21 A 40 ILE HD1% 1.0 . 3.57 889 571 A 40 ILE HD1% B 31 GLU HGx 1.0 . 3.95 890 572 A 40 ILE HD1% B 31 GLU HGy 1.0 . 3.95 891 573 A 40 ILE HD1% B 31 GLU HBx 1.0 . 3.79 892 573 B 31 GLU HBy A 40 ILE HD1% 1.0 . 3.79 893 574 A 40 ILE HD1% B 34 LEU HBx 1.0 . 3.91 894 574 A 40 ILE HD1% B 34 LEU HBy 1.0 . 3.91 895 575 A 40 ILE HD1% B 34 LEU HD11 1.0 . 2.75 896 575 A 40 ILE HD1% B 34 LEU HD21 1.0 . 2.75 897 576 A 40 ILE HD1% A 41 THR H 1.0 . 5.05 898 577 A 40 ILE HG1x B 34 LEU HD11 1.0 . 2.95 899 577 A 40 ILE HG1y B 34 LEU HD11 1.0 . 2.95 900 577 B 34 LEU HD21 A 40 ILE HG1x 1.0 . 2.95 901 577 A 40 ILE HG1y B 34 LEU HD21 1.0 . 2.95 902 578 A 41 THR H A 40 ILE HG1x 1.0 . 4.84 903 578 A 40 ILE HG1y A 41 THR H 1.0 . 4.84 904 579 A 40 ILE HG2% B 31 GLU HGx 1.0 . 3.88 905 580 A 40 ILE HG2% B 31 GLU HGy 1.0 . 3.88 906 581 A 40 ILE HG2% B 31 GLU HBx 1.0 . 3.93 907 581 A 40 ILE HG2% B 31 GLU HBy 1.0 . 3.93 908 582 A 40 ILE HG2% B 31 GLU HGx 1.0 . 3.35 909 582 A 40 ILE HG2% B 31 GLU HGy 1.0 . 3.35 910 583 A 40 ILE HG2% B 34 LEU HD11 1.0 . 2.64 911 583 A 40 ILE HG2% B 34 LEU HD21 1.0 . 2.64 912 584 A 40 ILE HG1y A 40 ILE HG2% 1.0 . 3.49 913 585 A 40 ILE HG2% A 40 ILE HG1x 1.0 . 3.49 914 586 A 40 ILE HG2% A 40 ILE HD1% 1.0 . 2.55 915 587 A 40 ILE HG2% A 40 ILE HG1x 1.0 . 2.84 916 587 A 40 ILE HG1y A 40 ILE HG2% 1.0 . 2.84 917 588 A 40 ILE HG2% A 41 THR H 1.0 . 3.92 918 589 A 41 THR HG2% A 41 THR H 1.0 . 4.15 919 590 A 42 LYS H A 41 THR H 1.0 . 5.50 920 591 A 43 ARG H A 41 THR H 1.0 . 5.50 921 592 A 44 GLY H A 41 THR H 1.0 . 4.78 922 593 A 45 LEU HA A 41 THR H 1.0 . 4.76 923 594 A 41 THR H A 45 LEU HDx% 1.0 . 4.49 924 594 A 45 LEU HDy% A 41 THR H 1.0 . 4.49 925 595 A 42 LYS H A 41 THR HG2% 1.0 . 4.73 926 596 A 43 ARG H A 41 THR HG2% 1.0 . 4.95 927 597 A 44 GLY H A 41 THR HG2% 1.0 . 5.13 928 598 A 41 THR HG2% A 46 LYS HB2 1.0 . 5.50 929 598 A 46 LYS HB3 A 41 THR HG2% 1.0 . 5.50 930 599 A 44 GLY H A 42 LYS HA 1.0 . 4.15 931 600 A 42 LYS H A 42 LYS HD2 1.0 . 4.80 932 600 A 42 LYS H A 42 LYS HD3 1.0 . 4.80 933 601 A 42 LYS H A 42 LYS HEx 1.0 . 4.31 934 601 A 42 LYS H A 42 LYS HEy 1.0 . 4.31 935 602 A 42 LYS H A 43 ARG H 1.0 . 4.85 936 603 A 44 GLY H A 42 LYS H 1.0 . 5.49 937 604 A 43 ARG H A 42 LYS HB2 1.0 . 5.21 938 604 A 43 ARG H A 42 LYS HB3 1.0 . 5.21 939 605 A 43 ARG H A 42 LYS HEx 1.0 . 4.47 940 605 A 43 ARG H A 42 LYS HEy 1.0 . 4.47 941 606 A 44 GLY H A 42 LYS HEx 1.0 . 5.08 942 606 A 44 GLY H A 42 LYS HEy 1.0 . 5.08 943 607 A 43 ARG HA A 43 ARG HD2 1.0 . 4.97 944 607 A 43 ARG HA A 43 ARG HD3 1.0 . 4.97 945 608 A 44 GLY H A 43 ARG HBy 1.0 . 5.01 946 609 A 44 GLY H A 43 ARG HBx 1.0 . 5.01 947 610 A 43 ARG H A 43 ARG HBx 1.0 . 3.53 948 610 A 43 ARG H A 43 ARG HBy 1.0 . 3.53 949 611 A 43 ARG H A 43 ARG HD2 1.0 . 5.13 950 611 A 43 ARG H A 43 ARG HD3 1.0 . 5.13 951 612 A 44 GLY H A 43 ARG H 1.0 . 3.81 952 613 A 43 ARG H A 44 GLY HAx 1.0 . 5.34 953 613 A 44 GLY HAy A 43 ARG H 1.0 . 5.34 954 614 A 43 ARG HBy A 43 ARG HD2 1.0 . 3.41 955 614 A 43 ARG HBx A 43 ARG HD2 1.0 . 3.41 956 614 A 43 ARG HD3 A 43 ARG HBx 1.0 . 3.41 957 614 A 43 ARG HD3 A 43 ARG HBy 1.0 . 3.41 958 615 A 44 GLY H A 43 ARG HBx 1.0 . 4.14 959 615 A 44 GLY H A 43 ARG HBy 1.0 . 4.14 960 616 A 45 LEU H A 44 GLY H 1.0 . 4.88 961 617 A 44 GLY HAy A 45 LEU HB2 1.0 . 5.34 962 617 A 45 LEU HB3 A 44 GLY HAx 1.0 . 5.34 963 617 A 45 LEU HB3 A 44 GLY HAy 1.0 . 5.34 964 617 A 44 GLY HAx A 45 LEU HB2 1.0 . 5.34 965 618 A 45 LEU HA A 45 LEU HDx% 1.0 . 4.60 966 619 A 45 LEU HA A 45 LEU HDy% 1.0 . 4.60 967 620 A 45 LEU HA A 45 LEU HDx% 1.0 . 3.96 968 620 A 45 LEU HA A 45 LEU HDy% 1.0 . 3.96 969 621 A 45 LEU HG B 49 ALA HA 1.0 . 5.50 970 622 A 46 LYS H A 45 LEU HG 1.0 . 5.41 971 623 A 45 LEU H A 45 LEU HB2 1.0 . 3.90 972 623 A 45 LEU H A 45 LEU HB3 1.0 . 3.90 973 624 A 45 LEU H A 45 LEU HDx% 1.0 . 5.50 974 625 A 45 LEU H A 45 LEU HDy% 1.0 . 5.50 975 626 A 45 LEU H A 45 LEU HDx% 1.0 . 4.17 976 626 A 45 LEU H A 45 LEU HDy% 1.0 . 4.17 977 627 A 46 LYS HA A 45 LEU H 1.0 . 5.33 978 628 A 45 LEU H A 46 LYS H 1.0 . 4.99 979 629 A 45 LEU HB2 A 45 LEU HDx% 1.0 . 3.68 980 629 A 45 LEU HB3 A 45 LEU HDx% 1.0 . 3.68 981 630 A 45 LEU HB3 A 45 LEU HDy% 1.0 . 3.68 982 630 A 45 LEU HDy% A 45 LEU HB2 1.0 . 3.68 983 631 A 46 LYS HA A 45 LEU HB2 1.0 . 5.50 984 631 A 46 LYS HA A 45 LEU HB3 1.0 . 5.50 985 632 A 46 LYS H A 45 LEU HB2 1.0 . 4.95 986 632 A 45 LEU HB3 A 46 LYS H 1.0 . 4.95 987 633 A 46 LYS H A 45 LEU HDx% 1.0 . 4.85 988 634 A 46 LYS H A 45 LEU HDy% 1.0 . 4.85 989 635 B 11 CYS HA A 45 LEU HDx% 1.0 . 4.44 990 635 A 45 LEU HDy% B 11 CYS HA 1.0 . 4.44 991 636 A 45 LEU HDy% B 34 LEU HD11 1.0 . 2.56 992 636 A 45 LEU HDx% B 34 LEU HD11 1.0 . 2.56 993 636 B 34 LEU HD21 A 45 LEU HDx% 1.0 . 2.56 994 636 A 45 LEU HDy% B 34 LEU HD21 1.0 . 2.56 995 637 B 48 CYS H A 45 LEU HDx% 1.0 . 5.34 996 637 B 48 CYS H A 45 LEU HDy% 1.0 . 5.34 997 638 B 49 ALA HA A 45 LEU HDx% 1.0 . 5.00 998 638 A 45 LEU HDy% B 49 ALA HA 1.0 . 5.00 999 639 B 49 ALA H A 45 LEU HDx% 1.0 . 4.45 1000 639 A 45 LEU HDy% B 49 ALA H 1.0 . 4.45 1001 640 B 49 ALA HB1 A 45 LEU HDx% 1.0 . 2.88 1002 640 A 45 LEU HDy% B 49 ALA HB1 1.0 . 2.88 1003 641 B 50 ASP H A 45 LEU HDx% 1.0 . 5.44 1004 641 A 45 LEU HDy% B 50 ASP H 1.0 . 5.44 1005 642 A 46 LYS H A 45 LEU HDx% 1.0 . 4.20 1006 642 A 46 LYS H A 45 LEU HDy% 1.0 . 4.20 1007 643 A 47 VAL HA A 45 LEU HDx% 1.0 . 4.17 1008 643 A 47 VAL HA A 45 LEU HDy% 1.0 . 4.17 1009 644 A 47 VAL HB A 45 LEU HDx% 1.0 . 4.46 1010 644 A 47 VAL HB A 45 LEU HDy% 1.0 . 4.46 1011 645 A 46 LYS HA A 46 LYS HD2 1.0 . 4.65 1012 645 A 46 LYS HD3 A 46 LYS HA 1.0 . 4.65 1013 646 A 46 LYS HA A 46 LYS HE2 1.0 . 5.43 1014 646 A 46 LYS HA A 46 LYS HE3 1.0 . 5.43 1015 647 A 46 LYS H A 46 LYS HB2 1.0 . 4.18 1016 647 A 46 LYS HB3 A 46 LYS H 1.0 . 4.18 1017 648 A 46 LYS HB2 A 46 LYS HD2 1.0 . 3.83 1018 648 A 46 LYS HB3 A 46 LYS HD2 1.0 . 3.83 1019 648 A 46 LYS HD3 A 46 LYS HB2 1.0 . 3.83 1020 648 A 46 LYS HD3 A 46 LYS HB3 1.0 . 3.83 1021 649 A 46 LYS HB3 A 46 LYS HE2 1.0 . 4.39 1022 649 A 46 LYS HB2 A 46 LYS HE2 1.0 . 4.39 1023 649 A 46 LYS HE3 A 46 LYS HB2 1.0 . 4.39 1024 649 A 46 LYS HE3 A 46 LYS HB3 1.0 . 4.39 1025 650 A 47 VAL H A 46 LYS HD2 1.0 . 4.12 1026 650 A 47 VAL H A 46 LYS HD3 1.0 . 4.12 1027 651 A 47 VAL H A 46 LYS HE2 1.0 . 5.45 1028 651 A 47 VAL H A 46 LYS HE3 1.0 . 5.45 1029 652 A 46 LYS HD2 A 46 LYS HG2 1.0 . 2.40 1030 652 A 46 LYS HD3 A 46 LYS HG2 1.0 . 2.40 1031 652 A 46 LYS HG3 A 46 LYS HD2 1.0 . 2.40 1032 652 A 46 LYS HG3 A 46 LYS HD3 1.0 . 2.40 1033 653 A 46 LYS HE2 A 46 LYS HG2 1.0 . 3.73 1034 653 A 46 LYS HE3 A 46 LYS HG2 1.0 . 3.73 1035 653 A 46 LYS HG3 A 46 LYS HE2 1.0 . 3.73 1036 653 A 46 LYS HG3 A 46 LYS HE3 1.0 . 3.73 1037 654 A 48 CYS H A 47 VAL HB 1.0 . 5.09 1038 655 A 47 VAL H A 47 VAL HGx% 1.0 . 3.94 1039 655 A 47 VAL H A 47 VAL HGy% 1.0 . 3.94 1040 656 A 47 VAL H A 48 CYS H 1.0 . 5.10 1041 657 A 48 CYS HA A 47 VAL HGx% 1.0 . 5.11 1042 657 A 48 CYS HA A 47 VAL HGy% 1.0 . 5.11 1043 658 A 48 CYS H A 47 VAL HGx% 1.0 . 3.85 1044 658 A 47 VAL HGy% A 48 CYS H 1.0 . 3.85 1045 659 A 49 ALA HB% A 47 VAL HGx% 1.0 . 3.82 1046 659 A 47 VAL HGy% A 49 ALA HB% 1.0 . 3.82 1047 660 A 48 CYS HA A 49 ALA HB% 1.0 . 5.33 1048 661 A 48 CYS H B 38 ILE HD11 1.0 . 5.50 1049 662 A 48 CYS H B 45 LEU HD11 1.0 . 5.34 1050 662 B 45 LEU HD21 A 48 CYS H 1.0 . 5.34 1051 663 A 48 CYS H A 48 CYS HB2 1.0 . 4.05 1052 663 A 48 CYS H A 48 CYS HB3 1.0 . 4.05 1053 664 A 49 ALA HA A 48 CYS H 1.0 . 5.50 1054 665 A 49 ALA H A 48 CYS H 1.0 . 4.95 1055 666 A 49 ALA H A 48 CYS HB2 1.0 . 4.15 1056 666 A 49 ALA H A 48 CYS HB3 1.0 . 4.15 1057 667 A 49 ALA HA B 45 LEU HG 1.0 . 5.50 1058 668 A 49 ALA HA B 45 LEU HD11 1.0 . 5.00 1059 668 A 49 ALA HA B 45 LEU HD21 1.0 . 5.00 1060 669 A 50 ASP H A 49 ALA HA 1.0 . 3.56 1061 670 A 49 ALA H B 45 LEU HD11 1.0 . 4.45 1062 670 A 49 ALA H B 45 LEU HD21 1.0 . 4.45 1063 671 A 49 ALA H A 49 ALA HB% 1.0 . 3.85 1064 672 A 49 ALA H A 50 ASP H 1.0 . 5.24 1065 673 A 49 ALA H A 50 ASP HBx 1.0 . 5.34 1066 673 A 49 ALA H A 50 ASP HBy 1.0 . 5.34 1067 674 A 49 ALA HB% B 45 LEU HD11 1.0 . 2.88 1068 674 B 45 LEU HD21 A 49 ALA HB% 1.0 . 2.88 1069 675 A 50 ASP HA A 49 ALA HB% 1.0 . 5.38 1070 676 A 50 ASP H A 49 ALA HB% 1.0 . 3.84 1071 677 A 50 ASP H B 45 LEU HD11 1.0 . 5.44 1072 677 A 50 ASP H B 45 LEU HD21 1.0 . 5.44 1073 678 A 50 ASP H A 50 ASP HBy 1.0 . 4.19 1074 679 A 50 ASP H A 50 ASP HBx 1.0 . 4.19 1075 680 A 50 ASP H A 50 ASP HBx 1.0 . 3.67 1076 680 A 50 ASP H A 50 ASP HBy 1.0 . 3.67 1077 681 A 50 ASP H A 51 PRO HDy 1.0 . 5.02 1078 681 A 50 ASP H A 51 PRO HDx 1.0 . 5.02 1079 682 A 50 ASP HBy A 51 PRO HDy 1.0 . 5.18 1080 682 A 50 ASP HBx A 51 PRO HDy 1.0 . 5.18 1081 682 A 51 PRO HDx A 50 ASP HBx 1.0 . 5.18 1082 682 A 50 ASP HBy A 51 PRO HDx 1.0 . 5.18 1083 683 A 51 PRO HA B 19 LEU HD11 1.0 . 5.31 1084 683 A 51 PRO HA B 19 LEU HD21 1.0 . 5.31 1085 684 A 51 PRO HA A 52 GLN HB2 1.0 . 5.50 1086 684 A 51 PRO HA A 52 GLN HB3 1.0 . 5.50 1087 685 A 51 PRO HA A 52 GLN HG2 1.0 . 4.66 1088 685 A 52 GLN HG3 A 51 PRO HA 1.0 . 4.66 1089 686 B 16 THR HG21 A 51 PRO HDy 1.0 . 4.81 1090 686 A 51 PRO HDx B 16 THR HG21 1.0 . 4.81 1091 687 A 52 GLN HA A 53 ALA HB% 1.0 . 5.50 1092 688 A 52 GLN H B 19 LEU HD11 1.0 . 5.44 1093 688 A 52 GLN H B 19 LEU HD21 1.0 . 5.44 1094 689 A 52 GLN H A 52 GLN HB2 1.0 . 3.98 1095 689 A 52 GLN H A 52 GLN HB3 1.0 . 3.98 1096 690 A 52 GLN H A 52 GLN HG2 1.0 . 4.10 1097 690 A 52 GLN H A 52 GLN HG3 1.0 . 4.10 1098 691 A 52 GLN H A 53 ALA HB% 1.0 . 5.42 1099 692 A 52 GLN HB2 B 19 LEU HD11 1.0 . 5.44 1100 692 A 52 GLN HB3 B 19 LEU HD11 1.0 . 5.44 1101 692 B 19 LEU HD21 A 52 GLN HB2 1.0 . 5.44 1102 692 B 19 LEU HD21 A 52 GLN HB3 1.0 . 5.44 1103 693 A 53 ALA HA A 52 GLN HB2 1.0 . 5.50 1104 693 A 52 GLN HB3 A 53 ALA HA 1.0 . 5.50 1105 694 A 52 GLN HG3 B 18 ARG HBx 1.0 . 5.02 1106 694 A 52 GLN HG2 B 18 ARG HBx 1.0 . 5.02 1107 694 B 18 ARG HBy A 52 GLN HG2 1.0 . 5.02 1108 694 A 52 GLN HG3 B 18 ARG HBy 1.0 . 5.02 1109 695 A 53 ALA H A 52 GLN HG2 1.0 . 5.50 1110 695 A 52 GLN HG3 A 53 ALA H 1.0 . 5.50 1111 696 A 53 ALA HB% A 54 THR HA 1.0 . 4.83 1112 697 A 53 ALA HB% A 54 THR H 1.0 . 5.02 1113 698 A 53 ALA HB% A 55 TRP H 1.0 . 5.50 1114 699 A 54 THR HA A 54 THR HG2% 1.0 . 3.92 1115 700 A 54 THR HB A 55 TRP HB2 1.0 . 5.30 1116 700 A 54 THR HB A 55 TRP HB3 1.0 . 5.30 1117 701 A 55 TRP HA A 56 VAL HA 1.0 . 5.50 1118 702 A 55 TRP H A 55 TRP HD1 1.0 . 4.80 1119 703 A 55 TRP H A 55 TRP HB2 1.0 . 3.97 1120 703 A 55 TRP H A 55 TRP HB3 1.0 . 3.97 1121 704 A 55 TRP HB3 A 56 VAL HGx% 1.0 . 4.96 1122 704 A 55 TRP HB2 A 56 VAL HGx% 1.0 . 4.96 1123 704 A 56 VAL HG21 A 55 TRP HB2 1.0 . 4.96 1124 704 A 56 VAL HG21 A 55 TRP HB3 1.0 . 4.96 1125 705 A 58 ASP H A 57 ARG HG2 1.0 . 4.20 1126 705 A 57 ARG HG3 A 58 ASP H 1.0 . 4.20 1127 706 A 59 VAL H A 57 ARG HG2 1.0 . 5.20 1128 706 A 57 ARG HG3 A 59 VAL H 1.0 . 5.20 1129 707 A 59 VAL H A 58 ASP HA 1.0 . 3.46 1130 708 A 58 ASP H A 59 VAL H 1.0 . 4.83 1131 709 A 59 VAL H A 58 ASP HBy 1.0 . 4.22 1132 709 A 59 VAL H A 58 ASP HBx 1.0 . 4.22 1133 710 A 59 VAL HA A 60 VAL H 1.0 . 3.42 1134 711 A 59 VAL H A 59 VAL HB 1.0 . 3.66 1135 712 A 60 VAL H A 59 VAL HGx% 1.0 . 3.75 1136 712 A 60 VAL H A 59 VAL HG21 1.0 . 3.75 1137 713 A 60 VAL H A 60 VAL HB 1.0 . 3.63 1138 714 B 4 GLU HBx B 4 GLU HGx 1.0 . 2.94 1139 714 B 4 GLU HBx B 4 GLU HGy 1.0 . 2.94 1140 715 B 4 GLU HBy B 4 GLU HGx 1.0 . 2.94 1141 715 B 4 GLU HGy B 4 GLU HBy 1.0 . 2.94 1142 716 B 5 VAL HA B 5 VAL HG11 1.0 . 3.03 1143 716 B 5 VAL HA B 5 VAL HG21 1.0 . 3.03 1144 717 B 7 ASP H B 6 SER HBx 1.0 . 5.50 1145 717 B 6 SER HBy B 7 ASP H 1.0 . 5.50 1146 718 B 8 LYS HA B 8 LYS HDx 1.0 . 5.41 1147 718 B 8 LYS HA B 8 LYS HDy 1.0 . 5.41 1148 719 B 8 LYS HA B 8 LYS HEx 1.0 . 5.50 1149 719 B 8 LYS HA B 8 LYS HEy 1.0 . 5.50 1150 720 B 8 LYS HA B 9 ARG HGx 1.0 . 3.73 1151 720 B 8 LYS HA B 9 ARG HGy 1.0 . 3.73 1152 721 B 8 LYS HDy B 8 LYS HBx 1.0 . 3.05 1153 721 B 8 LYS HBx B 8 LYS HDx 1.0 . 3.05 1154 722 B 8 LYS HDy B 8 LYS HBy 1.0 . 3.05 1155 722 B 8 LYS HBy B 8 LYS HDx 1.0 . 3.05 1156 723 B 8 LYS H B 8 LYS HGx 1.0 . 4.36 1157 723 B 8 LYS H B 8 LYS HGy 1.0 . 4.36 1158 724 B 8 LYS HBy B 8 LYS HDx 1.0 . 2.55 1159 724 B 8 LYS HBx B 8 LYS HDx 1.0 . 2.55 1160 724 B 8 LYS HDy B 8 LYS HBy 1.0 . 2.55 1161 724 B 8 LYS HDy B 8 LYS HBx 1.0 . 2.55 1162 725 B 8 LYS HBx B 8 LYS HEx 1.0 . 3.82 1163 725 B 8 LYS HBy B 8 LYS HEx 1.0 . 3.82 1164 725 B 8 LYS HEy B 8 LYS HBy 1.0 . 3.82 1165 725 B 8 LYS HEy B 8 LYS HBx 1.0 . 3.82 1166 726 B 9 ARG HA B 8 LYS HBy 1.0 . 5.34 1167 726 B 8 LYS HBx B 9 ARG HA 1.0 . 5.34 1168 727 B 8 LYS HDx B 8 LYS HEx 1.0 . 2.70 1169 727 B 8 LYS HEy B 8 LYS HDx 1.0 . 2.70 1170 727 B 8 LYS HDy B 8 LYS HEy 1.0 . 2.70 1171 727 B 8 LYS HDy B 8 LYS HEx 1.0 . 2.70 1172 728 B 8 LYS HEx B 8 LYS HGx 1.0 . 4.10 1173 728 B 8 LYS HEy B 8 LYS HGx 1.0 . 4.10 1174 728 B 8 LYS HGy B 8 LYS HEx 1.0 . 4.10 1175 728 B 8 LYS HEy B 8 LYS HGy 1.0 . 4.10 1176 729 B 9 ARG HA B 9 ARG HDx 1.0 . 4.10 1177 729 B 9 ARG HA B 9 ARG HDy 1.0 . 4.10 1178 730 B 9 ARG HA B 9 ARG HGx 1.0 . 4.00 1179 730 B 9 ARG HGy B 9 ARG HA 1.0 . 4.00 1180 731 B 49 ALA H B 9 ARG HA 1.0 . 5.20 1181 732 B 9 ARG HA B 50 ASP HA 1.0 . 5.28 1182 733 B 50 ASP H B 9 ARG HA 1.0 . 5.50 1183 734 B 9 ARG HBx B 9 ARG HDx 1.0 . 3.76 1184 734 B 9 ARG HBy B 9 ARG HDx 1.0 . 3.76 1185 734 B 9 ARG HDy B 9 ARG HBx 1.0 . 3.76 1186 734 B 9 ARG HDy B 9 ARG HBy 1.0 . 3.76 1187 735 B 9 ARG HBx B 9 ARG HGx 1.0 . 2.53 1188 735 B 9 ARG HBy B 9 ARG HGx 1.0 . 2.53 1189 735 B 9 ARG HGy B 9 ARG HBx 1.0 . 2.53 1190 735 B 9 ARG HGy B 9 ARG HBy 1.0 . 2.53 1191 736 B 10 THR H B 9 ARG HBx 1.0 . 4.42 1192 736 B 10 THR H B 9 ARG HBy 1.0 . 4.42 1193 737 B 10 THR HG21 B 9 ARG HBx 1.0 . 5.09 1194 737 B 9 ARG HBy B 10 THR HG21 1.0 . 5.09 1195 738 B 48 CYS HA B 9 ARG HBx 1.0 . 5.50 1196 738 B 9 ARG HBy B 48 CYS HA 1.0 . 5.50 1197 739 B 49 ALA H B 9 ARG HBx 1.0 . 5.28 1198 739 B 49 ALA H B 9 ARG HBy 1.0 . 5.28 1199 740 B 50 ASP HA B 9 ARG HBx 1.0 . 5.50 1200 740 B 50 ASP HA B 9 ARG HBy 1.0 . 5.50 1201 741 B 50 ASP H B 9 ARG HBx 1.0 . 4.77 1202 741 B 50 ASP H B 9 ARG HBy 1.0 . 4.77 1203 742 B 10 THR H B 9 ARG HGx 1.0 . 4.78 1204 742 B 10 THR H B 9 ARG HGy 1.0 . 4.78 1205 743 B 49 ALA H B 9 ARG HGx 1.0 . 5.39 1206 743 B 49 ALA H B 9 ARG HGy 1.0 . 5.39 1207 744 B 50 ASP HA B 9 ARG HGx 1.0 . 5.50 1208 744 B 9 ARG HGy B 50 ASP HA 1.0 . 5.50 1209 745 B 10 THR HB B 11 CYS H 1.0 . 5.22 1210 746 B 49 ALA H B 10 THR HB 1.0 . 5.17 1211 747 B 10 THR H B 49 ALA HA 1.0 . 5.50 1212 748 B 10 THR H B 49 ALA H 1.0 . 4.95 1213 749 B 11 CYS CB B 48 CYS SG 1.0 . 3.10 1214 750 B 11 CYS HA B 47 VAL H 1.0 . 5.50 1215 751 B 11 CYS HA B 47 VAL HG11 1.0 . 5.10 1216 751 B 11 CYS HA B 47 VAL HG21 1.0 . 5.10 1217 752 B 11 CYS HA B 48 CYS HA 1.0 . 4.35 1218 753 B 48 CYS H B 11 CYS HA 1.0 . 5.39 1219 754 B 11 CYS HA B 48 CYS HBx 1.0 . 5.50 1220 754 B 11 CYS HA B 48 CYS HBy 1.0 . 5.50 1221 755 B 11 CYS HA B 49 ALA H 1.0 . 4.26 1222 756 B 12 VAL H B 11 CYS HBx 1.0 . 4.61 1223 757 B 46 LYS HGy B 11 CYS HBx 1.0 . 5.06 1224 757 B 11 CYS HBx B 46 LYS HGx 1.0 . 5.06 1225 758 B 48 CYS HA B 11 CYS HBx 1.0 . 5.50 1226 759 B 49 ALA H B 11 CYS HBx 1.0 . 5.50 1227 760 B 12 VAL H B 11 CYS HBy 1.0 . 4.61 1228 761 B 46 LYS HGy B 11 CYS HBy 1.0 . 5.06 1229 761 B 11 CYS HBy B 46 LYS HGx 1.0 . 5.06 1230 762 B 48 CYS HA B 11 CYS HBy 1.0 . 5.50 1231 763 B 49 ALA H B 11 CYS HBy 1.0 . 5.50 1232 764 B 11 CYS H B 12 VAL H 1.0 . 5.41 1233 765 B 11 CYS H B 47 VAL HG11 1.0 . 5.44 1234 765 B 11 CYS H B 47 VAL HG21 1.0 . 5.44 1235 766 B 49 ALA H B 11 CYS H 1.0 . 5.50 1236 767 B 49 ALA HB1 B 11 CYS H 1.0 . 5.50 1237 768 B 12 VAL H B 11 CYS HBy 1.0 . 3.98 1238 768 B 12 VAL H B 11 CYS HBx 1.0 . 3.98 1239 769 B 49 ALA H B 11 CYS HBy 1.0 . 4.78 1240 769 B 49 ALA H B 11 CYS HBx 1.0 . 4.78 1241 770 B 11 CYS SG B 48 CYS CB 1.0 . 3.10 1242 771 B 48 CYS SG B 11 CYS SG 1.0 . 2.10 1243 772 B 12 VAL HA B 13 SER HBx 1.0 . 4.49 1244 772 B 12 VAL HA B 13 SER HBy 1.0 . 4.49 1245 773 B 12 VAL HA B 46 LYS HDx 1.0 . 4.89 1246 773 B 12 VAL HA B 46 LYS HDy 1.0 . 4.89 1247 774 B 12 VAL HB B 13 SER H 1.0 . 4.54 1248 775 B 12 VAL H B 12 VAL HG11 1.0 . 3.98 1249 775 B 12 VAL H B 12 VAL HG21 1.0 . 3.98 1250 776 B 12 VAL H B 13 SER H 1.0 . 5.16 1251 777 B 12 VAL H B 46 LYS HA 1.0 . 5.25 1252 778 B 12 VAL H B 46 LYS HDx 1.0 . 4.86 1253 778 B 12 VAL H B 46 LYS HDy 1.0 . 4.86 1254 779 B 12 VAL H B 46 LYS HEx 1.0 . 5.27 1255 779 B 12 VAL H B 46 LYS HEy 1.0 . 5.27 1256 780 B 12 VAL H B 46 LYS HGx 1.0 . 4.98 1257 780 B 12 VAL H B 46 LYS HGy 1.0 . 4.98 1258 781 B 12 VAL H B 47 VAL HB 1.0 . 5.08 1259 782 B 48 CYS HA B 12 VAL H 1.0 . 4.49 1260 783 B 49 ALA H B 12 VAL H 1.0 . 5.19 1261 784 B 13 SER H B 12 VAL HG11 1.0 . 4.25 1262 784 B 13 SER H B 12 VAL HG21 1.0 . 4.25 1263 785 B 12 VAL HG11 B 13 SER HBx 1.0 . 4.37 1264 785 B 12 VAL HG21 B 13 SER HBx 1.0 . 4.37 1265 785 B 13 SER HBy B 12 VAL HG11 1.0 . 4.37 1266 785 B 13 SER HBy B 12 VAL HG21 1.0 . 4.37 1267 786 B 13 SER H B 14 LEU H 1.0 . 4.62 1268 787 B 13 SER H B 46 LYS HA 1.0 . 4.96 1269 788 B 13 SER H B 46 LYS HGx 1.0 . 5.50 1270 788 B 46 LYS HGy B 13 SER H 1.0 . 5.50 1271 789 B 14 LEU H B 13 SER HBx 1.0 . 4.28 1272 789 B 13 SER HBy B 14 LEU H 1.0 . 4.28 1273 790 B 15 THR HG21 B 13 SER HBx 1.0 . 4.99 1274 790 B 13 SER HBy B 15 THR HG21 1.0 . 4.99 1275 791 B 45 LEU H B 13 SER HBx 1.0 . 5.50 1276 791 B 13 SER HBy B 45 LEU H 1.0 . 5.50 1277 792 B 13 SER HBx B 46 LYS HBx 1.0 . 5.13 1278 792 B 13 SER HBy B 46 LYS HBx 1.0 . 5.13 1279 792 B 46 LYS HBy B 13 SER HBx 1.0 . 5.13 1280 792 B 13 SER HBy B 46 LYS HBy 1.0 . 5.13 1281 793 B 13 SER HBx B 46 LYS HDx 1.0 . 4.48 1282 793 B 13 SER HBy B 46 LYS HDx 1.0 . 4.48 1283 793 B 46 LYS HDy B 13 SER HBx 1.0 . 4.48 1284 793 B 13 SER HBy B 46 LYS HDy 1.0 . 4.48 1285 794 B 13 SER HBy B 46 LYS HEx 1.0 . 5.50 1286 794 B 13 SER HBx B 46 LYS HEx 1.0 . 5.50 1287 794 B 46 LYS HEy B 13 SER HBx 1.0 . 5.50 1288 794 B 13 SER HBy B 46 LYS HEy 1.0 . 5.50 1289 795 B 47 VAL H B 13 SER HBx 1.0 . 5.26 1290 795 B 47 VAL H B 13 SER HBy 1.0 . 5.26 1291 796 B 14 LEU H B 14 LEU HG 1.0 . 4.49 1292 797 B 14 LEU H B 14 LEU HD11 1.0 . 4.60 1293 797 B 14 LEU H B 14 LEU HD21 1.0 . 4.60 1294 798 B 14 LEU H B 45 LEU H 1.0 . 4.88 1295 799 B 14 LEU H B 45 LEU HBx 1.0 . 5.50 1296 799 B 14 LEU H B 45 LEU HBy 1.0 . 5.50 1297 800 B 46 LYS HA B 14 LEU H 1.0 . 3.74 1298 801 B 14 LEU H B 46 LYS H 1.0 . 4.97 1299 802 B 45 LEU H B 14 LEU HBx 1.0 . 4.63 1300 802 B 14 LEU HBy B 45 LEU H 1.0 . 4.63 1301 803 B 16 THR H B 14 LEU HD11 1.0 . 5.44 1302 803 B 14 LEU HD21 B 16 THR H 1.0 . 5.44 1303 804 B 46 LYS HA B 14 LEU HD11 1.0 . 5.13 1304 804 B 46 LYS HA B 14 LEU HD21 1.0 . 5.13 1305 805 B 16 THR H B 15 THR HB 1.0 . 4.91 1306 806 B 15 THR HG21 B 16 THR H 1.0 . 4.94 1307 807 B 16 THR HG21 B 16 THR HA 1.0 . 4.05 1308 808 B 16 THR HB B 17 GLN H 1.0 . 4.23 1309 809 B 16 THR HG21 B 16 THR H 1.0 . 4.89 1310 810 B 16 THR H B 44 GLY HAx 1.0 . 5.50 1311 811 B 16 THR H B 44 GLY HAy 1.0 . 5.50 1312 812 B 16 THR H B 44 GLY HAy 1.0 . 4.81 1313 812 B 16 THR H B 44 GLY HAx 1.0 . 4.81 1314 813 B 45 LEU H B 16 THR H 1.0 . 4.48 1315 814 B 16 THR HG21 B 17 GLN H 1.0 . 4.81 1316 815 B 16 THR HG21 B 18 ARG HBx 1.0 . 5.50 1317 815 B 16 THR HG21 B 18 ARG HBy 1.0 . 5.50 1318 816 B 16 THR HG21 B 44 GLY HAy 1.0 . 4.83 1319 816 B 16 THR HG21 B 44 GLY HAx 1.0 . 4.83 1320 817 B 16 THR HG21 B 45 LEU HBx 1.0 . 4.82 1321 817 B 16 THR HG21 B 45 LEU HBy 1.0 . 4.82 1322 818 B 17 GLN HGy B 17 GLN HBx 1.0 . 2.82 1323 818 B 17 GLN HBx B 17 GLN HGx 1.0 . 2.82 1324 819 B 17 GLN HGy B 17 GLN HBy 1.0 . 2.82 1325 819 B 17 GLN HBy B 17 GLN HGx 1.0 . 2.82 1326 820 B 17 GLN H B 17 GLN HGx 1.0 . 5.21 1327 820 B 17 GLN H B 17 GLN HGy 1.0 . 5.21 1328 821 B 17 GLN H B 18 ARG HBx 1.0 . 5.21 1329 821 B 18 ARG HBy B 17 GLN H 1.0 . 5.21 1330 822 B 17 GLN HBy B 17 GLN HGx 1.0 . 2.42 1331 822 B 17 GLN HBx B 17 GLN HGx 1.0 . 2.42 1332 822 B 17 GLN HGy B 17 GLN HBy 1.0 . 2.42 1333 822 B 17 GLN HGy B 17 GLN HBx 1.0 . 2.42 1334 823 B 18 ARG H B 17 GLN HBy 1.0 . 4.18 1335 823 B 17 GLN HBx B 18 ARG H 1.0 . 4.18 1336 824 B 18 ARG HA B 17 GLN HGx 1.0 . 4.20 1337 824 B 17 GLN HGy B 18 ARG HA 1.0 . 4.20 1338 825 B 18 ARG H B 17 GLN HGx 1.0 . 4.69 1339 825 B 17 GLN HGy B 18 ARG H 1.0 . 4.69 1340 826 B 17 GLN HGx B 18 ARG HBx 1.0 . 5.49 1341 826 B 17 GLN HGy B 18 ARG HBx 1.0 . 5.49 1342 826 B 18 ARG HBy B 17 GLN HGx 1.0 . 5.49 1343 826 B 18 ARG HBy B 17 GLN HGy 1.0 . 5.49 1344 827 B 18 ARG HA B 18 ARG HDx 1.0 . 3.80 1345 827 B 18 ARG HA B 18 ARG HDy 1.0 . 3.80 1346 828 B 18 ARG HA B 19 LEU HG 1.0 . 5.50 1347 829 B 18 ARG HA B 19 LEU HBx 1.0 . 5.20 1348 829 B 18 ARG HA B 19 LEU HBy 1.0 . 5.20 1349 830 B 18 ARG HA B 19 LEU HD11 1.0 . 5.40 1350 830 B 19 LEU HD21 B 18 ARG HA 1.0 . 5.40 1351 831 B 18 ARG H B 18 ARG HBx 1.0 . 3.55 1352 831 B 18 ARG HBy B 18 ARG H 1.0 . 3.55 1353 832 B 18 ARG H B 18 ARG HDx 1.0 . 5.34 1354 832 B 18 ARG H B 18 ARG HDy 1.0 . 5.34 1355 833 B 18 ARG H B 18 ARG HGx 1.0 . 5.50 1356 833 B 18 ARG H B 18 ARG HGy 1.0 . 5.50 1357 834 B 18 ARG H B 19 LEU H 1.0 . 5.08 1358 835 B 18 ARG HBx B 18 ARG HDx 1.0 . 3.15 1359 835 B 18 ARG HBy B 18 ARG HDx 1.0 . 3.15 1360 835 B 18 ARG HDy B 18 ARG HBx 1.0 . 3.15 1361 835 B 18 ARG HBy B 18 ARG HDy 1.0 . 3.15 1362 836 B 19 LEU HA B 18 ARG HBx 1.0 . 5.47 1363 836 B 18 ARG HBy B 19 LEU HA 1.0 . 5.47 1364 837 B 19 LEU H B 18 ARG HBx 1.0 . 4.30 1365 837 B 18 ARG HBy B 19 LEU H 1.0 . 4.30 1366 838 B 18 ARG HBx B 19 LEU HD11 1.0 . 4.47 1367 838 B 19 LEU HD21 B 18 ARG HBx 1.0 . 4.47 1368 838 B 19 LEU HD21 B 18 ARG HBy 1.0 . 4.47 1369 838 B 18 ARG HBy B 19 LEU HD11 1.0 . 4.47 1370 839 B 44 GLY H B 18 ARG HBx 1.0 . 5.00 1371 839 B 18 ARG HBy B 44 GLY H 1.0 . 5.00 1372 840 B 19 LEU H B 18 ARG HDx 1.0 . 5.50 1373 840 B 18 ARG HDy B 19 LEU H 1.0 . 5.50 1374 841 B 44 GLY H B 18 ARG HDx 1.0 . 5.50 1375 841 B 18 ARG HDy B 44 GLY H 1.0 . 5.50 1376 842 B 44 GLY H B 18 ARG HGx 1.0 . 5.04 1377 842 B 18 ARG HGy B 44 GLY H 1.0 . 5.04 1378 843 B 18 ARG HGx B 44 GLY HAy 1.0 . 5.17 1379 843 B 18 ARG HGy B 44 GLY HAy 1.0 . 5.17 1380 843 B 44 GLY HAx B 18 ARG HGx 1.0 . 5.17 1381 843 B 44 GLY HAx B 18 ARG HGy 1.0 . 5.17 1382 844 B 45 LEU H B 18 ARG HGx 1.0 . 4.55 1383 844 B 45 LEU H B 18 ARG HGy 1.0 . 4.55 1384 845 B 19 LEU HA B 19 LEU HD11 1.0 . 5.17 1385 846 B 19 LEU HD21 B 19 LEU HA 1.0 . 5.17 1386 847 B 19 LEU HA B 19 LEU HD11 1.0 . 4.13 1387 847 B 19 LEU HD21 B 19 LEU HA 1.0 . 4.13 1388 848 B 19 LEU HG B 19 LEU H 1.0 . 5.50 1389 849 B 19 LEU H B 19 LEU HD11 1.0 . 5.31 1390 850 B 19 LEU HD21 B 19 LEU H 1.0 . 5.31 1391 851 B 19 LEU H B 19 LEU HD11 1.0 . 4.67 1392 851 B 19 LEU HD21 B 19 LEU H 1.0 . 4.67 1393 852 B 19 LEU HBy B 20 PRO HDx 1.0 . 4.21 1394 852 B 19 LEU HBx B 20 PRO HDx 1.0 . 4.21 1395 852 B 20 PRO HDy B 19 LEU HBx 1.0 . 4.21 1396 852 B 19 LEU HBy B 20 PRO HDy 1.0 . 4.21 1397 853 B 19 LEU HD21 B 20 PRO HDx 1.0 . 3.96 1398 853 B 19 LEU HD11 B 20 PRO HDx 1.0 . 3.96 1399 853 B 20 PRO HDy B 19 LEU HD11 1.0 . 3.96 1400 853 B 19 LEU HD21 B 20 PRO HDy 1.0 . 3.96 1401 854 B 19 LEU HD21 B 20 PRO HGx 1.0 . 4.92 1402 854 B 19 LEU HD11 B 20 PRO HGx 1.0 . 4.92 1403 854 B 20 PRO HGy B 19 LEU HD11 1.0 . 4.92 1404 854 B 19 LEU HD21 B 20 PRO HGy 1.0 . 4.92 1405 855 B 20 PRO HA B 21 VAL HB 1.0 . 4.98 1406 856 B 20 PRO HA B 21 VAL HG21 1.0 . 4.77 1407 856 B 20 PRO HA B 21 VAL HG11 1.0 . 4.77 1408 857 B 21 VAL H B 20 PRO HDx 1.0 . 5.47 1409 858 B 20 PRO HDy B 21 VAL H 1.0 . 5.47 1410 859 B 21 VAL H B 20 PRO HGx 1.0 . 4.87 1411 859 B 20 PRO HGy B 21 VAL H 1.0 . 4.87 1412 860 B 21 VAL HG11 B 21 VAL H 1.0 . 4.03 1413 861 B 21 VAL H B 21 VAL HG21 1.0 . 4.03 1414 862 B 21 VAL H B 21 VAL HG21 1.0 . 3.41 1415 862 B 21 VAL HG11 B 21 VAL H 1.0 . 3.41 1416 863 B 21 VAL H B 42 LYS H 1.0 . 5.50 1417 864 B 41 THR HA B 21 VAL HG21 1.0 . 4.95 1418 864 B 21 VAL HG11 B 41 THR HA 1.0 . 4.95 1419 865 B 42 LYS H B 21 VAL HG21 1.0 . 5.38 1420 865 B 21 VAL HG11 B 42 LYS H 1.0 . 5.38 1421 866 B 43 ARG H B 21 VAL HG21 1.0 . 5.44 1422 866 B 21 VAL HG11 B 43 ARG H 1.0 . 5.44 1423 867 B 23 ARG HA B 23 ARG HDx 1.0 . 3.71 1424 867 B 23 ARG HA B 23 ARG HDy 1.0 . 3.71 1425 868 B 23 ARG HA B 24 ILE H 1.0 . 3.37 1426 869 B 23 ARG H B 23 ARG HGx 1.0 . 5.50 1427 869 B 23 ARG H B 23 ARG HGy 1.0 . 5.50 1428 870 B 24 ILE H B 23 ARG H 1.0 . 4.79 1429 871 B 23 ARG HBx B 23 ARG HDx 1.0 . 3.32 1430 871 B 23 ARG HBy B 23 ARG HDx 1.0 . 3.32 1431 871 B 23 ARG HDy B 23 ARG HBx 1.0 . 3.32 1432 871 B 23 ARG HDy B 23 ARG HBy 1.0 . 3.32 1433 872 B 23 ARG HBx B 24 ILE HG1y 1.0 . 5.18 1434 872 B 23 ARG HBy B 24 ILE HG1y 1.0 . 5.18 1435 872 B 24 ILE HG1x B 23 ARG HBx 1.0 . 5.18 1436 872 B 23 ARG HBy B 24 ILE HG1x 1.0 . 5.18 1437 873 B 24 ILE H B 23 ARG HDx 1.0 . 5.43 1438 873 B 23 ARG HDy B 24 ILE H 1.0 . 5.43 1439 874 B 23 ARG HDy B 23 ARG HGx 1.0 . 2.75 1440 874 B 23 ARG HDx B 23 ARG HGx 1.0 . 2.75 1441 874 B 23 ARG HGy B 23 ARG HDx 1.0 . 2.75 1442 874 B 23 ARG HDy B 23 ARG HGy 1.0 . 2.75 1443 875 B 24 ILE HA B 24 ILE HD11 1.0 . 3.54 1444 876 B 24 ILE HA B 24 ILE HG1y 1.0 . 3.71 1445 876 B 24 ILE HG1x B 24 ILE HA 1.0 . 3.71 1446 877 B 24 ILE HA B 24 ILE HG21 1.0 . 3.57 1447 878 B 24 ILE HA B 25 LYS H 1.0 . 3.40 1448 879 B 24 ILE HA B 25 LYS HBx 1.0 . 5.50 1449 879 B 24 ILE HA B 25 LYS HBy 1.0 . 5.50 1450 880 B 24 ILE HA B 40 ILE HB 1.0 . 5.50 1451 881 B 24 ILE HA B 40 ILE H 1.0 . 5.36 1452 882 B 24 ILE HD11 B 24 ILE HB 1.0 . 3.42 1453 883 B 24 ILE HB B 25 LYS HA 1.0 . 5.50 1454 884 B 25 LYS H B 24 ILE HB 1.0 . 5.18 1455 885 B 24 ILE H B 24 ILE HB 1.0 . 3.48 1456 886 B 24 ILE H B 24 ILE HG1x 1.0 . 4.81 1457 887 B 24 ILE H B 24 ILE HG1y 1.0 . 4.81 1458 888 B 24 ILE H B 24 ILE HD11 1.0 . 4.01 1459 889 B 24 ILE H B 24 ILE HG1y 1.0 . 4.09 1460 889 B 24 ILE H B 24 ILE HG1x 1.0 . 4.09 1461 890 B 24 ILE H B 24 ILE HG21 1.0 . 4.61 1462 891 B 24 ILE H B 25 LYS H 1.0 . 4.99 1463 892 B 24 ILE H B 25 LYS HDx 1.0 . 4.60 1464 892 B 24 ILE H B 25 LYS HDy 1.0 . 4.60 1465 893 B 24 ILE HD11 B 25 LYS H 1.0 . 3.88 1466 894 B 24 ILE HD11 B 39 PHE HBy 1.0 . 5.26 1467 894 B 24 ILE HD11 B 39 PHE HBx 1.0 . 5.26 1468 895 B 24 ILE HD11 B 40 ILE HA 1.0 . 5.50 1469 896 B 42 LYS H B 24 ILE HD11 1.0 . 5.50 1470 897 B 25 LYS H B 24 ILE HG1y 1.0 . 5.32 1471 897 B 24 ILE HG1x B 25 LYS H 1.0 . 5.32 1472 898 B 41 THR HA B 24 ILE HG1y 1.0 . 5.13 1473 898 B 41 THR HA B 24 ILE HG1x 1.0 . 5.13 1474 899 B 24 ILE HG1x B 24 ILE HG21 1.0 . 3.70 1475 900 B 24 ILE HG21 B 24 ILE HG1y 1.0 . 3.70 1476 901 B 24 ILE HD11 B 24 ILE HG21 1.0 . 2.40 1477 902 B 24 ILE HG21 B 24 ILE HG1y 1.0 . 3.08 1478 902 B 24 ILE HG1x B 24 ILE HG21 1.0 . 3.08 1479 903 B 24 ILE HG21 B 25 LYS H 1.0 . 4.32 1480 904 B 24 ILE HG21 B 26 THR HA 1.0 . 5.50 1481 905 B 24 ILE HG21 B 26 THR HB 1.0 . 5.30 1482 906 B 24 ILE HG21 B 39 PHE HA 1.0 . 4.81 1483 907 B 24 ILE HG21 B 39 PHE HBy 1.0 . 4.89 1484 907 B 24 ILE HG21 B 39 PHE HBx 1.0 . 4.89 1485 908 B 24 ILE HG21 B 40 ILE H 1.0 . 4.90 1486 909 B 25 LYS HA B 25 LYS HDx 1.0 . 4.77 1487 909 B 25 LYS HA B 25 LYS HDy 1.0 . 4.77 1488 910 B 25 LYS HA B 25 LYS HEx 1.0 . 4.96 1489 910 B 25 LYS HA B 25 LYS HEy 1.0 . 4.96 1490 911 B 25 LYS HA B 25 LYS HGx 1.0 . 3.37 1491 911 B 25 LYS HGy B 25 LYS HA 1.0 . 3.37 1492 912 B 25 LYS HA B 26 THR HA 1.0 . 5.50 1493 913 B 25 LYS H B 25 LYS HBx 1.0 . 3.80 1494 913 B 25 LYS H B 25 LYS HBy 1.0 . 3.80 1495 914 B 25 LYS H B 26 THR H 1.0 . 4.69 1496 915 B 25 LYS H B 39 PHE HA 1.0 . 5.17 1497 916 B 25 LYS H B 40 ILE HB 1.0 . 4.35 1498 917 B 25 LYS H B 40 ILE H 1.0 . 4.61 1499 918 B 25 LYS H B 40 ILE HG1y 1.0 . 4.39 1500 918 B 40 ILE HG1x B 25 LYS H 1.0 . 4.39 1501 919 B 40 ILE HG21 B 25 LYS H 1.0 . 4.94 1502 920 B 41 THR HA B 25 LYS H 1.0 . 4.99 1503 921 B 25 LYS HBx B 25 LYS HDx 1.0 . 2.40 1504 921 B 25 LYS HBy B 25 LYS HDx 1.0 . 2.40 1505 921 B 25 LYS HDy B 25 LYS HBx 1.0 . 2.40 1506 921 B 25 LYS HBy B 25 LYS HDy 1.0 . 2.40 1507 922 B 25 LYS HBx B 25 LYS HEx 1.0 . 4.44 1508 922 B 25 LYS HBy B 25 LYS HEx 1.0 . 4.44 1509 922 B 25 LYS HEy B 25 LYS HBx 1.0 . 4.44 1510 922 B 25 LYS HBy B 25 LYS HEy 1.0 . 4.44 1511 923 B 26 THR HA B 25 LYS HBx 1.0 . 5.50 1512 923 B 25 LYS HBy B 26 THR HA 1.0 . 5.50 1513 924 B 26 THR H B 25 LYS HBx 1.0 . 3.90 1514 924 B 25 LYS HBy B 26 THR H 1.0 . 3.90 1515 925 B 27 TYR HE% B 25 LYS HBx 1.0 . 5.38 1516 925 B 27 TYR HE% B 25 LYS HBy 1.0 . 5.38 1517 926 B 40 ILE HB B 25 LYS HBx 1.0 . 4.30 1518 926 B 25 LYS HBy B 40 ILE HB 1.0 . 4.30 1519 927 B 40 ILE H B 25 LYS HBx 1.0 . 4.58 1520 927 B 25 LYS HBy B 40 ILE H 1.0 . 4.58 1521 928 B 26 THR H B 25 LYS HEx 1.0 . 5.50 1522 928 B 25 LYS HEy B 26 THR H 1.0 . 5.50 1523 929 B 26 THR HA B 26 THR HG21 1.0 . 3.71 1524 930 B 26 THR HA B 27 TYR H 1.0 . 3.52 1525 931 B 27 TYR HD% B 26 THR HA 1.0 . 5.50 1526 932 B 26 THR HA B 37 VAL HG11 1.0 . 5.50 1527 933 B 26 THR HA B 37 VAL HG21 1.0 . 5.50 1528 934 B 26 THR HA B 39 PHE HA 1.0 . 3.64 1529 935 B 26 THR HA B 39 PHE HBy 1.0 . 5.34 1530 935 B 39 PHE HBx B 26 THR HA 1.0 . 5.34 1531 936 B 40 ILE H B 26 THR HA 1.0 . 5.49 1532 937 B 26 THR HA B 40 ILE HG1y 1.0 . 5.34 1533 937 B 40 ILE HG1x B 26 THR HA 1.0 . 5.34 1534 938 B 26 THR HB B 27 TYR HA 1.0 . 5.50 1535 939 B 26 THR HB B 27 TYR H 1.0 . 4.82 1536 940 B 26 THR HB B 37 VAL HG21 1.0 . 5.11 1537 940 B 26 THR HB B 37 VAL HG11 1.0 . 5.11 1538 941 B 26 THR HB B 39 PHE HA 1.0 . 5.50 1539 942 B 26 THR HB B 39 PHE HE% 1.0 . 5.50 1540 943 B 26 THR HB B 26 THR H 1.0 . 4.14 1541 944 B 26 THR H B 26 THR HG21 1.0 . 4.33 1542 945 B 26 THR H B 27 TYR H 1.0 . 5.24 1543 946 B 26 THR HG21 B 27 TYR H 1.0 . 3.95 1544 947 B 39 PHE HA B 26 THR HG21 1.0 . 4.59 1545 948 B 26 THR HG21 B 39 PHE HE% 1.0 . 3.79 1546 949 B 38 ILE HB B 27 TYR HA 1.0 . 5.50 1547 950 B 27 TYR HBx B 28 THR H 1.0 . 4.83 1548 951 B 29 ILE HD11 B 27 TYR HBx 1.0 . 5.50 1549 952 B 38 ILE HB B 27 TYR HBx 1.0 . 5.50 1550 953 B 27 TYR HBx B 38 ILE H 1.0 . 5.46 1551 954 B 38 ILE HD11 B 27 TYR HBx 1.0 . 4.79 1552 955 B 38 ILE HG21 B 27 TYR HBx 1.0 . 5.42 1553 956 B 28 THR H B 27 TYR HBy 1.0 . 4.83 1554 957 B 29 ILE HD11 B 27 TYR HBy 1.0 . 5.50 1555 958 B 38 ILE HB B 27 TYR HBy 1.0 . 5.50 1556 959 B 38 ILE H B 27 TYR HBy 1.0 . 5.46 1557 960 B 38 ILE HD11 B 27 TYR HBy 1.0 . 4.79 1558 961 B 38 ILE HG21 B 27 TYR HBy 1.0 . 5.42 1559 962 B 27 TYR HD% B 27 TYR H 1.0 . 4.35 1560 963 B 27 TYR HE% B 27 TYR H 1.0 . 5.48 1561 964 B 27 TYR H B 28 THR H 1.0 . 4.77 1562 965 B 27 TYR H B 28 THR HG21 1.0 . 5.27 1563 966 B 27 TYR H B 37 VAL HG11 1.0 . 4.82 1564 967 B 27 TYR H B 37 VAL HG21 1.0 . 4.82 1565 968 B 38 ILE HB B 27 TYR H 1.0 . 4.47 1566 969 B 27 TYR H B 38 ILE HG1y 1.0 . 5.34 1567 969 B 38 ILE HG1x B 27 TYR H 1.0 . 5.34 1568 970 B 40 ILE H B 27 TYR H 1.0 . 5.50 1569 971 B 28 THR H B 27 TYR HBy 1.0 . 4.25 1570 971 B 27 TYR HBx B 28 THR H 1.0 . 4.25 1571 972 B 29 ILE HD11 B 27 TYR HBy 1.0 . 4.73 1572 972 B 29 ILE HD11 B 27 TYR HBx 1.0 . 4.73 1573 973 B 38 ILE HB B 27 TYR HBy 1.0 . 4.82 1574 973 B 38 ILE HB B 27 TYR HBx 1.0 . 4.82 1575 974 B 38 ILE H B 27 TYR HBy 1.0 . 4.70 1576 974 B 27 TYR HBx B 38 ILE H 1.0 . 4.70 1577 975 B 38 ILE HD11 B 27 TYR HBy 1.0 . 4.16 1578 975 B 38 ILE HD11 B 27 TYR HBx 1.0 . 4.16 1579 976 B 40 ILE HD11 B 27 TYR HBy 1.0 . 5.34 1580 976 B 27 TYR HBx B 40 ILE HD11 1.0 . 5.34 1581 977 B 27 TYR HD% B 28 THR H 1.0 . 5.00 1582 978 B 29 ILE HD11 B 27 TYR HD% 1.0 . 5.00 1583 979 B 38 ILE HB B 27 TYR HD% 1.0 . 5.50 1584 980 B 27 TYR HD% B 38 ILE H 1.0 . 5.50 1585 981 B 38 ILE HD11 B 27 TYR HD% 1.0 . 4.86 1586 982 B 38 ILE HG21 B 27 TYR HD% 1.0 . 5.16 1587 983 B 27 TYR HD% B 40 ILE HD11 1.0 . 4.56 1588 984 B 27 TYR HE% B 28 THR H 1.0 . 5.50 1589 985 B 38 ILE HG21 B 27 TYR HE% 1.0 . 5.50 1590 986 B 27 TYR HE% B 40 ILE HB 1.0 . 5.50 1591 987 B 27 TYR HE% B 40 ILE HD11 1.0 . 4.20 1592 988 B 27 TYR HE% B 40 ILE HG1y 1.0 . 5.34 1593 988 B 27 TYR HE% B 40 ILE HG1x 1.0 . 5.34 1594 989 B 28 THR HG21 B 28 THR HA 1.0 . 3.89 1595 990 B 28 THR HA B 37 VAL HA 1.0 . 4.82 1596 991 B 28 THR HA B 37 VAL HB 1.0 . 5.50 1597 992 B 37 VAL HG11 B 28 THR HA 1.0 . 4.85 1598 993 B 28 THR HA B 37 VAL HG21 1.0 . 4.85 1599 994 B 28 THR HA B 37 VAL HG21 1.0 . 4.17 1600 994 B 37 VAL HG11 B 28 THR HA 1.0 . 4.17 1601 995 B 38 ILE H B 28 THR HA 1.0 . 4.61 1602 996 B 38 ILE HD11 B 28 THR HA 1.0 . 5.20 1603 997 B 28 THR HB B 29 ILE H 1.0 . 4.69 1604 998 B 28 THR HB B 37 VAL HG21 1.0 . 5.44 1605 998 B 37 VAL HG11 B 28 THR HB 1.0 . 5.44 1606 999 B 28 THR H B 28 THR HG21 1.0 . 4.68 1607 1000 B 29 ILE HD11 B 28 THR H 1.0 . 5.50 1608 1001 B 28 THR H B 37 VAL HG21 1.0 . 5.44 1609 1001 B 37 VAL HG11 B 28 THR H 1.0 . 5.44 1610 1002 B 28 THR HG21 B 29 ILE H 1.0 . 3.94 1611 1003 B 28 THR HG21 B 37 VAL HB 1.0 . 5.11 1612 1004 B 29 ILE HD11 B 29 ILE HA 1.0 . 5.06 1613 1005 B 29 ILE HA B 30 THR H 1.0 . 3.36 1614 1006 B 29 ILE HD11 B 29 ILE HB 1.0 . 4.04 1615 1007 B 29 ILE HB B 30 THR H 1.0 . 4.79 1616 1008 B 29 ILE HB B 36 ALA H 1.0 . 4.46 1617 1009 B 29 ILE HB B 36 ALA HB1 1.0 . 4.24 1618 1010 B 29 ILE HB B 37 VAL HA 1.0 . 5.50 1619 1011 B 29 ILE HB B 29 ILE H 1.0 . 4.18 1620 1012 B 29 ILE HD11 B 29 ILE H 1.0 . 4.85 1621 1013 B 29 ILE H B 29 ILE HG1x 1.0 . 4.38 1622 1013 B 29 ILE HG1y B 29 ILE H 1.0 . 4.38 1623 1014 B 29 ILE HG21 B 29 ILE H 1.0 . 4.76 1624 1015 B 29 ILE H B 30 THR HB 1.0 . 5.50 1625 1016 B 29 ILE H B 30 THR H 1.0 . 5.02 1626 1017 B 29 ILE H B 35 ARG HA 1.0 . 5.50 1627 1018 B 36 ALA H B 29 ILE H 1.0 . 4.62 1628 1019 B 29 ILE HD11 B 30 THR H 1.0 . 5.13 1629 1020 B 29 ILE HD11 B 36 ALA H 1.0 . 5.50 1630 1021 B 29 ILE HD11 B 38 ILE HB 1.0 . 5.50 1631 1022 B 29 ILE HD11 B 38 ILE HG1y 1.0 . 4.96 1632 1022 B 29 ILE HD11 B 38 ILE HG1x 1.0 . 4.96 1633 1023 B 30 THR H B 29 ILE HG1x 1.0 . 5.34 1634 1023 B 29 ILE HG1y B 30 THR H 1.0 . 5.34 1635 1024 B 29 ILE HD11 B 29 ILE HG21 1.0 . 3.38 1636 1025 B 29 ILE HG21 B 29 ILE HG1x 1.0 . 3.16 1637 1025 B 29 ILE HG1y B 29 ILE HG21 1.0 . 3.16 1638 1026 B 29 ILE HG21 B 30 THR HB 1.0 . 5.50 1639 1027 B 29 ILE HG21 B 30 THR H 1.0 . 4.11 1640 1028 B 29 ILE HG21 B 31 GLU HGx 1.0 . 5.50 1641 1029 B 29 ILE HG21 B 31 GLU HGy 1.0 . 5.50 1642 1030 B 29 ILE HG21 B 36 ALA H 1.0 . 5.33 1643 1031 B 30 THR HA B 30 THR HG21 1.0 . 3.46 1644 1032 B 30 THR HA B 31 GLU H 1.0 . 3.28 1645 1033 B 30 THR HA B 34 LEU H 1.0 . 4.99 1646 1034 B 30 THR HA B 35 ARG HBy 1.0 . 5.20 1647 1034 B 30 THR HA B 35 ARG HBx 1.0 . 5.20 1648 1035 B 30 THR HA B 35 ARG HDx 1.0 . 5.12 1649 1035 B 30 THR HA B 35 ARG HDy 1.0 . 5.12 1650 1036 B 30 THR HA B 35 ARG HGx 1.0 . 4.58 1651 1036 B 30 THR HA B 35 ARG HGy 1.0 . 4.58 1652 1037 B 36 ALA H B 30 THR HA 1.0 . 5.50 1653 1038 B 30 THR HB B 31 GLU H 1.0 . 4.25 1654 1039 B 30 THR H B 30 THR HB 1.0 . 4.03 1655 1040 B 30 THR H B 30 THR HG21 1.0 . 4.30 1656 1041 B 36 ALA H B 30 THR H 1.0 . 5.50 1657 1042 B 30 THR HG21 B 31 GLU H 1.0 . 3.95 1658 1043 B 30 THR HG21 B 32 GLY H 1.0 . 5.50 1659 1044 B 31 GLU H B 31 GLU HBx 1.0 . 3.83 1660 1044 B 31 GLU HBy B 31 GLU H 1.0 . 3.83 1661 1045 B 31 GLU H B 31 GLU HGx 1.0 . 4.31 1662 1045 B 31 GLU HGy B 31 GLU H 1.0 . 4.31 1663 1046 B 31 GLU H B 32 GLY H 1.0 . 5.50 1664 1047 B 31 GLU H B 34 LEU HG 1.0 . 4.44 1665 1048 B 31 GLU H B 34 LEU H 1.0 . 4.32 1666 1049 B 31 GLU H B 34 LEU HBx 1.0 . 5.34 1667 1049 B 34 LEU HBy B 31 GLU H 1.0 . 5.34 1668 1050 B 35 ARG HA B 31 GLU H 1.0 . 5.50 1669 1051 B 31 GLU H B 35 ARG HDx 1.0 . 5.50 1670 1051 B 31 GLU H B 35 ARG HDy 1.0 . 5.50 1671 1052 B 36 ALA H B 31 GLU H 1.0 . 5.39 1672 1053 B 32 GLY H B 31 GLU HBx 1.0 . 5.45 1673 1053 B 31 GLU HBy B 32 GLY H 1.0 . 5.45 1674 1054 B 34 LEU H B 31 GLU HBx 1.0 . 4.61 1675 1054 B 31 GLU HBy B 34 LEU H 1.0 . 4.61 1676 1055 B 31 GLU HBy B 34 LEU HD11 1.0 . 4.50 1677 1055 B 34 LEU HD21 B 31 GLU HBx 1.0 . 4.50 1678 1055 B 31 GLU HBy B 34 LEU HD21 1.0 . 4.50 1679 1055 B 31 GLU HBx B 34 LEU HD11 1.0 . 4.50 1680 1056 B 31 GLU HGx B 32 GLY HAx 1.0 . 5.18 1681 1056 B 31 GLU HGy B 32 GLY HAx 1.0 . 5.18 1682 1056 B 32 GLY HAy B 31 GLU HGx 1.0 . 5.18 1683 1056 B 31 GLU HGy B 32 GLY HAy 1.0 . 5.18 1684 1057 B 33 SER H B 31 GLU HGx 1.0 . 5.21 1685 1057 B 31 GLU HGy B 33 SER H 1.0 . 5.21 1686 1058 B 31 GLU HGx B 34 LEU HD11 1.0 . 3.57 1687 1058 B 31 GLU HGy B 34 LEU HD11 1.0 . 3.57 1688 1058 B 34 LEU HD21 B 31 GLU HGx 1.0 . 3.57 1689 1058 B 34 LEU HD21 B 31 GLU HGy 1.0 . 3.57 1690 1059 B 34 LEU H B 32 GLY H 1.0 . 5.50 1691 1060 B 34 LEU H B 32 GLY HAx 1.0 . 4.08 1692 1060 B 34 LEU H B 32 GLY HAy 1.0 . 4.08 1693 1061 B 32 GLY HAx B 56 VAL HG11 1.0 . 5.28 1694 1061 B 32 GLY HAy B 56 VAL HG11 1.0 . 5.28 1695 1061 B 56 VAL HG21 B 32 GLY HAx 1.0 . 5.28 1696 1061 B 32 GLY HAy B 56 VAL HG21 1.0 . 5.28 1697 1062 B 33 SER HA B 56 VAL HB 1.0 . 3.85 1698 1063 B 33 SER H B 34 LEU HBx 1.0 . 5.34 1699 1063 B 34 LEU HBy B 33 SER H 1.0 . 5.34 1700 1064 B 34 LEU HA B 34 LEU HD11 1.0 . 4.64 1701 1065 B 34 LEU HD21 B 34 LEU HA 1.0 . 4.64 1702 1066 B 34 LEU HA B 34 LEU HD11 1.0 . 3.63 1703 1066 B 34 LEU HD21 B 34 LEU HA 1.0 . 3.63 1704 1067 B 52 GLN H B 34 LEU HA 1.0 . 3.79 1705 1068 B 34 LEU HG B 35 ARG H 1.0 . 4.02 1706 1069 B 34 LEU H B 34 LEU HG 1.0 . 3.89 1707 1070 B 34 LEU H B 34 LEU HBx 1.0 . 3.44 1708 1070 B 34 LEU HBy B 34 LEU H 1.0 . 3.44 1709 1071 B 52 GLN H B 34 LEU H 1.0 . 5.00 1710 1072 B 52 GLN H B 34 LEU HBx 1.0 . 4.11 1711 1072 B 52 GLN H B 34 LEU HBy 1.0 . 4.11 1712 1073 B 34 LEU HBy B 52 GLN HGx 1.0 . 5.34 1713 1073 B 34 LEU HBx B 52 GLN HGx 1.0 . 5.34 1714 1073 B 52 GLN HGy B 34 LEU HBx 1.0 . 5.34 1715 1073 B 52 GLN HGy B 34 LEU HBy 1.0 . 5.34 1716 1074 B 35 ARG H B 34 LEU HD11 1.0 . 4.18 1717 1074 B 34 LEU HD21 B 35 ARG H 1.0 . 4.18 1718 1075 B 36 ALA HA B 34 LEU HD11 1.0 . 5.42 1719 1075 B 36 ALA HA B 34 LEU HD21 1.0 . 5.42 1720 1076 B 36 ALA H B 34 LEU HD11 1.0 . 5.44 1721 1076 B 36 ALA H B 34 LEU HD21 1.0 . 5.44 1722 1077 B 50 ASP H B 34 LEU HD11 1.0 . 4.78 1723 1077 B 34 LEU HD21 B 50 ASP H 1.0 . 4.78 1724 1078 B 52 GLN H B 34 LEU HD11 1.0 . 5.36 1725 1078 B 52 GLN H B 34 LEU HD21 1.0 . 5.36 1726 1079 B 35 ARG HA B 35 ARG HDx 1.0 . 5.50 1727 1079 B 35 ARG HA B 35 ARG HDy 1.0 . 5.50 1728 1080 B 36 ALA H B 35 ARG HBx 1.0 . 4.87 1729 1081 B 36 ALA H B 35 ARG HBy 1.0 . 4.87 1730 1082 B 35 ARG H B 35 ARG HDx 1.0 . 5.50 1731 1082 B 35 ARG HDy B 35 ARG H 1.0 . 5.50 1732 1083 B 36 ALA H B 35 ARG H 1.0 . 5.25 1733 1084 B 36 ALA HB1 B 35 ARG H 1.0 . 5.32 1734 1085 B 50 ASP H B 35 ARG H 1.0 . 5.10 1735 1086 B 35 ARG H B 50 ASP HBy 1.0 . 5.34 1736 1086 B 35 ARG H B 50 ASP HBx 1.0 . 5.34 1737 1087 B 35 ARG H B 51 PRO HDx 1.0 . 5.35 1738 1087 B 51 PRO HDy B 35 ARG H 1.0 . 5.35 1739 1088 B 35 ARG H B 52 GLN HGx 1.0 . 5.50 1740 1088 B 52 GLN HGy B 35 ARG H 1.0 . 5.50 1741 1089 B 36 ALA HB1 B 35 ARG HBy 1.0 . 5.34 1742 1089 B 36 ALA HB1 B 35 ARG HBx 1.0 . 5.34 1743 1090 B 35 ARG HBy B 37 VAL HG21 1.0 . 4.98 1744 1090 B 35 ARG HBx B 37 VAL HG21 1.0 . 4.98 1745 1090 B 37 VAL HG11 B 35 ARG HBy 1.0 . 4.98 1746 1090 B 37 VAL HG11 B 35 ARG HBx 1.0 . 4.98 1747 1091 B 36 ALA H B 35 ARG HDx 1.0 . 5.50 1748 1091 B 36 ALA H B 35 ARG HDy 1.0 . 5.50 1749 1092 B 36 ALA HA B 37 VAL HA 1.0 . 5.50 1750 1093 B 36 ALA HA B 37 VAL HB 1.0 . 5.50 1751 1094 B 36 ALA HA B 37 VAL H 1.0 . 3.53 1752 1095 B 36 ALA HA B 37 VAL HG21 1.0 . 4.64 1753 1095 B 36 ALA HA B 37 VAL HG11 1.0 . 4.64 1754 1096 B 36 ALA HA B 48 CYS H 1.0 . 5.04 1755 1097 B 36 ALA HA B 49 ALA HA 1.0 . 4.32 1756 1098 B 36 ALA HA B 49 ALA HB1 1.0 . 4.45 1757 1099 B 36 ALA HA B 50 ASP H 1.0 . 4.56 1758 1100 B 36 ALA HA B 50 ASP HBy 1.0 . 5.34 1759 1100 B 36 ALA HA B 50 ASP HBx 1.0 . 5.34 1760 1101 B 36 ALA H B 36 ALA HB1 1.0 . 4.02 1761 1102 B 36 ALA H B 37 VAL HG21 1.0 . 5.44 1762 1102 B 36 ALA H B 37 VAL HG11 1.0 . 5.44 1763 1103 B 36 ALA HB1 B 37 VAL H 1.0 . 3.76 1764 1104 B 48 CYS H B 36 ALA HB1 1.0 . 5.02 1765 1105 B 36 ALA HB1 B 49 ALA HA 1.0 . 4.79 1766 1106 B 36 ALA HB1 B 50 ASP H 1.0 . 4.87 1767 1107 B 37 VAL HG11 B 37 VAL HA 1.0 . 3.99 1768 1108 B 37 VAL HA B 37 VAL HG21 1.0 . 3.99 1769 1109 B 38 ILE H B 37 VAL HB 1.0 . 4.86 1770 1110 B 39 PHE HE% B 37 VAL HB 1.0 . 4.89 1771 1111 B 48 CYS HA B 37 VAL HB 1.0 . 5.50 1772 1112 B 48 CYS H B 37 VAL HB 1.0 . 5.12 1773 1113 B 37 VAL HB B 48 CYS HBx 1.0 . 4.73 1774 1113 B 48 CYS HBy B 37 VAL HB 1.0 . 4.73 1775 1114 B 37 VAL HB B 37 VAL H 1.0 . 4.10 1776 1115 B 37 VAL HG11 B 37 VAL H 1.0 . 4.42 1777 1116 B 37 VAL H B 37 VAL HG21 1.0 . 4.42 1778 1117 B 37 VAL H B 37 VAL HG21 1.0 . 3.73 1779 1117 B 37 VAL HG11 B 37 VAL H 1.0 . 3.73 1780 1118 B 39 PHE HE% B 37 VAL H 1.0 . 5.50 1781 1119 B 48 CYS H B 37 VAL H 1.0 . 4.55 1782 1120 B 37 VAL H B 48 CYS HBx 1.0 . 4.72 1783 1120 B 48 CYS HBy B 37 VAL H 1.0 . 4.72 1784 1121 B 49 ALA HA B 37 VAL H 1.0 . 4.34 1785 1122 B 49 ALA H B 37 VAL H 1.0 . 5.19 1786 1123 B 49 ALA HB1 B 37 VAL H 1.0 . 4.64 1787 1124 B 50 ASP H B 37 VAL H 1.0 . 5.22 1788 1125 B 37 VAL HG11 B 38 ILE H 1.0 . 4.13 1789 1126 B 37 VAL HG11 B 39 PHE HE% 1.0 . 4.37 1790 1127 B 48 CYS H B 37 VAL HG11 1.0 . 5.30 1791 1128 B 38 ILE H B 37 VAL HG21 1.0 . 4.13 1792 1129 B 39 PHE HE% B 37 VAL HG21 1.0 . 4.37 1793 1130 B 48 CYS H B 37 VAL HG21 1.0 . 5.30 1794 1131 B 38 ILE HA B 37 VAL HG21 1.0 . 4.75 1795 1131 B 37 VAL HG11 B 38 ILE HA 1.0 . 4.75 1796 1132 B 39 PHE HA B 37 VAL HG21 1.0 . 4.58 1797 1132 B 39 PHE HA B 37 VAL HG11 1.0 . 4.58 1798 1133 B 39 PHE HE% B 37 VAL HG21 1.0 . 3.61 1799 1133 B 37 VAL HG11 B 39 PHE HE% 1.0 . 3.61 1800 1134 B 48 CYS H B 37 VAL HG21 1.0 . 4.64 1801 1134 B 48 CYS H B 37 VAL HG11 1.0 . 4.64 1802 1135 B 37 VAL HG21 B 48 CYS HBx 1.0 . 4.44 1803 1135 B 37 VAL HG11 B 48 CYS HBx 1.0 . 4.44 1804 1135 B 48 CYS HBy B 37 VAL HG21 1.0 . 4.44 1805 1135 B 48 CYS HBy B 37 VAL HG11 1.0 . 4.44 1806 1136 B 37 VAL HG21 B 50 ASP HBy 1.0 . 5.28 1807 1136 B 50 ASP HBx B 37 VAL HG21 1.0 . 5.28 1808 1136 B 37 VAL HG11 B 50 ASP HBx 1.0 . 5.28 1809 1136 B 37 VAL HG11 B 50 ASP HBy 1.0 . 5.28 1810 1137 B 38 ILE HD11 B 38 ILE HA 1.0 . 4.56 1811 1138 B 38 ILE HG21 B 38 ILE HA 1.0 . 4.19 1812 1139 B 46 LYS H B 38 ILE HA 1.0 . 4.98 1813 1140 B 38 ILE HA B 47 VAL HA 1.0 . 4.96 1814 1141 B 48 CYS H B 38 ILE HA 1.0 . 4.73 1815 1142 B 38 ILE HB B 38 ILE HD11 1.0 . 3.93 1816 1143 B 38 ILE HG1x B 39 PHE H 1.0 . 5.50 1817 1144 B 38 ILE HG1x B 48 CYS H 1.0 . 5.50 1818 1145 B 39 PHE H B 38 ILE HG1y 1.0 . 5.50 1819 1146 B 48 CYS H B 38 ILE HG1y 1.0 . 5.50 1820 1147 B 38 ILE HB B 38 ILE H 1.0 . 4.16 1821 1148 B 38 ILE HG1x B 38 ILE H 1.0 . 4.76 1822 1149 B 38 ILE H B 38 ILE HG1y 1.0 . 4.76 1823 1150 B 38 ILE HD11 B 38 ILE H 1.0 . 4.41 1824 1151 B 38 ILE H B 38 ILE HG1y 1.0 . 4.08 1825 1151 B 38 ILE HG1x B 38 ILE H 1.0 . 4.08 1826 1152 B 38 ILE HG21 B 38 ILE H 1.0 . 4.25 1827 1153 B 38 ILE H B 39 PHE H 1.0 . 5.38 1828 1154 B 40 ILE HD11 B 38 ILE H 1.0 . 5.50 1829 1155 B 39 PHE H B 38 ILE HG1y 1.0 . 4.66 1830 1155 B 38 ILE HG1x B 39 PHE H 1.0 . 4.66 1831 1156 B 47 VAL HA B 38 ILE HG1y 1.0 . 5.34 1832 1156 B 38 ILE HG1x B 47 VAL HA 1.0 . 5.34 1833 1157 B 47 VAL HB B 38 ILE HG1y 1.0 . 5.34 1834 1157 B 38 ILE HG1x B 47 VAL HB 1.0 . 5.34 1835 1158 B 38 ILE HG21 B 38 ILE HG1x 1.0 . 3.82 1836 1159 B 38 ILE HG21 B 38 ILE HG1y 1.0 . 3.82 1837 1160 B 38 ILE HD11 B 38 ILE HG21 1.0 . 2.78 1838 1161 B 38 ILE HG21 B 38 ILE HG1y 1.0 . 3.31 1839 1161 B 38 ILE HG21 B 38 ILE HG1x 1.0 . 3.31 1840 1162 B 38 ILE HG21 B 39 PHE H 1.0 . 3.99 1841 1163 B 38 ILE HG21 B 39 PHE HD% 1.0 . 5.50 1842 1164 B 38 ILE HG21 B 40 ILE HA 1.0 . 5.26 1843 1165 B 38 ILE HG21 B 40 ILE H 1.0 . 4.16 1844 1166 B 38 ILE HG21 B 46 LYS H 1.0 . 5.29 1845 1167 B 39 PHE HA B 39 PHE HE% 1.0 . 5.49 1846 1168 B 40 ILE HG1x B 39 PHE HA 1.0 . 5.50 1847 1169 B 39 PHE HA B 40 ILE HG1y 1.0 . 5.50 1848 1170 B 40 ILE H B 39 PHE HA 1.0 . 3.55 1849 1171 B 40 ILE HD11 B 39 PHE HA 1.0 . 5.17 1850 1172 B 40 ILE H B 39 PHE HBx 1.0 . 5.02 1851 1173 B 46 LYS H B 39 PHE HBx 1.0 . 5.07 1852 1174 B 46 LYS HBy B 39 PHE HBx 1.0 . 5.07 1853 1174 B 39 PHE HBx B 46 LYS HBx 1.0 . 5.07 1854 1175 B 40 ILE H B 39 PHE HBy 1.0 . 5.02 1855 1176 B 46 LYS H B 39 PHE HBy 1.0 . 5.07 1856 1177 B 46 LYS HBy B 39 PHE HBy 1.0 . 5.07 1857 1177 B 39 PHE HBy B 46 LYS HBx 1.0 . 5.07 1858 1178 B 39 PHE H B 39 PHE HD% 1.0 . 4.43 1859 1179 B 40 ILE HA B 39 PHE H 1.0 . 5.50 1860 1180 B 40 ILE H B 39 PHE H 1.0 . 5.39 1861 1181 B 39 PHE H B 45 LEU HA 1.0 . 5.20 1862 1182 B 39 PHE H B 45 LEU HD11 1.0 . 5.44 1863 1182 B 45 LEU HD21 B 39 PHE H 1.0 . 5.44 1864 1183 B 46 LYS H B 39 PHE H 1.0 . 4.60 1865 1184 B 39 PHE H B 46 LYS HBx 1.0 . 4.82 1866 1184 B 46 LYS HBy B 39 PHE H 1.0 . 4.82 1867 1185 B 39 PHE H B 46 LYS HGx 1.0 . 4.78 1868 1185 B 46 LYS HGy B 39 PHE H 1.0 . 4.78 1869 1186 B 47 VAL HA B 39 PHE H 1.0 . 4.65 1870 1187 B 48 CYS H B 39 PHE H 1.0 . 4.95 1871 1188 B 40 ILE H B 39 PHE HBy 1.0 . 4.29 1872 1188 B 40 ILE H B 39 PHE HBx 1.0 . 4.29 1873 1189 B 41 THR HG21 B 39 PHE HBy 1.0 . 5.32 1874 1189 B 39 PHE HBx B 41 THR HG21 1.0 . 5.32 1875 1190 B 46 LYS H B 39 PHE HBy 1.0 . 4.43 1876 1190 B 46 LYS H B 39 PHE HBx 1.0 . 4.43 1877 1191 B 39 PHE HBx B 46 LYS HDx 1.0 . 5.34 1878 1191 B 39 PHE HBy B 46 LYS HDx 1.0 . 5.34 1879 1191 B 46 LYS HDy B 39 PHE HBy 1.0 . 5.34 1880 1191 B 46 LYS HDy B 39 PHE HBx 1.0 . 5.34 1881 1192 B 40 ILE H B 39 PHE HD% 1.0 . 5.29 1882 1193 B 39 PHE HD% B 46 LYS HBx 1.0 . 5.40 1883 1193 B 46 LYS HBy B 39 PHE HD% 1.0 . 5.40 1884 1194 B 39 PHE HD% B 46 LYS HDx 1.0 . 4.86 1885 1194 B 46 LYS HDy B 39 PHE HD% 1.0 . 4.86 1886 1195 B 39 PHE HE% B 46 LYS HEx 1.0 . 4.92 1887 1195 B 46 LYS HEy B 39 PHE HE% 1.0 . 4.92 1888 1196 B 48 CYS H B 39 PHE HE% 1.0 . 5.30 1889 1197 B 40 ILE HD11 B 40 ILE HA 1.0 . 4.52 1890 1198 B 40 ILE HA B 40 ILE HG1y 1.0 . 3.55 1891 1198 B 40 ILE HG1x B 40 ILE HA 1.0 . 3.55 1892 1199 B 40 ILE HA B 41 THR HG21 1.0 . 4.35 1893 1200 B 40 ILE HA B 45 LEU HBx 1.0 . 5.50 1894 1200 B 45 LEU HBy B 40 ILE HA 1.0 . 5.50 1895 1201 B 40 ILE HA B 45 LEU HD11 1.0 . 4.71 1896 1201 B 45 LEU HD21 B 40 ILE HA 1.0 . 4.71 1897 1202 B 46 LYS H B 40 ILE HA 1.0 . 5.06 1898 1203 B 40 ILE HD11 B 40 ILE HB 1.0 . 3.81 1899 1204 B 40 ILE HB B 41 THR H 1.0 . 4.91 1900 1205 B 40 ILE HB B 40 ILE H 1.0 . 4.07 1901 1206 B 40 ILE HD11 B 40 ILE H 1.0 . 5.01 1902 1207 B 40 ILE H B 40 ILE HG1y 1.0 . 4.31 1903 1207 B 40 ILE HG1x B 40 ILE H 1.0 . 4.31 1904 1208 B 40 ILE HG21 B 40 ILE H 1.0 . 4.16 1905 1209 B 40 ILE HD11 B 41 THR H 1.0 . 5.05 1906 1210 B 41 THR H B 40 ILE HG1y 1.0 . 4.84 1907 1210 B 40 ILE HG1x B 41 THR H 1.0 . 4.84 1908 1211 B 40 ILE HG21 B 40 ILE HG1x 1.0 . 3.49 1909 1212 B 40 ILE HG21 B 40 ILE HG1y 1.0 . 3.49 1910 1213 B 40 ILE HD11 B 40 ILE HG21 1.0 . 2.55 1911 1214 B 40 ILE HG21 B 40 ILE HG1y 1.0 . 2.84 1912 1214 B 40 ILE HG21 B 40 ILE HG1x 1.0 . 2.84 1913 1215 B 40 ILE HG21 B 41 THR H 1.0 . 3.92 1914 1216 B 41 THR HG21 B 41 THR H 1.0 . 4.15 1915 1217 B 42 LYS H B 41 THR H 1.0 . 5.50 1916 1218 B 43 ARG H B 41 THR H 1.0 . 5.50 1917 1219 B 44 GLY H B 41 THR H 1.0 . 4.78 1918 1220 B 45 LEU HA B 41 THR H 1.0 . 4.76 1919 1221 B 41 THR H B 45 LEU HD11 1.0 . 4.49 1920 1221 B 45 LEU HD21 B 41 THR H 1.0 . 4.49 1921 1222 B 42 LYS H B 41 THR HG21 1.0 . 4.73 1922 1223 B 43 ARG H B 41 THR HG21 1.0 . 4.95 1923 1224 B 44 GLY H B 41 THR HG21 1.0 . 5.13 1924 1225 B 41 THR HG21 B 46 LYS HBx 1.0 . 5.50 1925 1225 B 46 LYS HBy B 41 THR HG21 1.0 . 5.50 1926 1226 B 44 GLY H B 42 LYS HA 1.0 . 4.15 1927 1227 B 42 LYS H B 42 LYS HDx 1.0 . 4.80 1928 1227 B 42 LYS H B 42 LYS HDy 1.0 . 4.80 1929 1228 B 42 LYS H B 42 LYS HEx 1.0 . 4.31 1930 1228 B 42 LYS H B 42 LYS HEy 1.0 . 4.31 1931 1229 B 42 LYS H B 43 ARG H 1.0 . 4.85 1932 1230 B 44 GLY H B 42 LYS H 1.0 . 5.49 1933 1231 B 43 ARG H B 42 LYS HBx 1.0 . 5.21 1934 1231 B 43 ARG H B 42 LYS HBy 1.0 . 5.21 1935 1232 B 43 ARG H B 42 LYS HEx 1.0 . 4.47 1936 1232 B 43 ARG H B 42 LYS HEy 1.0 . 4.47 1937 1233 B 44 GLY H B 42 LYS HEx 1.0 . 5.08 1938 1233 B 44 GLY H B 42 LYS HEy 1.0 . 5.08 1939 1234 B 43 ARG HA B 43 ARG HDx 1.0 . 4.97 1940 1234 B 43 ARG HA B 43 ARG HDy 1.0 . 4.97 1941 1235 B 44 GLY H B 43 ARG HBx 1.0 . 5.01 1942 1236 B 44 GLY H B 43 ARG HBy 1.0 . 5.01 1943 1237 B 43 ARG H B 43 ARG HBy 1.0 . 3.53 1944 1237 B 43 ARG H B 43 ARG HBx 1.0 . 3.53 1945 1238 B 43 ARG H B 43 ARG HDx 1.0 . 5.13 1946 1238 B 43 ARG H B 43 ARG HDy 1.0 . 5.13 1947 1239 B 44 GLY H B 43 ARG H 1.0 . 3.81 1948 1240 B 43 ARG H B 44 GLY HAy 1.0 . 5.34 1949 1240 B 44 GLY HAx B 43 ARG H 1.0 . 5.34 1950 1241 B 43 ARG HBx B 43 ARG HDx 1.0 . 3.41 1951 1241 B 43 ARG HBy B 43 ARG HDx 1.0 . 3.41 1952 1241 B 43 ARG HDy B 43 ARG HBy 1.0 . 3.41 1953 1241 B 43 ARG HDy B 43 ARG HBx 1.0 . 3.41 1954 1242 B 44 GLY H B 43 ARG HBy 1.0 . 4.14 1955 1242 B 44 GLY H B 43 ARG HBx 1.0 . 4.14 1956 1243 B 45 LEU H B 44 GLY H 1.0 . 4.88 1957 1244 B 44 GLY HAy B 45 LEU HBx 1.0 . 5.34 1958 1244 B 44 GLY HAx B 45 LEU HBx 1.0 . 5.34 1959 1244 B 45 LEU HBy B 44 GLY HAy 1.0 . 5.34 1960 1244 B 45 LEU HBy B 44 GLY HAx 1.0 . 5.34 1961 1245 B 45 LEU HA B 45 LEU HD11 1.0 . 4.60 1962 1246 B 45 LEU HD21 B 45 LEU HA 1.0 . 4.60 1963 1247 B 45 LEU HA B 45 LEU HD11 1.0 . 3.96 1964 1247 B 45 LEU HD21 B 45 LEU HA 1.0 . 3.96 1965 1248 B 45 LEU HG B 46 LYS H 1.0 . 5.41 1966 1249 B 45 LEU H B 45 LEU HBx 1.0 . 3.90 1967 1249 B 45 LEU H B 45 LEU HBy 1.0 . 3.90 1968 1250 B 45 LEU H B 45 LEU HD11 1.0 . 5.50 1969 1251 B 45 LEU HD21 B 45 LEU H 1.0 . 5.50 1970 1252 B 45 LEU H B 45 LEU HD11 1.0 . 4.17 1971 1252 B 45 LEU HD21 B 45 LEU H 1.0 . 4.17 1972 1253 B 46 LYS HA B 45 LEU H 1.0 . 5.33 1973 1254 B 45 LEU H B 46 LYS H 1.0 . 4.99 1974 1255 B 45 LEU HBy B 45 LEU HD11 1.0 . 3.68 1975 1255 B 45 LEU HBx B 45 LEU HD11 1.0 . 3.68 1976 1256 B 45 LEU HD21 B 45 LEU HBy 1.0 . 3.68 1977 1256 B 45 LEU HD21 B 45 LEU HBx 1.0 . 3.68 1978 1257 B 46 LYS HA B 45 LEU HBx 1.0 . 5.50 1979 1257 B 46 LYS HA B 45 LEU HBy 1.0 . 5.50 1980 1258 B 46 LYS H B 45 LEU HBx 1.0 . 4.95 1981 1258 B 45 LEU HBy B 46 LYS H 1.0 . 4.95 1982 1259 B 46 LYS H B 45 LEU HD11 1.0 . 4.85 1983 1260 B 45 LEU HD21 B 46 LYS H 1.0 . 4.85 1984 1261 B 46 LYS H B 45 LEU HD11 1.0 . 4.20 1985 1261 B 45 LEU HD21 B 46 LYS H 1.0 . 4.20 1986 1262 B 47 VAL HA B 45 LEU HD11 1.0 . 4.17 1987 1262 B 45 LEU HD21 B 47 VAL HA 1.0 . 4.17 1988 1263 B 47 VAL HB B 45 LEU HD11 1.0 . 4.46 1989 1263 B 45 LEU HD21 B 47 VAL HB 1.0 . 4.46 1990 1264 B 46 LYS HA B 46 LYS HDx 1.0 . 4.65 1991 1264 B 46 LYS HDy B 46 LYS HA 1.0 . 4.65 1992 1265 B 46 LYS HA B 46 LYS HEx 1.0 . 5.43 1993 1265 B 46 LYS HA B 46 LYS HEy 1.0 . 5.43 1994 1266 B 46 LYS H B 46 LYS HBx 1.0 . 4.18 1995 1266 B 46 LYS HBy B 46 LYS H 1.0 . 4.18 1996 1267 B 46 LYS HBx B 46 LYS HDx 1.0 . 3.83 1997 1267 B 46 LYS HBy B 46 LYS HDx 1.0 . 3.83 1998 1267 B 46 LYS HDy B 46 LYS HBx 1.0 . 3.83 1999 1267 B 46 LYS HDy B 46 LYS HBy 1.0 . 3.83 2000 1268 B 46 LYS HBy B 46 LYS HEx 1.0 . 4.39 2001 1268 B 46 LYS HBx B 46 LYS HEx 1.0 . 4.39 2002 1268 B 46 LYS HEy B 46 LYS HBx 1.0 . 4.39 2003 1268 B 46 LYS HEy B 46 LYS HBy 1.0 . 4.39 2004 1269 B 47 VAL H B 46 LYS HDx 1.0 . 4.12 2005 1269 B 47 VAL H B 46 LYS HDy 1.0 . 4.12 2006 1270 B 47 VAL H B 46 LYS HEx 1.0 . 5.45 2007 1270 B 47 VAL H B 46 LYS HEy 1.0 . 5.45 2008 1271 B 46 LYS HDx B 46 LYS HGx 1.0 . 2.40 2009 1271 B 46 LYS HDy B 46 LYS HGx 1.0 . 2.40 2010 1271 B 46 LYS HGy B 46 LYS HDx 1.0 . 2.40 2011 1271 B 46 LYS HGy B 46 LYS HDy 1.0 . 2.40 2012 1272 B 46 LYS HEy B 46 LYS HGx 1.0 . 3.73 2013 1272 B 46 LYS HEx B 46 LYS HGx 1.0 . 3.73 2014 1272 B 46 LYS HGy B 46 LYS HEx 1.0 . 3.73 2015 1272 B 46 LYS HGy B 46 LYS HEy 1.0 . 3.73 2016 1273 B 48 CYS H B 47 VAL HB 1.0 . 5.09 2017 1274 B 47 VAL H B 47 VAL HG11 1.0 . 3.94 2018 1274 B 47 VAL H B 47 VAL HG21 1.0 . 3.94 2019 1275 B 48 CYS H B 47 VAL H 1.0 . 5.10 2020 1276 B 48 CYS HA B 47 VAL HG11 1.0 . 5.11 2021 1276 B 48 CYS HA B 47 VAL HG21 1.0 . 5.11 2022 1277 B 48 CYS H B 47 VAL HG11 1.0 . 3.85 2023 1277 B 48 CYS H B 47 VAL HG21 1.0 . 3.85 2024 1278 B 49 ALA HB1 B 47 VAL HG11 1.0 . 3.82 2025 1278 B 49 ALA HB1 B 47 VAL HG21 1.0 . 3.82 2026 1279 B 49 ALA HB1 B 48 CYS HA 1.0 . 5.33 2027 1280 B 48 CYS H B 48 CYS HBx 1.0 . 4.05 2028 1280 B 48 CYS H B 48 CYS HBy 1.0 . 4.05 2029 1281 B 48 CYS H B 49 ALA HA 1.0 . 5.50 2030 1282 B 48 CYS H B 49 ALA H 1.0 . 4.95 2031 1283 B 49 ALA H B 48 CYS HBx 1.0 . 4.15 2032 1283 B 49 ALA H B 48 CYS HBy 1.0 . 4.15 2033 1284 B 49 ALA HA B 50 ASP H 1.0 . 3.56 2034 1285 B 49 ALA H B 49 ALA HB1 1.0 . 3.85 2035 1286 B 49 ALA H B 50 ASP H 1.0 . 5.24 2036 1287 B 49 ALA H B 50 ASP HBy 1.0 . 5.34 2037 1287 B 49 ALA H B 50 ASP HBx 1.0 . 5.34 2038 1288 B 49 ALA HB1 B 50 ASP HA 1.0 . 5.38 2039 1289 B 49 ALA HB1 B 50 ASP H 1.0 . 3.84 2040 1290 B 50 ASP H B 50 ASP HBx 1.0 . 4.19 2041 1291 B 50 ASP H B 50 ASP HBy 1.0 . 4.19 2042 1292 B 50 ASP H B 50 ASP HBy 1.0 . 3.67 2043 1292 B 50 ASP H B 50 ASP HBx 1.0 . 3.67 2044 1293 B 50 ASP H B 51 PRO HDx 1.0 . 5.02 2045 1293 B 51 PRO HDy B 50 ASP H 1.0 . 5.02 2046 1294 B 50 ASP HBy B 51 PRO HDx 1.0 . 5.18 2047 1294 B 50 ASP HBx B 51 PRO HDx 1.0 . 5.18 2048 1294 B 51 PRO HDy B 50 ASP HBy 1.0 . 5.18 2049 1294 B 51 PRO HDy B 50 ASP HBx 1.0 . 5.18 2050 1295 B 51 PRO HA B 52 GLN HBx 1.0 . 5.50 2051 1295 B 51 PRO HA B 52 GLN HBy 1.0 . 5.50 2052 1296 B 51 PRO HA B 52 GLN HGx 1.0 . 4.66 2053 1296 B 52 GLN HGy B 51 PRO HA 1.0 . 4.66 2054 1297 B 52 GLN HA B 53 ALA HB1 1.0 . 5.50 2055 1298 B 52 GLN H B 52 GLN HBx 1.0 . 3.98 2056 1298 B 52 GLN H B 52 GLN HBy 1.0 . 3.98 2057 1299 B 52 GLN H B 52 GLN HGx 1.0 . 4.10 2058 1299 B 52 GLN HGy B 52 GLN H 1.0 . 4.10 2059 1300 B 52 GLN H B 53 ALA HB1 1.0 . 5.42 2060 1301 B 53 ALA HA B 52 GLN HBx 1.0 . 5.50 2061 1301 B 52 GLN HBy B 53 ALA HA 1.0 . 5.50 2062 1302 B 53 ALA H B 52 GLN HGx 1.0 . 5.50 2063 1302 B 52 GLN HGy B 53 ALA H 1.0 . 5.50 2064 1303 B 53 ALA HB1 B 54 THR HA 1.0 . 4.83 2065 1304 B 53 ALA HB1 B 54 THR H 1.0 . 5.02 2066 1305 B 53 ALA HB1 B 55 TRP H 1.0 . 5.50 2067 1306 B 54 THR HA B 54 THR HG21 1.0 . 3.92 2068 1307 B 54 THR HB B 55 TRP HBx 1.0 . 5.30 2069 1307 B 54 THR HB B 55 TRP HBy 1.0 . 5.30 2070 1308 B 55 TRP HA B 56 VAL HA 1.0 . 5.50 2071 1309 B 55 TRP H B 55 TRP HD1 1.0 . 4.80 2072 1310 B 55 TRP H B 55 TRP HBx 1.0 . 3.97 2073 1310 B 55 TRP H B 55 TRP HBy 1.0 . 3.97 2074 1311 B 55 TRP HBy B 56 VAL HG11 1.0 . 4.96 2075 1311 B 56 VAL HG21 B 55 TRP HBx 1.0 . 4.96 2076 1311 B 56 VAL HG21 B 55 TRP HBy 1.0 . 4.96 2077 1311 B 55 TRP HBx B 56 VAL HG11 1.0 . 4.96 2078 1312 B 58 ASP H B 57 ARG HGx 1.0 . 4.20 2079 1312 B 57 ARG HGy B 58 ASP H 1.0 . 4.20 2080 1313 B 59 VAL H B 57 ARG HGx 1.0 . 5.20 2081 1313 B 57 ARG HGy B 59 VAL H 1.0 . 5.20 2082 1314 B 59 VAL H B 58 ASP HA 1.0 . 3.46 2083 1315 B 58 ASP H B 59 VAL H 1.0 . 4.83 2084 1316 B 59 VAL H B 58 ASP HBx 1.0 . 4.22 2085 1316 B 59 VAL H B 58 ASP HBy 1.0 . 4.22 2086 1317 B 59 VAL HA B 60 VAL H 1.0 . 3.42 2087 1318 B 59 VAL H B 59 VAL HB 1.0 . 3.66 2088 1319 B 60 VAL H B 59 VAL HG11 1.0 . 3.75 2089 1319 B 60 VAL H B 59 VAL HG21 1.0 . 3.75 2090 1320 B 60 VAL H B 60 VAL HB 1.0 . 3.63 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 9 ARG C A 10 THR N A 10 THR CA A 10 THR C 1.0 -108.0 -88.0 PHI 2 2 A 10 THR N A 10 THR CA A 10 THR C A 11 CYS N 1.0 118.0 148.0 PSI 3 3 A 10 THR C A 11 CYS N A 11 CYS CA A 11 CYS C 1.0 -148.0 -122.0 PHI 4 4 A 11 CYS N A 11 CYS CA A 11 CYS C A 12 VAL N 1.0 150.0 174.0 PSI 5 5 A 11 CYS C A 12 VAL N A 12 VAL CA A 12 VAL C 1.0 -144.0 -118.0 PHI 6 6 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 SER N 1.0 132.0 160.0 PSI 7 7 A 12 VAL C A 13 SER N A 13 SER CA A 13 SER C 1.0 -144.0 -108.0 PHI 8 8 A 13 SER N A 13 SER CA A 13 SER C A 14 LEU N 1.0 126.0 146.0 PSI 9 9 A 13 SER C A 14 LEU N A 14 LEU CA A 14 LEU C 1.0 -140.0 -102.0 PHI 10 10 A 14 LEU N A 14 LEU CA A 14 LEU C A 15 THR N 1.0 122.0 142.0 PSI 11 11 A 14 LEU C A 15 THR N A 15 THR CA A 15 THR C 1.0 -127.0 -85.0 PHI 12 12 A 15 THR N A 15 THR CA A 15 THR C A 16 THR N 1.0 115.0 141.0 PSI 13 13 A 17 GLN C A 18 ARG N A 18 ARG CA A 18 ARG C 1.0 -125.0 -81.0 PHI 14 14 A 18 ARG N A 18 ARG CA A 18 ARG C A 19 LEU N 1.0 98.0 148.0 PSI 15 15 A 18 ARG C A 19 LEU N A 19 LEU CA A 19 LEU C 1.0 -121.0 -75.0 PHI 16 16 A 19 LEU N A 19 LEU CA A 19 LEU C A 20 PRO N 1.0 127.0 169.0 PSI 17 17 A 20 PRO N A 20 PRO CA A 20 PRO C A 21 VAL N 1.0 137.0 159.0 PSI 18 18 A 20 PRO C A 21 VAL N A 21 VAL CA A 21 VAL C 1.0 -131.0 -87.0 PHI 19 19 A 21 VAL N A 21 VAL CA A 21 VAL C A 22 SER N 1.0 123.0 149.0 PSI 20 20 A 22 SER C A 23 ARG N A 23 ARG CA A 23 ARG C 1.0 -134.0 -76.0 PHI 21 21 A 23 ARG N A 23 ARG CA A 23 ARG C A 24 ILE N 1.0 134.0 166.0 PSI 22 22 A 23 ARG C A 24 ILE N A 24 ILE CA A 24 ILE C 1.0 -101.0 -73.0 PHI 23 23 A 24 ILE N A 24 ILE CA A 24 ILE C A 25 LYS N 1.0 116.0 138.0 PSI 24 24 A 24 ILE C A 25 LYS N A 25 LYS CA A 25 LYS C 1.0 -136.0 -90.0 PHI 25 25 A 25 LYS N A 25 LYS CA A 25 LYS C A 26 THR N 1.0 126.0 164.0 PSI 26 26 A 25 LYS C A 26 THR N A 26 THR CA A 26 THR C 1.0 -133.0 -107.0 PHI 27 27 A 26 THR N A 26 THR CA A 26 THR C A 27 TYR N 1.0 129.0 157.0 PSI 28 28 A 26 THR C A 27 TYR N A 27 TYR CA A 27 TYR C 1.0 -128.0 -106.0 PHI 29 29 A 27 TYR N A 27 TYR CA A 27 TYR C A 28 THR N 1.0 127.0 153.0 PSI 30 30 A 27 TYR C A 28 THR N A 28 THR CA A 28 THR C 1.0 -114.0 -84.0 PHI 31 31 A 28 THR N A 28 THR CA A 28 THR C A 29 ILE N 1.0 118.0 140.0 PSI 32 32 A 28 THR C A 29 ILE N A 29 ILE CA A 29 ILE C 1.0 -146.0 -92.0 PHI 33 33 A 29 ILE N A 29 ILE CA A 29 ILE C A 30 THR N 1.0 122.0 142.0 PSI 34 34 A 29 ILE C A 30 THR N A 30 THR CA A 30 THR C 1.0 -119.0 -97.0 PHI 35 35 A 30 THR N A 30 THR CA A 30 THR C A 31 GLU N 1.0 116.0 144.0 PSI 36 36 A 30 THR C A 31 GLU N A 31 GLU CA A 31 GLU C 1.0 -142.0 -116.0 PHI 37 37 A 31 GLU N A 31 GLU CA A 31 GLU C A 32 GLY N 1.0 98.0 122.0 PSI 38 38 A 34 LEU N A 34 LEU CA A 34 LEU C A 35 ARG N 1.0 116.0 140.0 PSI 39 39 A 34 LEU C A 35 ARG N A 35 ARG CA A 35 ARG C 1.0 -129.0 -93.0 PHI 40 40 A 35 ARG N A 35 ARG CA A 35 ARG C A 36 ALA N 1.0 114.0 134.0 PSI 41 41 A 35 ARG C A 36 ALA N A 36 ALA CA A 36 ALA C 1.0 -127.0 -105.0 PHI 42 42 A 36 ALA N A 36 ALA CA A 36 ALA C A 37 VAL N 1.0 115.0 145.0 PSI 43 43 A 36 ALA C A 37 VAL N A 37 VAL CA A 37 VAL C 1.0 -136.0 -108.0 PHI 44 44 A 37 VAL N A 37 VAL CA A 37 VAL C A 38 ILE N 1.0 118.0 144.0 PSI 45 45 A 37 VAL C A 38 ILE N A 38 ILE CA A 38 ILE C 1.0 -128.0 -102.0 PHI 46 46 A 38 ILE N A 38 ILE CA A 38 ILE C A 39 PHE N 1.0 115.0 149.0 PSI 47 47 A 38 ILE C A 39 PHE N A 39 PHE CA A 39 PHE C 1.0 -129.0 -103.0 PHI 48 48 A 39 PHE N A 39 PHE CA A 39 PHE C A 40 ILE N 1.0 115.0 157.0 PSI 49 49 A 39 PHE C A 40 ILE N A 40 ILE CA A 40 ILE C 1.0 -119.0 -89.0 PHI 50 50 A 40 ILE N A 40 ILE CA A 40 ILE C A 41 THR N 1.0 115.0 137.0 PSI 51 51 A 40 ILE C A 41 THR N A 41 THR CA A 41 THR C 1.0 -148.0 -100.0 PHI 52 52 A 41 THR N A 41 THR CA A 41 THR C A 42 LYS N 1.0 144.0 182.0 PSI 53 53 A 42 LYS C A 43 ARG N A 43 ARG CA A 43 ARG C 1.0 -116.0 -88.0 PHI 54 54 A 44 GLY C A 45 LEU N A 45 LEU CA A 45 LEU C 1.0 -138.0 -114.0 PHI 55 55 A 45 LEU N A 45 LEU CA A 45 LEU C A 46 LYS N 1.0 123.0 149.0 PSI 56 56 A 45 LEU C A 46 LYS N A 46 LYS CA A 46 LYS C 1.0 -150.0 -116.0 PHI 57 57 A 46 LYS N A 46 LYS CA A 46 LYS C A 47 VAL N 1.0 123.0 143.0 PSI 58 58 A 46 LYS C A 47 VAL N A 47 VAL CA A 47 VAL C 1.0 -131.0 -107.0 PHI 59 59 A 47 VAL N A 47 VAL CA A 47 VAL C A 48 CYS N 1.0 117.0 139.0 PSI 60 60 A 47 VAL C A 48 CYS N A 48 CYS CA A 48 CYS C 1.0 -142.0 -116.0 PHI 61 61 A 48 CYS N A 48 CYS CA A 48 CYS C A 49 ALA N 1.0 138.0 160.0 PSI 62 62 A 48 CYS C A 49 ALA N A 49 ALA CA A 49 ALA C 1.0 -156.0 -118.0 PHI 63 63 A 49 ALA N A 49 ALA CA A 49 ALA C A 50 ASP N 1.0 126.0 146.0 PSI 64 64 A 49 ALA C A 50 ASP N A 50 ASP CA A 50 ASP C 1.0 -147.0 -95.0 PHI 65 65 A 51 PRO N A 51 PRO CA A 51 PRO C A 52 GLN N 1.0 136.0 160.0 PSI stop_ save_