data_nef_c18278_2lpv save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 GLY middle . false 3 A 3 VAL middle . . 4 A 4 GLN middle . . 5 A 5 VAL middle . . 6 A 6 VAL middle . . 7 A 7 THR middle . . 8 A 8 LEU middle . . 9 A 9 ALA middle . . 10 A 10 ALA middle . . 11 A 11 GLY middle . false 12 A 12 ASP middle . . 13 A 13 GLU middle . . 14 A 14 ALA middle . . 15 A 15 THR middle . . 16 A 16 TYR middle . . 17 A 17 PRO middle . false 18 A 18 LYS middle . . 19 A 19 ALA middle . . 20 A 20 GLY middle . false 21 A 21 GLN middle . . 22 A 22 VAL middle . . 23 A 23 ALA middle . . 24 A 24 VAL middle . . 25 A 25 VAL middle . . 26 A 26 HIS middle . . 27 A 27 TYR middle . . 28 A 28 THR middle . . 29 A 29 GLY middle . false 30 A 30 THR middle . . 31 A 31 LEU middle . . 32 A 32 ALA middle . . 33 A 33 ASP middle . . 34 A 34 GLY middle . false 35 A 35 LYS middle . . 36 A 36 VAL middle . . 37 A 37 PHE middle . . 38 A 38 ASP middle . . 39 A 39 SER middle . . 40 A 40 SER middle . . 41 A 41 ARG middle . . 42 A 42 THR middle . . 43 A 43 ARG middle . . 44 A 44 GLY middle . false 45 A 45 LYS middle . . 46 A 46 PRO middle . false 47 A 47 PHE middle . . 48 A 48 ARG middle . . 49 A 49 PHE middle . . 50 A 50 THR middle . . 51 A 51 VAL middle . . 52 A 52 GLY middle . false 53 A 53 ARG middle . . 54 A 54 GLY middle . false 55 A 55 GLU middle . . 56 A 56 VAL middle . . 57 A 57 ILE middle . . 58 A 58 ARG middle . . 59 A 59 GLY middle . false 60 A 60 TRP middle . . 61 A 61 ASP middle . . 62 A 62 GLU middle . . 63 A 63 GLY middle . false 64 A 64 VAL middle . . 65 A 65 ALA middle . . 66 A 66 GLN middle . . 67 A 67 MET middle . . 68 A 68 SER middle . . 69 A 69 VAL middle . . 70 A 70 GLY middle . false 71 A 71 GLN middle . . 72 A 72 ARG middle . . 73 A 73 ALA middle . . 74 A 74 LYS middle . . 75 A 75 LEU middle . . 76 A 76 VAL middle . . 77 A 77 CYS middle . . 78 A 78 SER middle . . 79 A 79 PRO middle . false 80 A 80 ASP middle . . 81 A 81 TYR middle . . 82 A 82 ALA middle . . 83 A 83 TYR middle . . 84 A 84 GLY middle . false 85 A 85 SER middle . . 86 A 86 ARG middle . . 87 A 87 GLY middle . false 88 A 88 HIS middle . . 89 A 89 PRO middle . false 90 A 90 GLY middle . false 91 A 91 VAL middle . . 92 A 92 ILE middle . . 93 A 93 PRO middle . false 94 A 94 PRO middle . false 95 A 95 ASN middle . . 96 A 96 ALA middle . . 97 A 97 THR middle . . 98 A 98 LEU middle . . 99 A 99 THR middle . . 100 A 100 PHE middle . . 101 A 101 ASP middle . . 102 A 102 VAL middle . . 103 A 103 GLU middle . . 104 A 104 LEU middle . . 105 A 105 LEU middle . . 106 A 106 ARG middle . . 107 A 107 VAL middle . . 108 A 108 GLU end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET HA H 1 4.698 0.020 A 2 GLY HAy H 1 3.064 0.020 A 2 GLY HAx H 1 3.004 0.020 A 2 GLY C C 13 172.529 0.400 A 2 GLY CA C 13 45.354 0.400 A 3 VAL H H 1 7.648 0.020 A 3 VAL HA H 1 4.960 0.020 A 3 VAL HB H 1 1.824 0.020 A 3 VAL HGx% H 1 0.803 0.020 A 3 VAL HGy% H 1 0.814 0.020 A 3 VAL C C 13 173.461 0.400 A 3 VAL CA C 13 59.148 0.400 A 3 VAL CB C 13 34.592 0.400 A 3 VAL CGy C 13 22.508 0.400 A 3 VAL CGx C 13 19.338 0.400 A 3 VAL N N 15 118.483 0.400 A 4 GLN H H 1 8.249 0.020 A 4 GLN HA H 1 4.581 0.020 A 4 GLN HBy H 1 1.999 0.020 A 4 GLN HBx H 1 1.816 0.020 A 4 GLN HE2x H 1 6.695 0.020 A 4 GLN HE2y H 1 7.363 0.020 A 4 GLN HGy H 1 2.283 0.020 A 4 GLN HGx H 1 2.119 0.020 A 4 GLN C C 13 174.306 0.400 A 4 GLN CA C 13 54.225 0.400 A 4 GLN CB C 13 31.167 0.400 A 4 GLN CG C 13 33.818 0.400 A 4 GLN N N 15 127.234 0.400 A 4 GLN NE2 N 15 111.325 0.400 A 5 VAL H H 1 8.686 0.020 A 5 VAL HA H 1 4.567 0.020 A 5 VAL HB H 1 1.969 0.020 A 5 VAL HGx% H 1 0.620 0.020 A 5 VAL HGy% H 1 0.751 0.020 A 5 VAL C C 13 175.967 0.400 A 5 VAL CA C 13 61.836 0.400 A 5 VAL CB C 13 32.677 0.400 A 5 VAL CGx C 13 20.944 0.400 A 5 VAL CGy C 13 21.029 0.400 A 5 VAL N N 15 125.759 0.400 A 6 VAL H H 1 9.349 0.020 A 6 VAL HA H 1 4.273 0.020 A 6 VAL HB H 1 2.054 0.020 A 6 VAL HGx% H 1 0.840 0.020 A 6 VAL HGy% H 1 0.841 0.020 A 6 VAL C C 13 176.002 0.400 A 6 VAL CA C 13 61.318 0.400 A 6 VAL CB C 13 33.570 0.400 A 6 VAL CGy C 13 20.321 0.400 A 6 VAL CGx C 13 19.867 0.400 A 6 VAL N N 15 130.778 0.400 A 7 THR H H 1 8.977 0.020 A 7 THR HA H 1 3.890 0.020 A 7 THR HB H 1 4.030 0.020 A 7 THR HG1 H 1 5.142 0.020 A 7 THR HG2% H 1 1.133 0.020 A 7 THR C C 13 173.670 0.400 A 7 THR CA C 13 66.707 0.400 A 7 THR CB C 13 68.545 0.400 A 7 THR CG2 C 13 22.451 0.400 A 7 THR N N 15 125.637 0.400 A 8 LEU H H 1 9.259 0.020 A 8 LEU HA H 1 4.442 0.020 A 8 LEU HBy H 1 1.492 0.020 A 8 LEU HBx H 1 1.265 0.020 A 8 LEU HDx% H 1 0.737 0.020 A 8 LEU HDy% H 1 0.747 0.020 A 8 LEU HG H 1 1.628 0.020 A 8 LEU C C 13 176.805 0.400 A 8 LEU CA C 13 55.675 0.400 A 8 LEU CB C 13 42.962 0.400 A 8 LEU CDy C 13 25.444 0.400 A 8 LEU CDx C 13 22.457 0.400 A 8 LEU CG C 13 27.413 0.400 A 8 LEU N N 15 128.943 0.400 A 9 ALA H H 1 8.184 0.020 A 9 ALA HA H 1 4.464 0.020 A 9 ALA HB% H 1 1.346 0.020 A 9 ALA C C 13 175.507 0.400 A 9 ALA CA C 13 52.146 0.400 A 9 ALA CB C 13 21.689 0.400 A 9 ALA N N 15 122.590 0.400 A 10 ALA H H 1 8.477 0.020 A 10 ALA HA H 1 4.087 0.020 A 10 ALA HB% H 1 1.380 0.020 A 10 ALA C C 13 178.701 0.400 A 10 ALA CA C 13 53.174 0.400 A 10 ALA CB C 13 19.651 0.400 A 10 ALA N N 15 125.304 0.400 A 11 GLY H H 1 8.526 0.020 A 11 GLY HAy H 1 4.082 0.020 A 11 GLY HAx H 1 3.473 0.020 A 11 GLY C C 13 173.360 0.400 A 11 GLY CA C 13 44.119 0.400 A 11 GLY N N 15 107.868 0.400 A 12 ASP H H 1 8.060 0.020 A 12 ASP HA H 1 4.164 0.020 A 12 ASP HBy H 1 2.920 0.020 A 12 ASP HBx H 1 2.611 0.020 A 12 ASP C C 13 176.548 0.400 A 12 ASP CA C 13 54.410 0.400 A 12 ASP CB C 13 39.421 0.400 A 12 ASP N N 15 118.081 0.400 A 13 GLU H H 1 8.784 0.020 A 13 GLU HA H 1 3.486 0.020 A 13 GLU HBy H 1 2.176 0.020 A 13 GLU HBx H 1 1.976 0.020 A 13 GLU HGy H 1 2.159 0.020 A 13 GLU HGx H 1 1.964 0.020 A 13 GLU C C 13 174.734 0.400 A 13 GLU CA C 13 57.388 0.400 A 13 GLU CB C 13 27.352 0.400 A 13 GLU CG C 13 37.367 0.400 A 13 GLU N N 15 114.503 0.400 A 14 ALA H H 1 8.340 0.020 A 14 ALA HA H 1 4.618 0.020 A 14 ALA HB% H 1 1.166 0.020 A 14 ALA C C 13 176.977 0.400 A 14 ALA CA C 13 53.482 0.400 A 14 ALA CB C 13 22.408 0.400 A 14 ALA N N 15 118.545 0.400 A 15 THR H H 1 10.136 0.020 A 15 THR HA H 1 4.184 0.020 A 15 THR HB H 1 4.185 0.020 A 15 THR HG1 H 1 4.885 0.020 A 15 THR HG2% H 1 1.013 0.020 A 15 THR C C 13 172.263 0.400 A 15 THR CA C 13 61.843 0.400 A 15 THR CB C 13 66.952 0.400 A 15 THR CG2 C 13 21.909 0.400 A 15 THR N N 15 122.747 0.400 A 16 TYR H H 1 8.079 0.020 A 16 TYR HA H 1 5.264 0.020 A 16 TYR HBy H 1 2.861 0.020 A 16 TYR HBx H 1 2.485 0.020 A 16 TYR HDx H 1 6.801 0.020 A 16 TYR HDy H 1 6.801 0.020 A 16 TYR HEx H 1 6.432 0.020 A 16 TYR HEy H 1 6.432 0.020 A 16 TYR C C 13 172.231 0.400 A 16 TYR CA C 13 53.957 0.400 A 16 TYR CB C 13 39.263 0.400 A 16 TYR CEx C 13 117.445 0.400 A 16 TYR N N 15 125.123 0.400 A 17 PRO HA H 1 4.342 0.020 A 17 PRO HBx H 1 1.676 0.020 A 17 PRO HBy H 1 1.789 0.020 A 17 PRO HDy H 1 4.136 0.020 A 17 PRO HDx H 1 3.947 0.020 A 17 PRO HGy H 1 2.044 0.020 A 17 PRO HGx H 1 1.581 0.020 A 17 PRO C C 13 175.612 0.400 A 17 PRO CA C 13 62.666 0.400 A 17 PRO CB C 13 31.510 0.400 A 17 PRO CD C 13 51.017 0.400 A 17 PRO CG C 13 28.000 0.400 A 18 LYS H H 1 8.493 0.020 A 18 LYS HA H 1 4.395 0.020 A 18 LYS HBy H 1 1.784 0.020 A 18 LYS HBx H 1 1.465 0.020 A 18 LYS HDx H 1 1.624 0.020 A 18 LYS HDy H 1 1.624 0.020 A 18 LYS HEx H 1 2.946 0.020 A 18 LYS HEy H 1 2.946 0.020 A 18 LYS HGy H 1 1.459 0.020 A 18 LYS HGx H 1 1.394 0.020 A 18 LYS C C 13 175.708 0.400 A 18 LYS CA C 13 53.655 0.400 A 18 LYS CB C 13 34.005 0.400 A 18 LYS CD C 13 28.866 0.400 A 18 LYS CE C 13 42.151 0.400 A 18 LYS CG C 13 24.868 0.400 A 18 LYS N N 15 124.035 0.400 A 19 ALA H H 1 8.181 0.020 A 19 ALA HA H 1 3.825 0.020 A 19 ALA HB% H 1 1.295 0.020 A 19 ALA C C 13 179.360 0.400 A 19 ALA CA C 13 53.439 0.400 A 19 ALA CB C 13 17.655 0.400 A 19 ALA N N 15 121.217 0.400 A 20 GLY H H 1 8.970 0.020 A 20 GLY HAy H 1 4.297 0.020 A 20 GLY HAx H 1 3.212 0.020 A 20 GLY CA C 13 45.132 0.400 A 20 GLY N N 15 110.511 0.400 A 21 GLN H H 1 8.179 0.020 A 21 GLN HA H 1 4.502 0.020 A 21 GLN HBy H 1 2.117 0.020 A 21 GLN HBx H 1 1.895 0.020 A 21 GLN HE2x H 1 6.428 0.020 A 21 GLN HE2y H 1 7.503 0.020 A 21 GLN HGy H 1 2.202 0.020 A 21 GLN HGx H 1 2.128 0.020 A 21 GLN C C 13 173.665 0.400 A 21 GLN CA C 13 55.680 0.400 A 21 GLN CB C 13 30.357 0.400 A 21 GLN CG C 13 35.780 0.400 A 21 GLN N N 15 119.934 0.400 A 21 GLN NE2 N 15 110.870 0.400 A 22 VAL H H 1 8.505 0.020 A 22 VAL HA H 1 4.321 0.020 A 22 VAL HB H 1 1.726 0.020 A 22 VAL HGx% H 1 0.741 0.020 A 22 VAL HGy% H 1 0.477 0.020 A 22 VAL C C 13 175.231 0.400 A 22 VAL CA C 13 61.564 0.400 A 22 VAL CB C 13 32.961 0.400 A 22 VAL CGy C 13 21.551 0.400 A 22 VAL CGx C 13 21.252 0.400 A 22 VAL N N 15 121.184 0.400 A 23 ALA H H 1 8.429 0.020 A 23 ALA HA H 1 4.407 0.020 A 23 ALA HB% H 1 0.462 0.020 A 23 ALA C C 13 174.523 0.400 A 23 ALA CA C 13 50.295 0.400 A 23 ALA CB C 13 20.451 0.400 A 23 ALA N N 15 128.534 0.400 A 24 VAL H H 1 7.749 0.020 A 24 VAL HA H 1 4.630 0.020 A 24 VAL HB H 1 1.841 0.020 A 24 VAL HGx% H 1 0.635 0.020 A 24 VAL HGy% H 1 0.569 0.020 A 24 VAL C C 13 176.193 0.400 A 24 VAL CA C 13 61.229 0.400 A 24 VAL CB C 13 31.649 0.400 A 24 VAL CGy C 13 21.361 0.400 A 24 VAL CGx C 13 20.198 0.400 A 24 VAL N N 15 120.915 0.400 A 25 VAL H H 1 9.470 0.020 A 25 VAL HA H 1 5.753 0.020 A 25 VAL HB H 1 2.202 0.020 A 25 VAL HGx% H 1 0.800 0.020 A 25 VAL HGy% H 1 1.050 0.020 A 25 VAL C C 13 175.625 0.400 A 25 VAL CA C 13 58.022 0.400 A 25 VAL CB C 13 35.799 0.400 A 25 VAL CGy C 13 21.918 0.400 A 25 VAL CGx C 13 19.687 0.400 A 25 VAL N N 15 117.581 0.400 A 26 HIS H H 1 8.478 0.020 A 26 HIS HA H 1 5.708 0.020 A 26 HIS HBy H 1 2.768 0.020 A 26 HIS HBx H 1 2.673 0.020 A 26 HIS HD2 H 1 6.902 0.020 A 26 HIS HE1 H 1 7.029 0.020 A 26 HIS C C 13 176.486 0.400 A 26 HIS CA C 13 54.616 0.400 A 26 HIS CB C 13 35.532 0.400 A 26 HIS N N 15 119.004 0.400 A 27 TYR H H 1 9.754 0.020 A 27 TYR HA H 1 6.388 0.020 A 27 TYR HBy H 1 2.807 0.020 A 27 TYR HBx H 1 2.739 0.020 A 27 TYR HDx H 1 6.868 0.020 A 27 TYR HDy H 1 6.868 0.020 A 27 TYR HEx H 1 6.542 0.020 A 27 TYR HEy H 1 6.542 0.020 A 27 TYR C C 13 173.969 0.400 A 27 TYR CA C 13 56.104 0.400 A 27 TYR CB C 13 44.070 0.400 A 27 TYR CDy C 13 133.153 0.400 A 27 TYR CEy C 13 117.824 0.400 A 27 TYR N N 15 117.362 0.400 A 28 THR H H 1 8.456 0.020 A 28 THR HA H 1 4.556 0.020 A 28 THR HB H 1 3.973 0.020 A 28 THR HG2% H 1 1.201 0.020 A 28 THR C C 13 173.615 0.400 A 28 THR CA C 13 63.145 0.400 A 28 THR CB C 13 72.780 0.400 A 28 THR CG2 C 13 23.028 0.400 A 28 THR N N 15 116.185 0.400 A 29 GLY H H 1 9.447 0.020 A 29 GLY HAy H 1 4.691 0.020 A 29 GLY HAx H 1 2.441 0.020 A 29 GLY C C 13 171.481 0.400 A 29 GLY CA C 13 45.730 0.400 A 29 GLY N N 15 117.568 0.400 A 30 THR H H 1 9.227 0.020 A 30 THR HA H 1 5.376 0.020 A 30 THR HB H 1 3.955 0.020 A 30 THR HG2% H 1 0.966 0.020 A 30 THR C C 13 175.178 0.400 A 30 THR CA C 13 59.426 0.400 A 30 THR CB C 13 72.212 0.400 A 30 THR CG2 C 13 22.603 0.400 A 30 THR N N 15 117.374 0.400 A 31 LEU H H 1 8.514 0.020 A 31 LEU HA H 1 4.649 0.020 A 31 LEU HBy H 1 2.211 0.020 A 31 LEU HBx H 1 1.762 0.020 A 31 LEU HDx% H 1 0.984 0.020 A 31 LEU HDy% H 1 0.719 0.020 A 31 LEU HG H 1 1.832 0.020 A 31 LEU C C 13 179.920 0.400 A 31 LEU CA C 13 53.810 0.400 A 31 LEU CB C 13 42.899 0.400 A 31 LEU CDy C 13 25.980 0.400 A 31 LEU CDx C 13 23.889 0.400 A 31 LEU CG C 13 27.904 0.400 A 31 LEU N N 15 120.688 0.400 A 32 ALA H H 1 9.561 0.020 A 32 ALA HA H 1 4.070 0.020 A 32 ALA HB% H 1 1.435 0.020 A 32 ALA C C 13 178.198 0.400 A 32 ALA CA C 13 55.131 0.400 A 32 ALA CB C 13 18.443 0.400 A 32 ALA N N 15 124.750 0.400 A 33 ASP H H 1 7.722 0.020 A 33 ASP HA H 1 4.406 0.020 A 33 ASP HBy H 1 2.955 0.020 A 33 ASP HBx H 1 2.502 0.020 A 33 ASP C C 13 177.251 0.400 A 33 ASP CA C 13 53.385 0.400 A 33 ASP CB C 13 40.030 0.400 A 33 ASP N N 15 114.354 0.400 A 34 GLY H H 1 8.201 0.020 A 34 GLY HAy H 1 4.270 0.020 A 34 GLY HAx H 1 3.499 0.020 A 34 GLY C C 13 174.171 0.400 A 34 GLY CA C 13 44.757 0.400 A 34 GLY N N 15 108.394 0.400 A 35 LYS H H 1 7.893 0.020 A 35 LYS HA H 1 4.052 0.020 A 35 LYS HBy H 1 1.882 0.020 A 35 LYS HBx H 1 1.732 0.020 A 35 LYS HDx H 1 1.679 0.020 A 35 LYS HEx H 1 2.920 0.020 A 35 LYS HEy H 1 2.920 0.020 A 35 LYS HGy H 1 1.367 0.020 A 35 LYS HGx H 1 1.232 0.020 A 35 LYS C C 13 176.470 0.400 A 35 LYS CA C 13 57.317 0.400 A 35 LYS CB C 13 32.867 0.400 A 35 LYS CD C 13 29.024 0.400 A 35 LYS CG C 13 25.138 0.400 A 35 LYS N N 15 122.230 0.400 A 36 VAL H H 1 8.554 0.020 A 36 VAL HA H 1 4.348 0.020 A 36 VAL HB H 1 1.903 0.020 A 36 VAL HGx% H 1 0.885 0.020 A 36 VAL HGy% H 1 0.752 0.020 A 36 VAL C C 13 177.051 0.400 A 36 VAL CA C 13 62.220 0.400 A 36 VAL CB C 13 32.428 0.400 A 36 VAL CGy C 13 21.597 0.400 A 36 VAL CGx C 13 21.263 0.400 A 36 VAL N N 15 126.791 0.400 A 37 PHE H H 1 8.161 0.020 A 37 PHE HA H 1 5.012 0.020 A 37 PHE HBy H 1 3.230 0.020 A 37 PHE HBx H 1 2.568 0.020 A 37 PHE HDx H 1 6.945 0.020 A 37 PHE HDy H 1 6.945 0.020 A 37 PHE HEx H 1 7.220 0.020 A 37 PHE HEy H 1 7.220 0.020 A 37 PHE C C 13 174.494 0.400 A 37 PHE CA C 13 56.066 0.400 A 37 PHE CB C 13 40.607 0.400 A 37 PHE CDx C 13 130.498 0.400 A 37 PHE CEx C 13 131.021 0.400 A 37 PHE N N 15 123.931 0.400 A 38 ASP H H 1 6.619 0.020 A 38 ASP HA H 1 4.724 0.020 A 38 ASP HBy H 1 3.285 0.020 A 38 ASP HBx H 1 2.163 0.020 A 38 ASP C C 13 174.312 0.400 A 38 ASP CA C 13 54.803 0.400 A 38 ASP CB C 13 44.024 0.400 A 38 ASP N N 15 118.725 0.400 A 39 SER H H 1 8.027 0.020 A 39 SER HA H 1 4.612 0.020 A 39 SER HBy H 1 3.904 0.020 A 39 SER HBx H 1 3.657 0.020 A 39 SER C C 13 174.710 0.400 A 39 SER CA C 13 56.661 0.400 A 39 SER CB C 13 64.577 0.400 A 39 SER N N 15 118.390 0.400 A 40 SER H H 1 8.106 0.020 A 40 SER HA H 1 4.190 0.020 A 40 SER HBy H 1 4.840 0.020 A 40 SER HBx H 1 3.690 0.020 A 40 SER HG H 1 4.660 0.020 A 40 SER C C 13 176.725 0.400 A 40 SER CA C 13 60.977 0.400 A 40 SER CB C 13 61.868 0.400 A 40 SER N N 15 123.658 0.400 A 41 ARG H H 1 7.698 0.020 A 41 ARG HA H 1 3.540 0.020 A 41 ARG HBy H 1 1.438 0.020 A 41 ARG HBx H 1 1.372 0.020 A 41 ARG HDx H 1 2.715 0.020 A 41 ARG HDy H 1 2.715 0.020 A 41 ARG HGy H 1 1.176 0.020 A 41 ARG HGx H 1 0.704 0.020 A 41 ARG C C 13 179.389 0.400 A 41 ARG CA C 13 59.159 0.400 A 41 ARG CB C 13 29.044 0.400 A 41 ARG CD C 13 42.909 0.400 A 41 ARG CG C 13 28.814 0.400 A 41 ARG N N 15 123.343 0.400 A 42 THR H H 1 7.216 0.020 A 42 THR HA H 1 3.912 0.020 A 42 THR HB H 1 4.122 0.020 A 42 THR HG2% H 1 1.159 0.020 A 42 THR C C 13 175.726 0.400 A 42 THR CA C 13 64.426 0.400 A 42 THR CB C 13 68.193 0.400 A 42 THR CG2 C 13 22.097 0.400 A 42 THR N N 15 111.923 0.400 A 43 ARG H H 1 7.059 0.020 A 43 ARG HA H 1 4.323 0.020 A 43 ARG HBy H 1 2.032 0.020 A 43 ARG HBx H 1 1.961 0.020 A 43 ARG HDy H 1 3.409 0.020 A 43 ARG HDx H 1 3.236 0.020 A 43 ARG HGy H 1 1.784 0.020 A 43 ARG HGx H 1 1.649 0.020 A 43 ARG C C 13 177.438 0.400 A 43 ARG CA C 13 57.424 0.400 A 43 ARG CB C 13 31.451 0.400 A 43 ARG CD C 13 43.612 0.400 A 43 ARG CG C 13 28.756 0.400 A 43 ARG N N 15 118.233 0.400 A 44 GLY H H 1 7.674 0.020 A 44 GLY HAy H 1 4.130 0.020 A 44 GLY HAx H 1 3.746 0.020 A 44 GLY C C 13 173.575 0.400 A 44 GLY CA C 13 45.915 0.400 A 44 GLY N N 15 106.057 0.400 A 45 LYS H H 1 7.296 0.020 A 45 LYS HA H 1 4.926 0.020 A 45 LYS HBy H 1 1.826 0.020 A 45 LYS HBx H 1 1.664 0.020 A 45 LYS HDx H 1 2.008 0.020 A 45 LYS HDy H 1 2.008 0.020 A 45 LYS HEx H 1 3.235 0.020 A 45 LYS HEy H 1 3.235 0.020 A 45 LYS HGx H 1 1.427 0.020 A 45 LYS HGy H 1 1.427 0.020 A 45 LYS C C 13 172.669 0.400 A 45 LYS CA C 13 53.059 0.400 A 45 LYS CB C 13 34.860 0.400 A 45 LYS CG C 13 24.239 0.400 A 45 LYS N N 15 118.236 0.400 A 46 PRO HA H 1 3.915 0.020 A 46 PRO HBx H 1 1.190 0.020 A 46 PRO HBy H 1 1.392 0.020 A 46 PRO HDy H 1 3.617 0.020 A 46 PRO HDx H 1 3.580 0.020 A 46 PRO HGy H 1 1.604 0.020 A 46 PRO HGx H 1 1.343 0.020 A 46 PRO C C 13 174.215 0.400 A 46 PRO CA C 13 62.586 0.400 A 46 PRO CB C 13 32.569 0.400 A 46 PRO CD C 13 50.582 0.400 A 46 PRO CG C 13 26.656 0.400 A 47 PHE H H 1 9.201 0.020 A 47 PHE HA H 1 4.851 0.020 A 47 PHE HBy H 1 3.458 0.020 A 47 PHE HBx H 1 3.167 0.020 A 47 PHE HDx H 1 7.285 0.020 A 47 PHE HDy H 1 7.285 0.020 A 47 PHE C C 13 172.892 0.400 A 47 PHE CA C 13 56.991 0.400 A 47 PHE CB C 13 43.021 0.400 A 47 PHE N N 15 123.712 0.400 A 48 ARG H H 1 7.440 0.020 A 48 ARG HA H 1 5.456 0.020 A 48 ARG HBy H 1 1.372 0.020 A 48 ARG HBx H 1 1.341 0.020 A 48 ARG HDy H 1 3.057 0.020 A 48 ARG HDx H 1 2.927 0.020 A 48 ARG HGy H 1 1.377 0.020 A 48 ARG HGx H 1 1.279 0.020 A 48 ARG C C 13 174.532 0.400 A 48 ARG CA C 13 53.663 0.400 A 48 ARG CB C 13 33.693 0.400 A 48 ARG CD C 13 43.217 0.400 A 48 ARG CG C 13 27.715 0.400 A 48 ARG N N 15 125.619 0.400 A 49 PHE H H 1 8.304 0.020 A 49 PHE HA H 1 4.659 0.020 A 49 PHE HBy H 1 2.937 0.020 A 49 PHE HBx H 1 2.920 0.020 A 49 PHE HDx H 1 6.978 0.020 A 49 PHE HDy H 1 6.978 0.020 A 49 PHE HEx H 1 7.143 0.020 A 49 PHE HEy H 1 7.143 0.020 A 49 PHE HZ H 1 6.853 0.020 A 49 PHE C C 13 171.727 0.400 A 49 PHE CA C 13 55.946 0.400 A 49 PHE CB C 13 41.513 0.400 A 49 PHE CEy C 13 130.948 0.400 A 49 PHE CZ C 13 127.992 0.400 A 49 PHE N N 15 117.234 0.400 A 50 THR H H 1 8.734 0.020 A 50 THR HA H 1 4.334 0.020 A 50 THR HB H 1 3.811 0.020 A 50 THR HG2% H 1 0.881 0.020 A 50 THR C C 13 174.289 0.400 A 50 THR CA C 13 62.216 0.400 A 50 THR CB C 13 67.757 0.400 A 50 THR CG2 C 13 21.866 0.400 A 50 THR N N 15 119.365 0.400 A 51 VAL H H 1 8.907 0.020 A 51 VAL HA H 1 3.708 0.020 A 51 VAL HB H 1 1.971 0.020 A 51 VAL HGx% H 1 0.618 0.020 A 51 VAL HGy% H 1 0.779 0.020 A 51 VAL C C 13 177.542 0.400 A 51 VAL CA C 13 64.419 0.400 A 51 VAL CB C 13 31.663 0.400 A 51 VAL CGy C 13 23.150 0.400 A 51 VAL CGx C 13 20.826 0.400 A 51 VAL N N 15 130.756 0.400 A 52 GLY H H 1 9.582 0.400 A 52 GLY HAy H 1 3.986 0.020 A 52 GLY HAx H 1 3.742 0.020 A 52 GLY C C 13 175.147 0.400 A 52 GLY CA C 13 46.250 0.400 A 52 GLY N N 15 116.129 0.400 A 53 ARG H H 1 7.971 0.020 A 53 ARG HA H 1 4.619 0.020 A 53 ARG HBy H 1 2.065 0.020 A 53 ARG HBx H 1 1.609 0.020 A 53 ARG HDy H 1 3.176 0.020 A 53 ARG HDx H 1 3.083 0.020 A 53 ARG HGy H 1 1.575 0.020 A 53 ARG HGx H 1 1.417 0.020 A 53 ARG C C 13 176.286 0.400 A 53 ARG CA C 13 54.222 0.400 A 53 ARG CB C 13 31.656 0.400 A 53 ARG CD C 13 42.997 0.400 A 53 ARG CG C 13 27.160 0.400 A 53 ARG N N 15 117.920 0.400 A 54 GLY H H 1 8.908 0.020 A 54 GLY HAx H 1 3.944 0.020 A 54 GLY HAy H 1 3.944 0.020 A 54 GLY C C 13 175.719 0.400 A 54 GLY CA C 13 46.711 0.400 A 54 GLY N N 15 112.121 0.400 A 55 GLU H H 1 9.254 0.020 A 55 GLU HA H 1 4.110 0.020 A 55 GLU HBy H 1 2.157 0.020 A 55 GLU HBx H 1 2.110 0.020 A 55 GLU HGx H 1 2.258 0.020 A 55 GLU HGy H 1 2.258 0.020 A 55 GLU C C 13 175.466 0.400 A 55 GLU CA C 13 57.513 0.400 A 55 GLU CB C 13 30.838 0.400 A 55 GLU CG C 13 36.886 0.400 A 55 GLU N N 15 119.450 0.400 A 56 VAL H H 1 6.826 0.020 A 56 VAL HA H 1 4.179 0.020 A 56 VAL HB H 1 1.396 0.020 A 56 VAL HGx% H 1 0.118 0.020 A 56 VAL HGy% H 1 0.231 0.020 A 56 VAL C C 13 175.156 0.400 A 56 VAL CA C 13 57.578 0.400 A 56 VAL CB C 13 35.813 0.400 A 56 VAL CGy C 13 21.854 0.400 A 56 VAL CGx C 13 18.936 0.400 A 56 VAL N N 15 108.923 0.400 A 57 ILE H H 1 7.224 0.020 A 57 ILE HA H 1 3.800 0.020 A 57 ILE HB H 1 2.002 0.020 A 57 ILE HD1% H 1 0.707 0.020 A 57 ILE HG1y H 1 0.942 0.020 A 57 ILE HG1x H 1 0.450 0.020 A 57 ILE HG2% H 1 0.090 0.020 A 57 ILE C C 13 177.148 0.400 A 57 ILE CA C 13 61.852 0.400 A 57 ILE CB C 13 38.236 0.400 A 57 ILE CD1 C 13 14.407 0.400 A 57 ILE CG1 C 13 25.214 0.400 A 57 ILE CG2 C 13 17.514 0.400 A 57 ILE N N 15 111.592 0.400 A 58 ARG H H 1 8.722 0.020 A 58 ARG HA H 1 4.074 0.020 A 58 ARG HBy H 1 1.673 0.020 A 58 ARG HBx H 1 1.283 0.020 A 58 ARG HDy H 1 2.820 0.020 A 58 ARG HDx H 1 2.266 0.020 A 58 ARG HGy H 1 1.580 0.020 A 58 ARG HGx H 1 1.194 0.020 A 58 ARG C C 13 178.934 0.400 A 58 ARG CA C 13 59.827 0.400 A 58 ARG CB C 13 30.907 0.400 A 58 ARG CD C 13 43.426 0.400 A 58 ARG CG C 13 27.118 0.400 A 58 ARG N N 15 124.810 0.400 A 59 GLY H H 1 9.330 0.020 A 59 GLY HAy H 1 4.094 0.020 A 59 GLY HAx H 1 3.903 0.020 A 59 GLY C C 13 175.368 0.400 A 59 GLY CA C 13 47.926 0.400 A 59 GLY N N 15 101.886 0.400 A 60 TRP H H 1 7.419 0.020 A 60 TRP HA H 1 4.329 0.020 A 60 TRP HBy H 1 2.801 0.020 A 60 TRP HBx H 1 2.654 0.020 A 60 TRP HD1 H 1 6.242 0.020 A 60 TRP HE1 H 1 5.490 0.020 A 60 TRP HE3 H 1 6.392 0.020 A 60 TRP HH2 H 1 5.441 0.020 A 60 TRP HZ2 H 1 5.998 0.020 A 60 TRP C C 13 177.247 0.400 A 60 TRP CA C 13 59.463 0.400 A 60 TRP CB C 13 29.228 0.400 A 60 TRP CZ2 C 13 112.073 0.400 A 60 TRP N N 15 119.582 0.400 A 60 TRP NE1 N 15 118.591 0.400 A 61 ASP H H 1 7.361 0.020 A 61 ASP HA H 1 4.727 0.020 A 61 ASP HBy H 1 2.685 0.020 A 61 ASP HBx H 1 2.559 0.020 A 61 ASP C C 13 178.796 0.400 A 61 ASP CA C 13 58.373 0.400 A 61 ASP CB C 13 41.372 0.400 A 61 ASP N N 15 121.099 0.400 A 62 GLU H H 1 8.347 0.020 A 62 GLU HA H 1 4.181 0.020 A 62 GLU HBy H 1 2.111 0.020 A 62 GLU HBx H 1 1.888 0.020 A 62 GLU HGy H 1 2.408 0.020 A 62 GLU HGx H 1 2.212 0.020 A 62 GLU C C 13 179.414 0.400 A 62 GLU CA C 13 58.466 0.400 A 62 GLU CB C 13 30.332 0.400 A 62 GLU CG C 13 37.149 0.400 A 62 GLU N N 15 113.092 0.400 A 63 GLY H H 1 7.896 0.020 A 63 GLY HAx H 1 3.683 0.020 A 63 GLY HAy H 1 3.683 0.020 A 63 GLY C C 13 175.101 0.400 A 63 GLY CA C 13 47.121 0.400 A 63 GLY N N 15 108.077 0.400 A 64 VAL H H 1 8.816 0.020 A 64 VAL HA H 1 3.760 0.020 A 64 VAL HB H 1 2.301 0.020 A 64 VAL HGx% H 1 0.889 0.020 A 64 VAL HGy% H 1 0.838 0.020 A 64 VAL C C 13 177.196 0.400 A 64 VAL CA C 13 65.704 0.400 A 64 VAL CB C 13 31.000 0.400 A 64 VAL CGy C 13 23.516 0.400 A 64 VAL CGx C 13 21.970 0.400 A 64 VAL N N 15 120.637 0.400 A 65 ALA H H 1 6.552 0.020 A 65 ALA HA H 1 4.177 0.020 A 65 ALA HB% H 1 1.457 0.020 A 65 ALA C C 13 177.710 0.400 A 65 ALA CA C 13 54.165 0.400 A 65 ALA CB C 13 18.466 0.400 A 65 ALA N N 15 116.848 0.400 A 66 GLN H H 1 7.134 0.020 A 66 GLN HA H 1 4.334 0.020 A 66 GLN HBy H 1 2.349 0.020 A 66 GLN HBx H 1 2.107 0.020 A 66 GLN HE2x H 1 7.005 0.020 A 66 GLN HE2y H 1 7.057 0.020 A 66 GLN HGy H 1 2.493 0.020 A 66 GLN HGx H 1 2.336 0.020 A 66 GLN C C 13 175.697 0.400 A 66 GLN CA C 13 55.488 0.400 A 66 GLN CB C 13 30.108 0.400 A 66 GLN CG C 13 34.408 0.400 A 66 GLN N N 15 112.649 0.400 A 66 GLN NE2 N 15 111.056 0.400 A 67 MET H H 1 7.851 0.020 A 67 MET HA H 1 4.816 0.020 A 67 MET HBy H 1 2.054 0.020 A 67 MET HBx H 1 1.882 0.020 A 67 MET HE% H 1 1.784 0.020 A 67 MET HGy H 1 2.707 0.020 A 67 MET HGx H 1 1.902 0.020 A 67 MET C C 13 171.954 0.400 A 67 MET CA C 13 55.001 0.400 A 67 MET CB C 13 35.886 0.400 A 67 MET CE C 13 17.702 0.400 A 67 MET CG C 13 31.729 0.400 A 67 MET N N 15 122.493 0.400 A 68 SER H H 1 8.108 0.020 A 68 SER HA H 1 4.885 0.020 A 68 SER HBy H 1 3.799 0.020 A 68 SER HBx H 1 2.311 0.020 A 68 SER HG H 1 5.108 0.020 A 68 SER C C 13 176.173 0.400 A 68 SER CA C 13 54.627 0.400 A 68 SER CB C 13 65.918 0.400 A 68 SER N N 15 107.708 0.400 A 69 VAL H H 1 7.515 0.020 A 69 VAL HA H 1 3.067 0.020 A 69 VAL HB H 1 1.808 0.020 A 69 VAL HGx% H 1 0.876 0.020 A 69 VAL HGy% H 1 0.829 0.020 A 69 VAL C C 13 176.552 0.400 A 69 VAL CA C 13 67.002 0.400 A 69 VAL CB C 13 31.681 0.400 A 69 VAL CGy C 13 23.765 0.400 A 69 VAL CGx C 13 21.460 0.400 A 69 VAL N N 15 120.074 0.400 A 70 GLY H H 1 8.870 0.020 A 70 GLY HAy H 1 4.382 0.020 A 70 GLY HAx H 1 3.749 0.020 A 70 GLY C C 13 173.809 0.400 A 70 GLY CA C 13 44.335 0.400 A 70 GLY N N 15 116.701 0.400 A 71 GLN H H 1 8.669 0.020 A 71 GLN HA H 1 4.121 0.020 A 71 GLN HBx H 1 2.128 0.020 A 71 GLN HBy H 1 2.128 0.020 A 71 GLN HE2x H 1 6.479 0.020 A 71 GLN HE2y H 1 7.690 0.020 A 71 GLN HGy H 1 3.095 0.020 A 71 GLN HGx H 1 2.102 0.020 A 71 GLN C C 13 174.178 0.400 A 71 GLN CA C 13 55.600 0.400 A 71 GLN CB C 13 30.488 0.400 A 71 GLN CG C 13 33.494 0.400 A 71 GLN N N 15 123.501 0.400 A 71 GLN NE2 N 15 109.747 0.400 A 72 ARG H H 1 8.636 0.020 A 72 ARG HA H 1 5.578 0.020 A 72 ARG HBy H 1 1.749 0.020 A 72 ARG HBx H 1 1.618 0.020 A 72 ARG HDy H 1 2.971 0.020 A 72 ARG HDx H 1 2.897 0.020 A 72 ARG HGy H 1 1.541 0.020 A 72 ARG HGx H 1 1.386 0.020 A 72 ARG C C 13 175.528 0.400 A 72 ARG CA C 13 53.827 0.400 A 72 ARG CB C 13 33.646 0.400 A 72 ARG CD C 13 43.789 0.400 A 72 ARG CG C 13 27.546 0.400 A 72 ARG N N 15 124.017 0.400 A 73 ALA H H 1 9.802 0.020 A 73 ALA HA H 1 5.175 0.020 A 73 ALA HB% H 1 1.209 0.020 A 73 ALA C C 13 174.432 0.400 A 73 ALA CA C 13 50.938 0.400 A 73 ALA CB C 13 23.525 0.400 A 73 ALA N N 15 130.252 0.400 A 74 LYS H H 1 9.201 0.020 A 74 LYS HA H 1 5.356 0.020 A 74 LYS HBx H 1 1.573 0.020 A 74 LYS HBy H 1 1.573 0.020 A 74 LYS HDy H 1 1.554 0.020 A 74 LYS HDx H 1 1.535 0.020 A 74 LYS HEx H 1 2.758 0.020 A 74 LYS HEy H 1 2.758 0.020 A 74 LYS HGy H 1 1.433 0.020 A 74 LYS HGx H 1 1.158 0.020 A 74 LYS C C 13 175.189 0.400 A 74 LYS CA C 13 54.725 0.400 A 74 LYS CB C 13 33.942 0.400 A 74 LYS CD C 13 29.394 0.400 A 74 LYS CE C 13 41.690 0.400 A 74 LYS CG C 13 25.497 0.400 A 74 LYS N N 15 119.717 0.400 A 75 LEU H H 1 9.574 0.020 A 75 LEU HA H 1 5.272 0.020 A 75 LEU HBy H 1 1.649 0.020 A 75 LEU HBx H 1 1.246 0.020 A 75 LEU HDx% H 1 0.614 0.020 A 75 LEU HDy% H 1 0.814 0.020 A 75 LEU HG H 1 1.525 0.020 A 75 LEU C C 13 176.418 0.400 A 75 LEU CA C 13 53.268 0.400 A 75 LEU CB C 13 43.546 0.400 A 75 LEU CDx C 13 25.598 0.400 A 75 LEU CG C 13 28.110 0.400 A 75 LEU N N 15 125.450 0.400 A 76 VAL H H 1 9.124 0.020 A 76 VAL HA H 1 4.704 0.020 A 76 VAL HB H 1 2.038 0.020 A 76 VAL HGx% H 1 0.752 0.020 A 76 VAL HGy% H 1 0.880 0.020 A 76 VAL C C 13 177.045 0.400 A 76 VAL CA C 13 62.353 0.400 A 76 VAL CB C 13 32.334 0.400 A 76 VAL CGy C 13 20.883 0.400 A 76 VAL CGx C 13 19.873 0.400 A 76 VAL N N 15 126.441 0.400 A 77 CYS H H 1 9.649 0.020 A 77 CYS HA H 1 4.996 0.020 A 77 CYS HBy H 1 3.145 0.020 A 77 CYS HBx H 1 2.653 0.020 A 77 CYS C C 13 173.221 0.400 A 77 CYS CA C 13 57.753 0.400 A 77 CYS CB C 13 29.787 0.400 A 77 CYS N N 15 126.617 0.400 A 78 SER H H 1 8.649 0.020 A 78 SER HA H 1 4.658 0.020 A 78 SER HBy H 1 4.206 0.020 A 78 SER HBx H 1 4.008 0.020 A 78 SER C C 13 172.804 0.400 A 78 SER CA C 13 58.055 0.400 A 78 SER CB C 13 62.088 0.400 A 78 SER N N 15 120.981 0.400 A 79 PRO HA H 1 4.387 0.020 A 79 PRO HBx H 1 1.973 0.020 A 79 PRO HBy H 1 1.973 0.020 A 79 PRO HDx H 1 3.732 0.020 A 79 PRO HDy H 1 3.732 0.020 A 79 PRO HGy H 1 1.908 0.020 A 79 PRO HGx H 1 1.558 0.020 A 79 PRO C C 13 179.963 0.400 A 79 PRO CA C 13 66.459 0.400 A 79 PRO CB C 13 31.261 0.400 A 79 PRO CD C 13 49.749 0.400 A 79 PRO CG C 13 27.784 0.400 A 80 ASP H H 1 8.806 0.020 A 80 ASP HA H 1 4.361 0.020 A 80 ASP HBy H 1 2.605 0.020 A 80 ASP HBx H 1 2.531 0.020 A 80 ASP C C 13 176.421 0.400 A 80 ASP CA C 13 56.142 0.400 A 80 ASP CB C 13 39.358 0.400 A 80 ASP N N 15 115.842 0.400 A 81 TYR H H 1 8.176 0.020 A 81 TYR HA H 1 4.338 0.020 A 81 TYR HBx H 1 2.860 0.020 A 81 TYR HBy H 1 2.860 0.020 A 81 TYR HDx H 1 6.686 0.020 A 81 TYR HDy H 1 6.686 0.020 A 81 TYR C C 13 173.349 0.400 A 81 TYR CA C 13 57.877 0.400 A 81 TYR CB C 13 38.114 0.400 A 81 TYR CDy C 13 131.656 0.400 A 81 TYR N N 15 122.100 0.400 A 82 ALA H H 1 7.762 0.020 A 82 ALA HA H 1 4.376 0.020 A 82 ALA HB% H 1 1.372 0.020 A 82 ALA C C 13 175.937 0.400 A 82 ALA CA C 13 52.187 0.400 A 82 ALA CB C 13 18.889 0.400 A 82 ALA N N 15 125.509 0.400 A 83 TYR H H 1 9.456 0.020 A 83 TYR HA H 1 4.533 0.020 A 83 TYR HBy H 1 3.166 0.020 A 83 TYR HBx H 1 2.621 0.020 A 83 TYR HDx H 1 7.008 0.020 A 83 TYR HDy H 1 7.008 0.020 A 83 TYR HEx H 1 6.462 0.020 A 83 TYR HEy H 1 6.462 0.020 A 83 TYR C C 13 176.565 0.400 A 83 TYR CA C 13 59.098 0.400 A 83 TYR CB C 13 38.043 0.400 A 83 TYR CDy C 13 133.197 0.400 A 83 TYR CEy C 13 117.903 0.400 A 83 TYR N N 15 122.420 0.400 A 84 GLY H H 1 8.547 0.020 A 84 GLY HAy H 1 4.000 0.020 A 84 GLY HAx H 1 3.665 0.020 A 84 GLY C C 13 175.473 0.400 A 84 GLY CA C 13 46.650 0.400 A 84 GLY N N 15 108.224 0.400 A 85 SER HA H 1 4.160 0.020 A 85 SER HBy H 1 3.915 0.020 A 85 SER HBx H 1 3.865 0.020 A 85 SER C C 13 176.922 0.400 A 85 SER CA C 13 60.148 0.400 A 85 SER CB C 13 62.896 0.400 A 86 ARG H H 1 8.271 0.020 A 86 ARG HA H 1 4.182 0.020 A 86 ARG HBx H 1 1.920 0.020 A 86 ARG HBy H 1 1.920 0.020 A 86 ARG HDx H 1 3.189 0.020 A 86 ARG HDy H 1 3.189 0.020 A 86 ARG HGy H 1 1.693 0.020 A 86 ARG HGx H 1 1.651 0.020 A 86 ARG C C 13 179.197 0.400 A 86 ARG CA C 13 57.775 0.400 A 86 ARG CB C 13 31.076 0.400 A 86 ARG CD C 13 43.168 0.400 A 86 ARG CG C 13 27.498 0.400 A 86 ARG N N 15 120.244 0.400 A 87 GLY H H 1 7.310 0.020 A 87 GLY HAy H 1 3.627 0.020 A 87 GLY HAx H 1 3.402 0.020 A 87 GLY C C 13 171.392 0.400 A 87 GLY CA C 13 44.843 0.400 A 87 GLY N N 15 103.692 0.400 A 88 HIS H H 1 8.710 0.020 A 88 HIS HA H 1 5.031 0.020 A 88 HIS HBy H 1 2.468 0.020 A 88 HIS HBx H 1 1.880 0.020 A 88 HIS HD2 H 1 6.421 0.020 A 88 HIS C C 13 172.580 0.400 A 88 HIS CA C 13 52.993 0.400 A 88 HIS CB C 13 32.780 0.400 A 88 HIS N N 15 121.475 0.400 A 89 PRO HA H 1 4.089 0.020 A 89 PRO HBx H 1 1.807 0.020 A 89 PRO HBy H 1 2.149 0.020 A 89 PRO HDy H 1 3.515 0.020 A 89 PRO HDx H 1 3.298 0.020 A 89 PRO HGy H 1 1.931 0.020 A 89 PRO HGx H 1 1.855 0.020 A 89 PRO CA C 13 65.056 0.400 A 89 PRO CB C 13 31.815 0.400 A 89 PRO CD C 13 51.217 0.400 A 89 PRO CG C 13 26.940 0.400 A 90 GLY HAy H 1 4.166 0.020 A 90 GLY HAx H 1 3.548 0.020 A 90 GLY C C 13 174.040 0.400 A 90 GLY CA C 13 45.182 0.400 A 91 VAL H H 1 8.206 0.020 A 91 VAL HA H 1 4.118 0.020 A 91 VAL HB H 1 1.557 0.020 A 91 VAL HGx% H 1 0.894 0.020 A 91 VAL HGy% H 1 0.715 0.020 A 91 VAL C C 13 174.478 0.400 A 91 VAL CA C 13 64.294 0.400 A 91 VAL CB C 13 35.916 0.400 A 91 VAL CGy C 13 21.373 0.400 A 91 VAL CGx C 13 20.795 0.400 A 91 VAL N N 15 119.243 0.400 A 92 ILE H H 1 8.366 0.020 A 92 ILE HA H 1 4.466 0.020 A 92 ILE HB H 1 1.291 0.020 A 92 ILE HD1% H 1 -0.215 0.020 A 92 ILE HG1y H 1 0.711 0.020 A 92 ILE HG1x H 1 0.387 0.020 A 92 ILE HG2% H 1 0.831 0.020 A 92 ILE C C 13 174.440 0.400 A 92 ILE CA C 13 56.215 0.400 A 92 ILE CB C 13 40.820 0.400 A 92 ILE CD1 C 13 11.610 0.400 A 92 ILE CG1 C 13 26.151 0.400 A 92 ILE CG2 C 13 17.787 0.400 A 92 ILE N N 15 119.119 0.400 A 93 PRO HA H 1 4.676 0.020 A 93 PRO HBx H 1 1.861 0.020 A 93 PRO HBy H 1 2.343 0.020 A 93 PRO HDy H 1 3.725 0.020 A 93 PRO HDx H 1 3.301 0.020 A 93 PRO HGy H 1 1.933 0.020 A 93 PRO HGx H 1 1.877 0.020 A 93 PRO CA C 13 62.002 0.400 A 93 PRO CB C 13 31.192 0.400 A 93 PRO CD C 13 51.766 0.400 A 93 PRO CG C 13 26.885 0.400 A 94 PRO HA H 1 3.691 0.020 A 94 PRO HBx H 1 1.655 0.020 A 94 PRO HBy H 1 2.480 0.020 A 94 PRO HDy H 1 3.730 0.020 A 94 PRO HDx H 1 3.441 0.020 A 94 PRO HGy H 1 1.987 0.020 A 94 PRO HGx H 1 1.740 0.020 A 94 PRO C C 13 176.019 0.400 A 94 PRO CA C 13 63.639 0.400 A 94 PRO CB C 13 33.189 0.400 A 94 PRO CD C 13 50.893 0.400 A 94 PRO CG C 13 28.115 0.400 A 95 ASN H H 1 8.160 0.020 A 95 ASN HA H 1 3.885 0.020 A 95 ASN HBy H 1 2.886 0.020 A 95 ASN HBx H 1 2.693 0.020 A 95 ASN HD2x H 1 6.881 0.020 A 95 ASN HD2y H 1 7.567 0.020 A 95 ASN C C 13 173.385 0.400 A 95 ASN CA C 13 54.406 0.400 A 95 ASN CB C 13 37.300 0.400 A 95 ASN N N 15 116.901 0.400 A 95 ASN ND2 N 15 114.362 0.400 A 96 ALA H H 1 7.767 0.020 A 96 ALA HA H 1 4.340 0.020 A 96 ALA HB% H 1 1.172 0.020 A 96 ALA C C 13 177.043 0.400 A 96 ALA CA C 13 52.634 0.400 A 96 ALA CB C 13 20.669 0.400 A 96 ALA N N 15 121.349 0.400 A 97 THR H H 1 8.451 0.020 A 97 THR HA H 1 4.594 0.020 A 97 THR HB H 1 3.924 0.020 A 97 THR HG2% H 1 0.945 0.020 A 97 THR C C 13 175.012 0.400 A 97 THR CA C 13 63.269 0.400 A 97 THR CB C 13 69.280 0.400 A 97 THR CG2 C 13 20.737 0.400 A 97 THR N N 15 121.606 0.400 A 98 LEU H H 1 8.568 0.020 A 98 LEU HA H 1 4.839 0.020 A 98 LEU HBy H 1 1.673 0.020 A 98 LEU HBx H 1 1.220 0.020 A 98 LEU HDx% H 1 1.093 0.020 A 98 LEU HDy% H 1 0.623 0.020 A 98 LEU C C 13 175.060 0.400 A 98 LEU CA C 13 53.303 0.400 A 98 LEU CB C 13 45.999 0.400 A 98 LEU CDy C 13 26.956 0.400 A 98 LEU CDx C 13 23.685 0.400 A 98 LEU N N 15 128.165 0.400 A 99 THR H H 1 8.275 0.020 A 99 THR HA H 1 5.217 0.020 A 99 THR HB H 1 3.886 0.020 A 99 THR HG2% H 1 1.035 0.020 A 99 THR C C 13 173.189 0.400 A 99 THR CA C 13 61.960 0.400 A 99 THR CB C 13 69.970 0.400 A 99 THR CG2 C 13 21.477 0.400 A 99 THR N N 15 117.629 0.400 A 100 PHE H H 1 9.451 0.020 A 100 PHE HA H 1 5.602 0.020 A 100 PHE HBy H 1 2.843 0.020 A 100 PHE HBx H 1 2.703 0.020 A 100 PHE HDx H 1 7.234 0.020 A 100 PHE HDy H 1 7.234 0.020 A 100 PHE HEx H 1 7.429 0.020 A 100 PHE HEy H 1 7.429 0.020 A 100 PHE C C 13 173.902 0.400 A 100 PHE CA C 13 55.638 0.400 A 100 PHE CB C 13 42.687 0.400 A 100 PHE N N 15 123.058 0.400 A 101 ASP H H 1 8.813 0.020 A 101 ASP HA H 1 5.063 0.020 A 101 ASP HBy H 1 2.794 0.020 A 101 ASP HBx H 1 2.464 0.020 A 101 ASP C C 13 176.641 0.400 A 101 ASP CA C 13 53.325 0.400 A 101 ASP CB C 13 41.970 0.400 A 101 ASP N N 15 125.593 0.400 A 102 VAL H H 1 9.562 0.020 A 102 VAL HA H 1 5.001 0.020 A 102 VAL HB H 1 1.723 0.020 A 102 VAL HGx% H 1 0.579 0.020 A 102 VAL HGy% H 1 0.607 0.020 A 102 VAL C C 13 172.994 0.400 A 102 VAL CA C 13 61.143 0.400 A 102 VAL CB C 13 35.199 0.400 A 102 VAL CGy C 13 22.515 0.400 A 102 VAL CGx C 13 21.102 0.400 A 102 VAL N N 15 127.441 0.400 A 103 GLU H H 1 9.073 0.020 A 103 GLU HA H 1 5.294 0.020 A 103 GLU HBy H 1 1.948 0.020 A 103 GLU HBx H 1 1.597 0.020 A 103 GLU HGy H 1 1.953 0.020 A 103 GLU HGx H 1 1.840 0.020 A 103 GLU C C 13 175.255 0.400 A 103 GLU CA C 13 53.860 0.400 A 103 GLU CB C 13 33.796 0.400 A 103 GLU CG C 13 36.066 0.400 A 103 GLU N N 15 127.690 0.400 A 104 LEU H H 1 8.392 0.020 A 104 LEU HA H 1 4.649 0.020 A 104 LEU HBy H 1 2.190 0.020 A 104 LEU HBx H 1 0.965 0.020 A 104 LEU HDx% H 1 0.514 0.020 A 104 LEU HDy% H 1 0.753 0.020 A 104 LEU HG H 1 1.191 0.020 A 104 LEU C C 13 174.583 0.400 A 104 LEU CA C 13 54.245 0.400 A 104 LEU CB C 13 41.304 0.400 A 104 LEU CDy C 13 26.669 0.400 A 104 LEU CDx C 13 23.993 0.400 A 104 LEU CG C 13 28.644 0.400 A 104 LEU N N 15 127.496 0.400 A 105 LEU H H 1 9.122 0.020 A 105 LEU HA H 1 4.190 0.020 A 105 LEU HBy H 1 1.629 0.020 A 105 LEU HBx H 1 1.404 0.020 A 105 LEU HDx% H 1 0.652 0.020 A 105 LEU HDy% H 1 0.749 0.020 A 105 LEU HG H 1 1.668 0.020 A 105 LEU C C 13 177.789 0.400 A 105 LEU CA C 13 57.198 0.400 A 105 LEU CB C 13 42.676 0.400 A 105 LEU CDy C 13 26.156 0.400 A 105 LEU CDx C 13 22.695 0.400 A 105 LEU CG C 13 27.918 0.400 A 105 LEU N N 15 129.426 0.400 A 106 ARG H H 1 7.540 0.020 A 106 ARG HA H 1 4.344 0.020 A 106 ARG HBy H 1 1.758 0.020 A 106 ARG HBx H 1 1.624 0.020 A 106 ARG HDx H 1 3.070 0.020 A 106 ARG HDy H 1 3.070 0.020 A 106 ARG HGx H 1 1.302 0.020 A 106 ARG HGy H 1 1.302 0.020 A 106 ARG C C 13 172.331 0.400 A 106 ARG CA C 13 55.556 0.400 A 106 ARG CB C 13 33.157 0.400 A 106 ARG CD C 13 43.413 0.400 A 106 ARG CG C 13 26.988 0.400 A 106 ARG N N 15 111.747 0.400 A 107 VAL H H 1 8.075 0.020 A 107 VAL HA H 1 4.839 0.020 A 107 VAL HB H 1 1.608 0.020 A 107 VAL HGx% H 1 0.698 0.020 A 107 VAL HGy% H 1 0.565 0.020 A 107 VAL C C 13 175.030 0.400 A 107 VAL CA C 13 60.719 0.400 A 107 VAL CB C 13 34.091 0.400 A 107 VAL CGx C 13 21.748 0.400 A 107 VAL CGy C 13 22.243 0.400 A 107 VAL N N 15 119.614 0.400 A 108 GLU H H 1 9.225 0.020 A 108 GLU HA H 1 4.236 0.020 A 108 GLU HBy H 1 1.930 0.020 A 108 GLU HBx H 1 1.664 0.020 A 108 GLU HGy H 1 1.994 0.020 A 108 GLU HGx H 1 1.843 0.020 A 108 GLU C C 13 180.482 0.400 A 108 GLU CA C 13 56.852 0.400 A 108 GLU CB C 13 32.280 0.400 A 108 GLU CG C 13 36.691 0.400 A 108 GLU N N 15 131.741 0.400 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _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 59 GLY H A 60 TRP H 1.0 . 3.74 2 2 A 59 GLY H A 81 TYR HA 1.0 . 4.46 3 3 A 59 GLY H A 81 TYR HBx 1.0 . 3.34 4 3 A 59 GLY H A 81 TYR HBy 1.0 . 3.34 5 4 A 59 GLY H A 57 ILE HB 1.0 . 3.97 6 5 A 59 GLY H A 58 ARG HBy 1.0 . 4.01 7 6 A 59 GLY H A 57 ILE HG1x 1.0 . 4.08 8 7 A 59 GLY H A 57 ILE HG1y 1.0 . 5.03 9 8 A 59 GLY H A 57 ILE HG2% 1.0 . 4.66 10 9 A 59 GLY H A 81 TYR HD% 1.0 . 4.00 11 10 A 22 VAL H A 108 GLU H 1.0 . 4.50 12 11 A 108 GLU H A 107 VAL H 1.0 . 4.43 13 12 A 108 GLU H A 24 VAL H 1.0 . 4.90 14 13 A 108 GLU H A 107 VAL HA 1.0 . 3.06 15 14 A 108 GLU H A 107 VAL HGx% 1.0 . 4.10 16 15 A 108 GLU H A 107 VAL HGy% 1.0 . 4.10 17 16 A 5 VAL H A 6 VAL H 1.0 . 4.49 18 17 A 49 PHE HD% A 51 VAL H 1.0 . 4.78 19 18 A 6 VAL H A 75 LEU HA 1.0 . 4.28 20 19 A 6 VAL H A 5 VAL HA 1.0 . 3.00 21 20 A 51 VAL H A 50 THR HA 1.0 . 2.76 22 21 A 6 VAL H A 6 VAL HB 1.0 . 3.20 23 22 A 51 VAL H A 51 VAL HB 1.0 . 3.68 24 23 A 6 VAL H A 74 LYS HBx 1.0 . 4.12 25 23 A 6 VAL H A 74 LYS HBy 1.0 . 4.12 26 24 A 6 VAL H A 73 ALA HB% 1.0 . 3.73 27 25 A 6 VAL H A 6 VAL HGy% 1.0 . 3.06 28 26 A 51 VAL H A 51 VAL HGx% 1.0 . 3.91 29 27 A 51 VAL H A 23 ALA H 1.0 . 4.04 30 28 A 51 VAL H A 49 PHE HE% 1.0 . 4.95 31 29 A 72 ARG HA A 73 ALA H 1.0 . 2.96 32 30 A 73 ALA H A 71 GLN HBx 1.0 . 5.50 33 30 A 73 ALA H A 71 GLN HBy 1.0 . 5.50 34 31 A 73 ALA H A 72 ARG HGx 1.0 . 3.81 35 32 A 73 ALA H A 8 LEU HDx% 1.0 . 4.28 36 33 A 73 ALA H A 104 LEU H 1.0 . 5.26 37 34 A 73 ALA HB% A 73 ALA H 1.0 . 3.36 38 35 A 25 VAL H A 105 LEU H 1.0 . 4.91 39 36 A 105 LEU H A 26 HIS H 1.0 . 4.56 40 37 A 105 LEU H A 25 VAL HA 1.0 . 3.55 41 38 A 105 LEU H A 104 LEU HA 1.0 . 3.26 42 39 A 105 LEU H A 106 ARG HA 1.0 . 5.02 43 40 A 105 LEU H A 25 VAL HB 1.0 . 4.35 44 41 A 105 LEU H A 105 LEU HBy 1.0 . 3.37 45 42 A 105 LEU H A 105 LEU HBx 1.0 . 3.70 46 43 A 105 LEU H A 104 LEU HG 1.0 . 4.18 47 44 A 8 LEU H A 73 ALA HA 1.0 . 3.46 48 45 A 8 LEU H A 7 THR HA 1.0 . 3.19 49 46 A 8 LEU H A 8 LEU HG 1.0 . 3.61 50 47 A 8 LEU HDx% A 8 LEU H 1.0 . 3.83 51 48 A 24 VAL H A 23 ALA H 1.0 . 4.65 52 49 A 23 ALA H A 48 ARG HA 1.0 . 4.72 53 50 A 23 ALA H A 22 VAL HA 1.0 . 2.79 54 51 A 23 ALA H A 21 GLN HBx 1.0 . 5.50 55 52 A 23 ALA H A 48 ARG HBy 1.0 . 4.78 56 53 A 23 ALA H A 22 VAL HGy% 1.0 . 4.38 57 54 A 23 ALA H A 23 ALA HB% 1.0 . 3.44 58 55 A 97 THR HA A 98 LEU H 1.0 . 3.11 59 56 A 98 LEU H A 79 PRO HDx 1.0 . 4.48 60 56 A 98 LEU H A 79 PRO HDy 1.0 . 4.48 61 57 A 98 LEU H A 98 LEU HBy 1.0 . 3.92 62 58 A 98 LEU H A 82 ALA HB% 1.0 . 5.11 63 59 A 98 LEU H A 97 THR HG2% 1.0 . 3.33 64 60 A 98 LEU H A 98 LEU HDy% 1.0 . 4.56 65 61 A 27 TYR HA A 103 GLU H 1.0 . 4.08 66 62 A 25 VAL HA A 103 GLU H 1.0 . 4.70 67 63 A 103 GLU H A 102 VAL HA 1.0 . 2.94 68 64 A 104 LEU HA A 103 GLU H 1.0 . 4.96 69 65 A 25 VAL HB A 103 GLU H 1.0 . 4.08 70 66 A 103 GLU H A 103 GLU HBy 1.0 . 3.79 71 67 A 103 GLU H A 67 MET HE% 1.0 . 4.34 72 68 A 103 GLU H A 103 GLU HBx 1.0 . 3.79 73 69 A 103 GLU H A 25 VAL HGy% 1.0 . 5.14 74 70 A 103 GLU H A 25 VAL HGx% 1.0 . 5.14 75 71 A 104 LEU H A 25 VAL HA 1.0 . 5.23 76 72 A 72 ARG HA A 104 LEU H 1.0 . 3.87 77 73 A 104 LEU H A 103 GLU HA 1.0 . 3.00 78 74 A 104 LEU H A 71 GLN HA 1.0 . 5.23 79 75 A 104 LEU H A 104 LEU HBy 1.0 . 3.53 80 76 A 104 LEU H A 67 MET HE% 1.0 . 3.31 81 77 A 104 LEU H A 104 LEU HG 1.0 . 4.57 82 78 A 104 LEU H A 104 LEU HBx 1.0 . 3.53 83 79 A 104 LEU H A 104 LEU HDx% 1.0 . 5.10 84 80 A 73 ALA H A 102 VAL H 1.0 . 3.57 85 81 A 102 VAL H A 74 LYS H 1.0 . 5.08 86 82 A 104 LEU H A 105 LEU H 1.0 . 4.82 87 83 A 102 VAL H A 101 ASP H 1.0 . 4.52 88 84 A 102 VAL H A 28 THR H 1.0 . 5.19 89 85 A 72 ARG HA A 102 VAL H 1.0 . 5.50 90 86 A 102 VAL H A 74 LYS HA 1.0 . 3.70 91 87 A 102 VAL H A 101 ASP HA 1.0 . 2.81 92 88 A 104 LEU H A 69 VAL HA 1.0 . 5.50 93 89 A 102 VAL H A 101 ASP HBy 1.0 . 4.56 94 90 A 102 VAL H A 101 ASP HBx 1.0 . 4.56 95 91 A 102 VAL H A 102 VAL HB 1.0 . 3.83 96 92 A 73 ALA HB% A 102 VAL H 1.0 . 4.41 97 93 A 8 LEU HDx% A 102 VAL H 1.0 . 4.34 98 94 A 104 LEU H A 104 LEU HDy% 1.0 . 5.10 99 95 A 4 GLN H A 76 VAL H 1.0 . 3.59 100 96 A 4 GLN H A 3 VAL HA 1.0 . 2.81 101 97 A 4 GLN H A 4 GLN HBx 1.0 . 3.69 102 98 A 4 GLN H A 3 VAL HGy% 1.0 . 3.17 103 99 A 35 LYS H A 36 VAL H 1.0 . 4.83 104 100 A 36 VAL H A 35 LYS HA 1.0 . 2.67 105 101 A 36 VAL H A 36 VAL HB 1.0 . 2.86 106 102 A 36 VAL H A 35 LYS HGy 1.0 . 5.02 107 103 A 36 VAL H A 35 LYS HGx 1.0 . 5.02 108 104 A 77 CYS H A 100 PHE H 1.0 . 4.61 109 105 A 4 GLN H A 77 CYS H 1.0 . 4.82 110 106 A 77 CYS H A 77 CYS HBx 1.0 . 3.82 111 107 A 77 CYS H A 75 LEU HBx 1.0 . 5.46 112 108 A 77 CYS H A 98 LEU HBy 1.0 . 5.50 113 109 A 77 CYS H A 98 LEU HBx 1.0 . 5.50 114 110 A 76 VAL H A 77 CYS H 1.0 . 4.34 115 111 A 98 LEU H A 77 CYS H 1.0 . 3.94 116 112 A 77 CYS H A 99 THR HA 1.0 . 3.75 117 113 A 77 CYS H A 76 VAL HA 1.0 . 2.97 118 114 A 77 CYS H A 77 CYS HBy 1.0 . 3.82 119 115 A 82 ALA HB% A 77 CYS H 1.0 . 5.30 120 116 A 77 CYS H A 76 VAL HGy% 1.0 . 4.32 121 117 A 77 CYS H A 76 VAL HGx% 1.0 . 4.32 122 118 A 76 VAL H A 75 LEU H 1.0 . 4.30 123 119 A 76 VAL H A 100 PHE H 1.0 . 5.14 124 120 A 75 LEU HA A 76 VAL H 1.0 . 2.86 125 121 A 76 VAL H A 3 VAL HA 1.0 . 5.50 126 122 A 76 VAL H A 77 CYS HA 1.0 . 5.50 127 123 A 76 VAL H A 76 VAL HB 1.0 . 3.24 128 124 A 76 VAL H A 75 LEU HBx 1.0 . 4.54 129 125 A 5 VAL H A 4 GLN H 1.0 . 4.60 130 126 A 5 VAL H A 4 GLN HA 1.0 . 2.80 131 127 A 6 VAL HA A 7 THR H 1.0 . 3.11 132 128 A 5 VAL H A 6 VAL HA 1.0 . 5.24 133 129 A 7 THR H A 7 THR HB 1.0 . 3.44 134 130 A 5 VAL H A 5 VAL HB 1.0 . 3.27 135 131 A 7 THR H A 7 THR HG2% 1.0 . 4.03 136 132 A 7 THR H A 6 VAL HGx% 1.0 . 3.43 137 133 A 101 ASP H A 100 PHE H 1.0 . 4.51 138 134 A 47 PHE H A 48 ARG H 1.0 . 4.49 139 135 A 101 ASP H A 28 THR H 1.0 . 3.57 140 136 A 101 ASP H A 100 PHE HD% 1.0 . 4.48 141 137 A 81 TYR HD% A 82 ALA H 1.0 . 4.84 142 138 A 27 TYR HA A 101 ASP H 1.0 . 5.02 143 139 A 101 ASP H A 100 PHE HA 1.0 . 2.99 144 140 A 48 ARG H A 47 PHE HA 1.0 . 2.92 145 141 A 48 ARG H A 24 VAL HA 1.0 . 4.58 146 142 A 101 ASP H A 28 THR HB 1.0 . 4.18 147 143 A 82 ALA H A 79 PRO HDx 1.0 . 5.50 148 143 A 79 PRO HDy A 82 ALA H 1.0 . 5.50 149 144 A 48 ARG H A 47 PHE HBy 1.0 . 4.47 150 145 A 48 ARG H A 47 PHE HBx 1.0 . 4.47 151 146 A 48 ARG H A 49 PHE HBx 1.0 . 5.50 152 147 A 82 ALA H A 81 TYR HBx 1.0 . 3.79 153 147 A 81 TYR HBy A 82 ALA H 1.0 . 3.79 154 148 A 101 ASP H A 101 ASP HBy 1.0 . 3.74 155 149 A 101 ASP H A 101 ASP HBx 1.0 . 3.74 156 150 A 6 VAL HB A 7 THR H 1.0 . 4.71 157 151 A 57 ILE HB A 82 ALA H 1.0 . 5.18 158 152 A 82 ALA H A 79 PRO HBx 1.0 . 5.50 159 152 A 82 ALA H A 79 PRO HBy 1.0 . 5.50 160 153 A 82 ALA HB% A 82 ALA H 1.0 . 3.27 161 154 A 48 ARG H A 48 ARG HBx 1.0 . 3.20 162 155 A 101 ASP H A 28 THR HG2% 1.0 . 4.42 163 156 A 101 ASP H A 99 THR HG2% 1.0 . 4.50 164 157 A 8 LEU HDx% A 101 ASP H 1.0 . 5.50 165 158 A 57 ILE HG2% A 82 ALA H 1.0 . 4.92 166 159 A 82 ALA H A 83 TYR H 1.0 . 4.39 167 160 A 74 LYS H A 75 LEU H 1.0 . 4.77 168 161 A 75 LEU H A 100 PHE HD% 1.0 . 5.50 169 162 A 74 LYS HA A 75 LEU H 1.0 . 2.83 170 163 A 101 ASP HA A 75 LEU H 1.0 . 3.98 171 164 A 75 LEU H A 76 VAL HB 1.0 . 5.47 172 165 A 75 LEU HBx A 75 LEU H 1.0 . 3.34 173 166 A 75 LEU H A 74 LYS HBx 1.0 . 3.35 174 166 A 74 LYS HBy A 75 LEU H 1.0 . 3.35 175 167 A 75 LEU H A 99 THR HG2% 1.0 . 4.04 176 168 A 82 ALA H A 57 ILE HD1% 1.0 . 4.59 177 169 A 9 ALA HA A 10 ALA H 1.0 . 2.71 178 170 A 10 ALA H A 10 ALA HB% 1.0 . 2.59 179 171 A 7 THR HG2% A 10 ALA H 1.0 . 3.81 180 172 A 16 TYR H A 16 TYR HE% 1.0 . 4.73 181 173 A 16 TYR H A 15 THR HG1 1.0 . 5.39 182 174 A 16 TYR H A 68 SER HA 1.0 . 5.50 183 175 A 16 TYR H A 15 THR HA 1.0 . 2.77 184 176 A 16 TYR H A 16 TYR HBy 1.0 . 3.99 185 177 A 16 TYR H A 16 TYR HBx 1.0 . 3.99 186 178 A 16 TYR H A 16 TYR HD% 1.0 . 3.29 187 179 A 16 TYR H A 14 ALA HB% 1.0 . 5.47 188 180 A 16 TYR H A 15 THR HG2% 1.0 . 3.49 189 181 A 59 GLY H A 58 ARG H 1.0 . 3.83 190 182 A 60 TRP H A 58 ARG H 1.0 . 4.81 191 183 A 58 ARG H A 57 ILE H 1.0 . 4.68 192 184 A 58 ARG H A 82 ALA HA 1.0 . 4.24 193 185 A 58 ARG H A 57 ILE HA 1.0 . 3.00 194 186 A 57 ILE HB A 58 ARG H 1.0 . 3.39 195 187 A 31 LEU HBy A 32 ALA H 1.0 . 3.95 196 188 A 57 ILE HG1x A 58 ARG H 1.0 . 4.48 197 189 A 57 ILE HD1% A 58 ARG H 1.0 . 4.22 198 190 A 57 ILE HG1y A 58 ARG H 1.0 . 5.16 199 191 A 57 ILE HG2% A 58 ARG H 1.0 . 3.70 200 192 A 32 ALA H A 31 LEU H 1.0 . 4.80 201 193 A 32 ALA H A 31 LEU HA 1.0 . 3.52 202 194 A 32 ALA H A 33 ASP HA 1.0 . 5.28 203 195 A 32 ALA H A 31 LEU HBx 1.0 . 3.87 204 196 A 32 ALA H A 32 ALA HB% 1.0 . 3.15 205 197 A 73 ALA H A 72 ARG H 1.0 . 4.61 206 198 A 8 LEU H A 72 ARG H 1.0 . 4.57 207 199 A 17 PRO HA A 18 LYS H 1.0 . 2.76 208 200 A 71 GLN HA A 72 ARG H 1.0 . 2.96 209 201 A 72 ARG H A 71 GLN HGy 1.0 . 3.91 210 202 A 18 LYS H A 21 GLN HBy 1.0 . 3.36 211 203 A 72 ARG H A 9 ALA HB% 1.0 . 3.39 212 204 A 37 PHE H A 37 PHE HD% 1.0 . 3.53 213 205 A 72 ARG H A 71 GLN HE2x 1.0 . 4.84 214 206 A 37 PHE H A 30 THR HA 1.0 . 3.65 215 207 A 103 GLU HA A 72 ARG H 1.0 . 4.81 216 208 A 37 PHE H A 36 VAL HA 1.0 . 3.07 217 209 A 37 PHE H A 30 THR HB 1.0 . 5.50 218 210 A 37 PHE H A 37 PHE HBx 1.0 . 4.11 219 211 A 37 PHE H A 37 PHE HBy 1.0 . 3.97 220 212 A 36 VAL HB A 37 PHE H 1.0 . 4.27 221 213 A 18 LYS H A 18 LYS HBy 1.0 . 3.52 222 214 A 18 LYS H A 18 LYS HBx 1.0 . 3.52 223 215 A 28 THR HG2% A 37 PHE H 1.0 . 4.52 224 216 A 7 THR HG2% A 72 ARG H 1.0 . 4.25 225 217 A 37 PHE H A 36 VAL HGy% 1.0 . 3.45 226 218 A 8 LEU HDx% A 72 ARG H 1.0 . 5.37 227 219 A 27 TYR H A 40 SER H 1.0 . 4.09 228 220 A 40 SER H A 29 GLY H 1.0 . 4.85 229 221 A 40 SER H A 41 ARG H 1.0 . 3.44 230 222 A 47 PHE H A 47 PHE HD% 1.0 . 4.43 231 223 A 47 PHE H A 27 TYR HD% 1.0 . 4.64 232 224 A 40 SER H A 27 TYR HD% 1.0 . 4.35 233 225 A 47 PHE H A 27 TYR HE% 1.0 . 4.50 234 226 A 40 SER H A 27 TYR HE% 1.0 . 4.45 235 227 A 40 SER H A 26 HIS HA 1.0 . 5.50 236 228 A 47 PHE H A 24 VAL HA 1.0 . 5.50 237 229 A 47 PHE H A 40 SER HG 1.0 . 5.50 238 230 A 40 SER H A 39 SER HA 1.0 . 3.13 239 231 A 47 PHE H A 46 PRO HA 1.0 . 3.14 240 232 A 40 SER H A 39 SER HBy 1.0 . 4.38 241 233 A 47 PHE H A 47 PHE HBy 1.0 . 3.54 242 234 A 47 PHE H A 47 PHE HBx 1.0 . 3.54 243 235 A 40 SER H A 27 TYR HBy 1.0 . 5.50 244 236 A 40 SER H A 41 ARG HDx 1.0 . 5.50 245 236 A 40 SER H A 41 ARG HDy 1.0 . 5.50 246 237 A 47 PHE H A 46 PRO HBx 1.0 . 3.74 247 238 A 28 THR HG2% A 40 SER H 1.0 . 4.92 248 239 A 40 SER H A 41 ARG HGy 1.0 . 5.50 249 240 A 47 PHE H A 46 PRO HBy 1.0 . 3.74 250 241 A 47 PHE H A 24 VAL HGx% 1.0 . 3.93 251 242 A 69 VAL HA A 71 GLN H 1.0 . 3.64 252 243 A 67 MET HE% A 71 GLN H 1.0 . 4.19 253 244 A 104 LEU HG A 71 GLN H 1.0 . 5.18 254 245 A 40 SER H A 41 ARG HGx 1.0 . 5.50 255 246 A 71 GLN H A 70 GLY H 1.0 . 3.15 256 247 A 71 GLN H A 69 VAL H 1.0 . 4.87 257 248 A 71 GLN HE2x A 71 GLN H 1.0 . 5.50 258 249 A 103 GLU HA A 71 GLN H 1.0 . 5.20 259 250 A 71 GLN H A 68 SER HG 1.0 . 4.94 260 251 A 71 GLN H A 11 GLY HAx 1.0 . 3.64 261 252 A 71 GLN H A 71 GLN HBx 1.0 . 2.83 262 252 A 71 GLN HBy A 71 GLN H 1.0 . 2.83 263 253 A 71 GLN H A 69 VAL HGx% 1.0 . 4.70 264 254 A 27 TYR H A 41 ARG H 1.0 . 4.93 265 255 A 41 ARG H A 39 SER HA 1.0 . 4.20 266 256 A 41 ARG H A 41 ARG HDx 1.0 . 4.70 267 256 A 41 ARG H A 41 ARG HDy 1.0 . 4.70 268 257 A 41 ARG H A 41 ARG HGy 1.0 . 3.94 269 258 A 41 ARG H A 41 ARG HGx 1.0 . 3.94 270 259 A 100 PHE H A 100 PHE HD% 1.0 . 3.67 271 260 A 100 PHE H A 99 THR HA 1.0 . 2.90 272 261 A 101 ASP HA A 100 PHE H 1.0 . 5.35 273 262 A 100 PHE H A 76 VAL HA 1.0 . 3.88 274 263 A 100 PHE H A 99 THR HB 1.0 . 4.45 275 264 A 100 PHE H A 100 PHE HBy 1.0 . 3.54 276 265 A 100 PHE H A 100 PHE HBx 1.0 . 3.77 277 266 A 100 PHE H A 75 LEU HBx 1.0 . 3.85 278 267 A 100 PHE H A 99 THR HG2% 1.0 . 3.36 279 268 A 13 GLU H A 15 THR H 1.0 . 4.38 280 269 A 16 TYR H A 15 THR H 1.0 . 4.63 281 270 A 69 VAL H A 15 THR H 1.0 . 4.30 282 271 A 72 ARG HA A 9 ALA H 1.0 . 4.82 283 272 A 68 SER HG A 15 THR H 1.0 . 5.50 284 273 A 15 THR HG1 A 15 THR H 1.0 . 4.70 285 274 A 15 THR H A 15 THR HB 1.0 . 3.91 286 275 A 15 THR H A 68 SER HBy 1.0 . 3.89 287 276 A 15 THR H A 13 GLU HA 1.0 . 4.78 288 277 A 15 THR H A 69 VAL HB 1.0 . 4.65 289 278 A 14 ALA HB% A 15 THR H 1.0 . 3.38 290 279 A 15 THR HG2% A 15 THR H 1.0 . 4.18 291 280 A 69 VAL HGx% A 15 THR H 1.0 . 5.24 292 281 A 8 LEU H A 9 ALA H 1.0 . 2.99 293 282 A 72 ARG H A 9 ALA H 1.0 . 3.48 294 283 A 16 TYR HD% A 67 MET H 1.0 . 4.17 295 284 A 73 ALA HA A 9 ALA H 1.0 . 4.19 296 285 A 9 ALA H A 10 ALA HA 1.0 . 4.68 297 286 A 7 THR HA A 9 ALA H 1.0 . 4.24 298 287 A 67 MET H A 66 GLN HGy 1.0 . 5.44 299 288 A 67 MET H A 65 ALA HB% 1.0 . 4.64 300 289 A 9 ALA HB% A 9 ALA H 1.0 . 3.04 301 290 A 7 THR HG2% A 9 ALA H 1.0 . 3.17 302 291 A 8 LEU HDx% A 9 ALA H 1.0 . 4.08 303 292 A 67 MET H A 66 GLN H 1.0 . 3.07 304 293 A 67 MET H A 17 PRO HDy 1.0 . 4.62 305 294 A 67 MET H A 65 ALA HA 1.0 . 4.56 306 295 A 67 MET H A 67 MET HGy 1.0 . 4.45 307 296 A 67 MET H A 66 GLN HGx 1.0 . 5.44 308 297 A 82 ALA HB% A 83 TYR H 1.0 . 3.32 309 298 A 83 TYR H A 83 TYR HD% 1.0 . 4.00 310 299 A 81 TYR H A 79 PRO HBx 1.0 . 4.90 311 299 A 79 PRO HBy A 81 TYR H 1.0 . 4.90 312 300 A 81 TYR H A 80 ASP H 1.0 . 4.08 313 301 A 35 LYS H A 34 GLY H 1.0 . 3.13 314 302 A 35 LYS H A 33 ASP H 1.0 . 3.76 315 303 A 81 TYR H A 78 SER HA 1.0 . 4.95 316 304 A 81 TYR H A 79 PRO HDx 1.0 . 4.92 317 304 A 79 PRO HDy A 81 TYR H 1.0 . 4.92 318 305 A 35 LYS H A 33 ASP HBy 1.0 . 4.70 319 306 A 35 LYS H A 35 LYS HEx 1.0 . 5.38 320 306 A 35 LYS H A 35 LYS HEy 1.0 . 5.38 321 307 A 35 LYS H A 33 ASP HBx 1.0 . 4.70 322 308 A 35 LYS H A 31 LEU HBx 1.0 . 4.32 323 309 A 35 LYS H A 35 LYS HBy 1.0 . 3.42 324 310 A 35 LYS H A 31 LEU HBy 1.0 . 3.10 325 311 A 35 LYS H A 35 LYS HBx 1.0 . 3.42 326 312 A 35 LYS H A 35 LYS HGy 1.0 . 4.79 327 313 A 35 LYS H A 35 LYS HGx 1.0 . 4.79 328 314 A 82 ALA H A 81 TYR H 1.0 . 3.05 329 315 A 81 TYR HD% A 81 TYR H 1.0 . 3.68 330 316 A 81 TYR H A 81 TYR HBx 1.0 . 3.04 331 316 A 81 TYR HBy A 81 TYR H 1.0 . 3.04 332 317 A 96 ALA H A 97 THR H 1.0 . 4.69 333 318 A 97 THR H A 96 ALA HA 1.0 . 2.79 334 319 A 97 THR H A 97 THR HB 1.0 . 3.15 335 320 A 97 THR H A 79 PRO HDx 1.0 . 4.46 336 320 A 79 PRO HDy A 97 THR H 1.0 . 4.46 337 321 A 97 THR H A 96 ALA HB% 1.0 . 3.48 338 322 A 97 THR HG2% A 97 THR H 1.0 . 3.76 339 323 A 88 HIS H A 92 ILE HG1x 1.0 . 4.52 340 324 A 88 HIS H A 92 ILE H 1.0 . 3.58 341 325 A 88 HIS H A 91 VAL H 1.0 . 4.49 342 326 A 88 HIS H A 92 ILE HA 1.0 . 4.55 343 327 A 88 HIS H A 89 PRO HA 1.0 . 5.03 344 328 A 88 HIS H A 87 GLY HAy 1.0 . 3.54 345 329 A 88 HIS H A 87 GLY HAx 1.0 . 3.54 346 330 A 88 HIS H A 86 ARG HDx 1.0 . 5.50 347 330 A 88 HIS H A 86 ARG HDy 1.0 . 5.50 348 331 A 88 HIS H A 88 HIS HBy 1.0 . 3.66 349 332 A 88 HIS H A 88 HIS HBx 1.0 . 3.89 350 333 A 88 HIS H A 91 VAL HB 1.0 . 4.52 351 334 A 88 HIS H A 92 ILE HB 1.0 . 3.22 352 335 A 88 HIS H A 92 ILE HG2% 1.0 . 3.72 353 336 A 88 HIS H A 92 ILE HD1% 1.0 . 4.48 354 337 A 19 ALA H A 20 GLY H 1.0 . 4.61 355 338 A 96 ALA H A 95 ASN HBy 1.0 . 4.68 356 339 A 96 ALA H A 95 ASN HBx 1.0 . 4.68 357 340 A 21 GLN HBy A 19 ALA H 1.0 . 5.27 358 341 A 96 ALA H A 96 ALA HB% 1.0 . 3.10 359 342 A 31 LEU H A 30 THR H 1.0 . 4.56 360 343 A 61 ASP H A 64 VAL H 1.0 . 4.96 361 344 A 22 VAL H A 21 GLN HA 1.0 . 3.06 362 345 A 19 ALA H A 18 LYS HA 1.0 . 2.70 363 346 A 19 ALA H A 19 ALA HB% 1.0 . 2.68 364 347 A 22 VAL H A 22 VAL HGx% 1.0 . 3.95 365 348 A 22 VAL H A 22 VAL HGy% 1.0 . 3.95 366 349 A 59 GLY H A 61 ASP H 1.0 . 4.89 367 350 A 81 TYR H A 78 SER H 1.0 . 4.54 368 351 A 61 ASP H A 63 GLY H 1.0 . 4.57 369 352 A 49 PHE HE% A 61 ASP H 1.0 . 4.64 370 353 A 61 ASP H A 60 TRP HD1 1.0 . 5.26 371 354 A 61 ASP H A 58 ARG HA 1.0 . 3.73 372 355 A 61 ASP H A 59 GLY HAy 1.0 . 4.88 373 356 A 61 ASP H A 61 ASP HBy 1.0 . 3.02 374 357 A 31 LEU H A 31 LEU HG 1.0 . 3.10 375 358 A 22 VAL H A 22 VAL HB 1.0 . 3.04 376 359 A 24 VAL H A 48 ARG HBy 1.0 . 4.95 377 360 A 24 VAL H A 48 ARG HBx 1.0 . 5.38 378 361 A 61 ASP H A 56 VAL HB 1.0 . 4.66 379 362 A 61 ASP H A 56 VAL HGy% 1.0 . 3.46 380 363 A 77 CYS H A 78 SER H 1.0 . 4.50 381 364 A 81 TYR HD% A 78 SER H 1.0 . 5.47 382 365 A 77 CYS HA A 78 SER H 1.0 . 2.74 383 366 A 24 VAL H A 107 VAL HA 1.0 . 4.03 384 367 A 24 VAL H A 23 ALA HA 1.0 . 2.87 385 368 A 78 SER H A 78 SER HBy 1.0 . 3.54 386 369 A 78 SER H A 78 SER HBx 1.0 . 3.54 387 370 A 78 SER H A 79 PRO HDx 1.0 . 4.41 388 370 A 79 PRO HDy A 78 SER H 1.0 . 4.41 389 371 A 78 SER H A 77 CYS HBy 1.0 . 4.19 390 372 A 78 SER H A 81 TYR HBx 1.0 . 3.60 391 372 A 81 TYR HBy A 78 SER H 1.0 . 3.60 392 373 A 78 SER H A 77 CYS HBx 1.0 . 4.19 393 374 A 78 SER H A 3 VAL HB 1.0 . 4.51 394 375 A 24 VAL H A 24 VAL HB 1.0 . 3.34 395 376 A 24 VAL H A 105 LEU HBy 1.0 . 5.49 396 377 A 24 VAL H A 24 VAL HGy% 1.0 . 3.11 397 378 A 35 LYS H A 31 LEU H 1.0 . 4.22 398 379 A 31 LEU H A 33 ASP H 1.0 . 4.97 399 380 A 60 TRP H A 64 VAL H 1.0 . 5.50 400 381 A 31 LEU H A 37 PHE HE% 1.0 . 4.67 401 382 A 31 LEU H A 37 PHE HD% 1.0 . 3.86 402 383 A 64 VAL H A 49 PHE HZ 1.0 . 4.54 403 384 A 31 LEU H A 30 THR HA 1.0 . 3.02 404 385 A 64 VAL H A 60 TRP HA 1.0 . 3.67 405 386 A 31 LEU H A 30 THR HB 1.0 . 3.47 406 387 A 31 LEU H A 37 PHE HBy 1.0 . 5.29 407 388 A 64 VAL H A 64 VAL HB 1.0 . 2.97 408 389 A 65 ALA HB% A 64 VAL H 1.0 . 4.51 409 390 A 31 LEU H A 30 THR HG2% 1.0 . 3.39 410 391 A 64 VAL H A 75 LEU HDx% 1.0 . 4.67 411 392 A 69 VAL H A 12 ASP H 1.0 . 5.17 412 393 A 70 GLY H A 69 VAL H 1.0 . 4.59 413 394 A 69 VAL H A 16 TYR HA 1.0 . 4.40 414 395 A 69 VAL H A 68 SER HG 1.0 . 4.82 415 396 A 68 SER HA A 69 VAL H 1.0 . 3.19 416 397 A 69 VAL H A 15 THR HB 1.0 . 3.44 417 398 A 69 VAL H A 68 SER HBy 1.0 . 3.53 418 399 A 69 VAL H A 13 GLU HA 1.0 . 5.50 419 400 A 69 VAL H A 69 VAL HB 1.0 . 3.13 420 401 A 104 LEU HG A 69 VAL H 1.0 . 5.20 421 402 A 20 GLY H A 21 GLN H 1.0 . 3.17 422 403 A 18 LYS H A 21 GLN H 1.0 . 5.09 423 404 A 21 GLN H A 21 GLN HE2x 1.0 . 4.97 424 405 A 21 GLN H A 19 ALA HA 1.0 . 3.68 425 406 A 21 GLN HBy A 21 GLN H 1.0 . 2.87 426 407 A 21 GLN HBx A 21 GLN H 1.0 . 3.67 427 408 A 19 ALA HB% A 21 GLN H 1.0 . 4.57 428 409 A 73 ALA H A 74 LYS H 1.0 . 4.52 429 410 A 107 VAL H A 24 VAL H 1.0 . 4.99 430 411 A 73 ALA HA A 74 LYS H 1.0 . 3.06 431 412 A 7 THR HA A 74 LYS H 1.0 . 4.32 432 413 A 6 VAL HB A 74 LYS H 1.0 . 3.72 433 414 A 74 LYS H A 74 LYS HBx 1.0 . 3.16 434 414 A 74 LYS HBy A 74 LYS H 1.0 . 3.16 435 415 A 73 ALA HB% A 74 LYS H 1.0 . 3.19 436 416 A 74 LYS H A 8 LEU HDy% 1.0 . 3.91 437 417 A 60 TRP H A 60 TRP HD1 1.0 . 4.03 438 418 A 60 TRP H A 61 ASP HA 1.0 . 5.43 439 419 A 107 VAL H A 106 ARG HA 1.0 . 2.81 440 420 A 107 VAL H A 106 ARG HDx 1.0 . 4.97 441 420 A 107 VAL H A 106 ARG HDy 1.0 . 4.97 442 421 A 60 TRP H A 60 TRP HBy 1.0 . 3.31 443 422 A 60 TRP H A 60 TRP HBx 1.0 . 3.64 444 423 A 60 TRP H A 57 ILE HB 1.0 . 4.44 445 424 A 53 ARG HBx A 55 GLU H 1.0 . 3.85 446 425 A 107 VAL H A 106 ARG HBx 1.0 . 3.77 447 426 A 60 TRP H A 56 VAL HB 1.0 . 4.95 448 427 A 60 TRP H A 82 ALA HB% 1.0 . 5.37 449 428 A 107 VAL H A 106 ARG HGx 1.0 . 4.32 450 428 A 107 VAL H A 106 ARG HGy 1.0 . 4.32 451 429 A 60 TRP H A 57 ILE HG1x 1.0 . 3.38 452 430 A 107 VAL H A 69 VAL HGy% 1.0 . 3.67 453 431 A 60 TRP H A 57 ILE HD1% 1.0 . 3.59 454 432 A 60 TRP H A 57 ILE HG1y 1.0 . 3.85 455 433 A 60 TRP H A 56 VAL HGy% 1.0 . 5.06 456 434 A 55 GLU H A 53 ARG H 1.0 . 4.67 457 435 A 60 TRP H A 63 GLY H 1.0 . 4.87 458 436 A 49 PHE HD% A 55 GLU H 1.0 . 5.50 459 437 A 55 GLU H A 54 GLY HAx 1.0 . 3.49 460 437 A 55 GLU H A 54 GLY HAy 1.0 . 3.49 461 438 A 55 GLU H A 55 GLU HBy 1.0 . 3.20 462 439 A 55 GLU H A 53 ARG HGx 1.0 . 4.95 463 440 A 56 VAL HGy% A 55 GLU H 1.0 . 4.07 464 441 A 51 VAL H A 50 THR H 1.0 . 4.51 465 442 A 49 PHE HD% A 50 THR H 1.0 . 3.83 466 443 A 50 THR H A 49 PHE HA 1.0 . 2.99 467 444 A 50 THR H A 50 THR HB 1.0 . 3.23 468 445 A 50 THR H A 49 PHE HBy 1.0 . 3.05 469 446 A 91 VAL H A 88 HIS HBy 1.0 . 4.64 470 447 A 55 GLU HBy A 50 THR H 1.0 . 4.09 471 448 A 53 ARG HBx A 50 THR H 1.0 . 5.29 472 449 A 50 THR H A 53 ARG HGy 1.0 . 5.50 473 450 A 50 THR H A 50 THR HG2% 1.0 . 4.00 474 451 A 91 VAL H A 91 VAL HGx% 1.0 . 4.04 475 452 A 91 VAL H A 91 VAL HGy% 1.0 . 4.04 476 453 A 92 ILE H A 91 VAL H 1.0 . 3.03 477 454 A 92 ILE H A 88 HIS HBy 1.0 . 3.59 478 455 A 92 ILE H A 91 VAL HB 1.0 . 3.28 479 456 A 91 VAL H A 91 VAL HB 1.0 . 3.33 480 457 A 92 ILE H A 91 VAL HGy% 1.0 . 3.62 481 458 A 92 ILE HG1x A 92 ILE H 1.0 . 4.04 482 459 A 92 ILE H A 92 ILE HD1% 1.0 . 4.34 483 460 A 26 HIS H A 26 HIS HD2 1.0 . 4.80 484 461 A 92 ILE H A 88 HIS HA 1.0 . 4.87 485 462 A 92 ILE H A 93 PRO HDy 1.0 . 5.10 486 463 A 92 ILE H A 93 PRO HDx 1.0 . 5.10 487 464 A 92 ILE H A 88 HIS HBx 1.0 . 3.88 488 465 A 92 ILE H A 92 ILE HB 1.0 . 3.55 489 466 A 26 HIS H A 103 GLU H 1.0 . 3.56 490 467 A 26 HIS H A 25 VAL HA 1.0 . 3.00 491 468 A 26 HIS H A 104 LEU HA 1.0 . 4.38 492 469 A 26 HIS H A 25 VAL HB 1.0 . 4.07 493 470 A 37 PHE HE% A 38 ASP H 1.0 . 5.11 494 471 A 37 PHE HD% A 38 ASP H 1.0 . 3.65 495 472 A 27 TYR HD% A 60 TRP HE1 1.0 . 5.43 496 473 A 38 ASP H A 38 ASP HBy 1.0 . 3.87 497 474 A 60 TRP HE1 A 27 TYR HBx 1.0 . 4.50 498 475 A 37 PHE HBy A 38 ASP H 1.0 . 4.33 499 476 A 38 ASP H A 38 ASP HBx 1.0 . 3.87 500 477 A 57 ILE HD1% A 60 TRP HE1 1.0 . 3.90 501 478 A 15 THR H A 14 ALA H 1.0 . 3.00 502 479 A 16 TYR HE% A 14 ALA H 1.0 . 4.89 503 480 A 68 SER HG A 14 ALA H 1.0 . 4.48 504 481 A 60 TRP HA A 60 TRP HE1 1.0 . 4.84 505 482 A 14 ALA H A 12 ASP HA 1.0 . 5.15 506 483 A 15 THR HA A 14 ALA H 1.0 . 5.50 507 484 A 15 THR HB A 14 ALA H 1.0 . 5.50 508 485 A 68 SER HBy A 14 ALA H 1.0 . 3.77 509 486 A 75 LEU HBx A 60 TRP HE1 1.0 . 4.67 510 487 A 14 ALA HB% A 14 ALA H 1.0 . 3.18 511 488 A 4 GLN H A 3 VAL H 1.0 . 4.37 512 489 A 39 SER H A 38 ASP HBy 1.0 . 4.74 513 490 A 3 VAL H A 2 GLY HAx 1.0 . 3.19 514 491 A 3 VAL HB A 3 VAL H 1.0 . 3.58 515 492 A 3 VAL H A 3 VAL HGx% 1.0 . 2.98 516 493 A 39 SER H A 38 ASP HA 1.0 . 3.23 517 494 A 44 GLY H A 45 LYS H 1.0 . 3.67 518 495 A 45 LYS H A 43 ARG H 1.0 . 3.82 519 496 A 45 LYS H A 43 ARG HA 1.0 . 4.86 520 497 A 45 LYS H A 46 PRO HDx 1.0 . 4.13 521 498 A 45 LYS H A 45 LYS HBy 1.0 . 3.70 522 499 A 45 LYS H A 45 LYS HBx 1.0 . 3.70 523 500 A 45 LYS H A 45 LYS HGx 1.0 . 4.18 524 500 A 45 LYS H A 45 LYS HGy 1.0 . 4.18 525 501 A 13 GLU H A 12 ASP H 1.0 . 3.36 526 502 A 68 SER HG A 12 ASP H 1.0 . 4.16 527 503 A 12 ASP H A 70 GLY HAx 1.0 . 4.02 528 504 A 68 SER HBy A 12 ASP H 1.0 . 3.83 529 505 A 11 GLY HAx A 12 ASP H 1.0 . 3.05 530 506 A 12 ASP H A 12 ASP HBy 1.0 . 3.69 531 507 A 12 ASP H A 12 ASP HBx 1.0 . 3.69 532 508 A 12 ASP H A 71 GLN HBx 1.0 . 4.00 533 508 A 71 GLN HBy A 12 ASP H 1.0 . 4.00 534 509 A 69 VAL HB A 12 ASP H 1.0 . 4.36 535 510 A 69 VAL HGx% A 12 ASP H 1.0 . 4.46 536 511 A 53 ARG H A 52 GLY H 1.0 . 3.47 537 512 A 53 ARG H A 56 VAL H 1.0 . 5.23 538 513 A 53 ARG H A 51 VAL HA 1.0 . 3.92 539 514 A 53 ARG H A 53 ARG HBy 1.0 . 3.66 540 515 A 53 ARG H A 53 ARG HGy 1.0 . 3.26 541 516 A 53 ARG H A 53 ARG HGx 1.0 . 4.19 542 517 A 53 ARG H A 55 GLU HGx 1.0 . 5.41 543 517 A 53 ARG H A 55 GLU HGy 1.0 . 5.41 544 518 A 100 PHE H A 99 THR H 1.0 . 4.59 545 519 A 98 LEU H A 99 THR H 1.0 . 4.60 546 520 A 100 PHE HD% A 99 THR H 1.0 . 4.32 547 521 A 99 THR H A 98 LEU HA 1.0 . 3.18 548 522 A 99 THR HG2% A 99 THR H 1.0 . 4.01 549 523 A 99 THR H A 98 LEU HDy% 1.0 . 4.94 550 524 A 25 VAL H A 26 HIS H 1.0 . 4.79 551 525 A 37 PHE H A 29 GLY H 1.0 . 4.45 552 526 A 24 VAL H A 25 VAL H 1.0 . 4.52 553 527 A 25 VAL H A 48 ARG H 1.0 . 5.23 554 528 A 29 GLY H A 100 PHE HE% 1.0 . 5.50 555 529 A 25 VAL H A 47 PHE HD% 1.0 . 5.29 556 530 A 100 PHE HD% A 29 GLY H 1.0 . 4.27 557 531 A 29 GLY H A 27 TYR HD% 1.0 . 4.25 558 532 A 29 GLY H A 38 ASP H 1.0 . 4.85 559 533 A 100 PHE HA A 29 GLY H 1.0 . 5.24 560 534 A 25 VAL H A 48 ARG HA 1.0 . 3.89 561 535 A 25 VAL H A 24 VAL HA 1.0 . 2.95 562 536 A 99 THR HB A 99 THR H 1.0 . 3.38 563 537 A 25 VAL H A 25 VAL HB 1.0 . 4.17 564 538 A 25 VAL H A 24 VAL HB 1.0 . 4.39 565 539 A 25 VAL H A 105 LEU HBy 1.0 . 5.28 566 540 A 25 VAL H A 48 ARG HBx 1.0 . 4.73 567 541 A 28 THR HG2% A 29 GLY H 1.0 . 3.40 568 542 A 25 VAL H A 25 VAL HGy% 1.0 . 4.12 569 543 A 25 VAL H A 25 VAL HGx% 1.0 . 4.12 570 544 A 25 VAL H A 24 VAL HGx% 1.0 . 3.21 571 545 A 51 VAL H A 49 PHE H 1.0 . 5.50 572 546 A 30 THR H A 99 THR H 1.0 . 4.14 573 547 A 100 PHE HD% A 30 THR H 1.0 . 4.10 574 548 A 30 THR H A 29 GLY HAx 1.0 . 3.26 575 549 A 36 VAL HA A 30 THR H 1.0 . 5.20 576 550 A 30 THR H A 29 GLY HAy 1.0 . 3.40 577 551 A 30 THR H A 30 THR HG2% 1.0 . 4.01 578 552 A 26 HIS H A 27 TYR H 1.0 . 5.00 579 553 A 28 THR H A 27 TYR H 1.0 . 5.38 580 554 A 49 PHE HE% A 49 PHE H 1.0 . 4.84 581 555 A 37 PHE HD% A 30 THR H 1.0 . 4.54 582 556 A 27 TYR H A 27 TYR HD% 1.0 . 3.79 583 557 A 27 TYR H A 26 HIS HA 1.0 . 3.32 584 558 A 100 PHE HA A 30 THR H 1.0 . 3.92 585 559 A 27 TYR H A 40 SER HBy 1.0 . 4.74 586 560 A 27 TYR H A 40 SER HG 1.0 . 4.71 587 561 A 30 THR HB A 30 THR H 1.0 . 3.96 588 562 A 27 TYR H A 46 PRO HA 1.0 . 4.98 589 563 A 27 TYR H A 40 SER HBx 1.0 . 4.74 590 564 A 27 TYR H A 27 TYR HBy 1.0 . 3.93 591 565 A 28 THR HG2% A 30 THR H 1.0 . 5.20 592 566 A 36 VAL HGy% A 30 THR H 1.0 . 5.50 593 567 A 50 THR H A 49 PHE H 1.0 . 4.63 594 568 A 49 PHE HD% A 49 PHE H 1.0 . 3.47 595 569 A 48 ARG HA A 49 PHE H 1.0 . 2.86 596 570 A 22 VAL HA A 49 PHE H 1.0 . 4.20 597 571 A 49 PHE HBx A 49 PHE H 1.0 . 3.67 598 572 A 96 ALA H A 95 ASN H 1.0 . 4.07 599 573 A 95 ASN H A 85 SER HA 1.0 . 3.73 600 574 A 95 ASN H A 94 PRO HA 1.0 . 3.16 601 575 A 95 ASN H A 95 ASN HBy 1.0 . 4.12 602 576 A 95 ASN H A 95 ASN HBx 1.0 . 4.12 603 577 A 95 ASN H A 94 PRO HBx 1.0 . 4.16 604 578 A 95 ASN H A 79 PRO HBx 1.0 . 3.94 605 578 A 79 PRO HBy A 95 ASN H 1.0 . 3.94 606 579 A 95 ASN H A 94 PRO HBy 1.0 . 4.37 607 580 A 96 ALA HB% A 95 ASN H 1.0 . 4.95 608 581 A 64 VAL H A 65 ALA H 1.0 . 3.13 609 582 A 64 VAL HB A 65 ALA H 1.0 . 4.09 610 583 A 65 ALA HB% A 65 ALA H 1.0 . 2.75 611 584 A 104 LEU H A 70 GLY H 1.0 . 4.94 612 585 A 70 GLY H A 11 GLY HAx 1.0 . 4.98 613 586 A 69 VAL HA A 70 GLY H 1.0 . 2.89 614 587 A 70 GLY H A 69 VAL HB 1.0 . 4.53 615 588 A 104 LEU HG A 70 GLY H 1.0 . 4.80 616 589 A 70 GLY H A 69 VAL HGx% 1.0 . 3.20 617 590 A 103 GLU H A 28 THR H 1.0 . 5.50 618 591 A 28 THR H A 29 GLY H 1.0 . 4.71 619 592 A 51 VAL H A 52 GLY H 1.0 . 4.69 620 593 A 28 THR H A 100 PHE HD% 1.0 . 4.84 621 594 A 28 THR H A 27 TYR HD% 1.0 . 4.12 622 595 A 27 TYR HA A 28 THR H 1.0 . 3.07 623 596 A 28 THR H A 100 PHE HA 1.0 . 4.52 624 597 A 102 VAL HA A 28 THR H 1.0 . 4.02 625 598 A 28 THR H A 28 THR HB 1.0 . 3.77 626 599 A 52 GLY H A 61 ASP HBx 1.0 . 5.14 627 600 A 28 THR H A 29 GLY HAy 1.0 . 5.45 628 601 A 51 VAL HB A 52 GLY H 1.0 . 4.46 629 602 A 28 THR H A 28 THR HG2% 1.0 . 4.19 630 603 A 52 GLY H A 51 VAL HGx% 1.0 . 4.46 631 604 A 49 PHE HE% A 52 GLY H 1.0 . 4.19 632 605 A 49 PHE HD% A 52 GLY H 1.0 . 4.81 633 606 A 61 ASP HA A 52 GLY H 1.0 . 4.26 634 607 A 52 GLY H A 51 VAL HA 1.0 . 2.87 635 608 A 61 ASP HBy A 52 GLY H 1.0 . 4.90 636 609 A 52 GLY H A 51 VAL HGy% 1.0 . 4.46 637 610 A 80 ASP H A 78 SER HBy 1.0 . 4.96 638 611 A 82 ALA H A 80 ASP H 1.0 . 4.98 639 612 A 80 ASP H A 78 SER HBx 1.0 . 4.96 640 613 A 80 ASP H A 79 PRO HDx 1.0 . 4.46 641 613 A 79 PRO HDy A 80 ASP H 1.0 . 4.46 642 614 A 80 ASP H A 81 TYR HBx 1.0 . 4.94 643 614 A 81 TYR HBy A 80 ASP H 1.0 . 4.94 644 615 A 80 ASP H A 79 PRO HBx 1.0 . 4.11 645 615 A 79 PRO HBy A 80 ASP H 1.0 . 4.11 646 616 A 13 GLU H A 14 ALA H 1.0 . 3.50 647 617 A 16 TYR HE% A 13 GLU H 1.0 . 5.39 648 618 A 68 SER HG A 13 GLU H 1.0 . 3.37 649 619 A 13 GLU H A 68 SER HBy 1.0 . 3.54 650 620 A 13 GLU H A 12 ASP HBy 1.0 . 4.75 651 621 A 13 GLU H A 13 GLU HGy 1.0 . 4.87 652 622 A 13 GLU H A 13 GLU HGx 1.0 . 4.87 653 623 A 14 ALA HB% A 13 GLU H 1.0 . 4.68 654 624 A 68 SER HA A 13 GLU H 1.0 . 5.17 655 625 A 95 ASN HA A 95 ASN HD2x 1.0 . 4.86 656 626 A 95 ASN HA A 95 ASN HD2y 1.0 . 4.86 657 627 A 13 GLU H A 12 ASP HBx 1.0 . 4.75 658 628 A 94 PRO HBx A 95 ASN HD2x 1.0 . 5.02 659 629 A 94 PRO HBy A 95 ASN HD2y 1.0 . 4.74 660 630 A 32 ALA H A 33 ASP H 1.0 . 4.05 661 631 A 34 GLY H A 33 ASP H 1.0 . 3.21 662 632 A 31 LEU HA A 33 ASP H 1.0 . 4.22 663 633 A 33 ASP H A 34 GLY HAy 1.0 . 4.88 664 634 A 33 ASP H A 33 ASP HBy 1.0 . 3.68 665 635 A 33 ASP H A 33 ASP HBx 1.0 . 3.68 666 636 A 31 LEU HBx A 33 ASP H 1.0 . 3.78 667 637 A 31 LEU HBy A 33 ASP H 1.0 . 3.62 668 638 A 94 PRO HBy A 95 ASN HD2x 1.0 . 4.74 669 639 A 32 ALA HB% A 33 ASP H 1.0 . 3.42 670 640 A 33 ASP H A 31 LEU HDx% 1.0 . 4.84 671 641 A 33 ASP H A 31 LEU HDy% 1.0 . 4.84 672 642 A 64 VAL H A 62 GLU H 1.0 . 4.90 673 643 A 61 ASP H A 62 GLU H 1.0 . 3.38 674 644 A 59 GLY HAy A 62 GLU H 1.0 . 4.38 675 645 A 62 GLU H A 63 GLY HAx 1.0 . 4.62 676 645 A 62 GLU H A 63 GLY HAy 1.0 . 4.62 677 646 A 61 ASP HBx A 62 GLU H 1.0 . 3.49 678 647 A 62 GLU H A 62 GLU HBy 1.0 . 3.76 679 648 A 62 GLU H A 62 GLU HBx 1.0 . 3.76 680 649 A 3 VAL HGy% A 62 GLU H 1.0 . 5.50 681 650 A 3 VAL HGx% A 62 GLU H 1.0 . 5.50 682 651 A 62 GLU H A 75 LEU HDy% 1.0 . 5.50 683 652 A 62 GLU H A 75 LEU HDx% 1.0 . 5.50 684 653 A 56 VAL HGy% A 62 GLU H 1.0 . 5.50 685 654 A 66 GLN H A 64 VAL H 1.0 . 4.34 686 655 A 66 GLN H A 65 ALA H 1.0 . 3.29 687 656 A 65 ALA HB% A 66 GLN H 1.0 . 3.46 688 657 A 55 GLU H A 54 GLY H 1.0 . 3.38 689 658 A 56 VAL H A 54 GLY H 1.0 . 4.69 690 659 A 54 GLY H A 54 GLY HAx 1.0 . 2.73 691 659 A 54 GLY HAy A 54 GLY H 1.0 . 2.73 692 660 A 53 ARG HBy A 54 GLY H 1.0 . 4.10 693 661 A 54 GLY H A 55 GLU HGx 1.0 . 4.55 694 661 A 55 GLU HGy A 54 GLY H 1.0 . 4.55 695 662 A 53 ARG HBx A 54 GLY H 1.0 . 4.10 696 663 A 53 ARG HGx A 54 GLY H 1.0 . 4.71 697 664 A 56 VAL HGy% A 54 GLY H 1.0 . 5.50 698 665 A 105 LEU H A 106 ARG H 1.0 . 3.20 699 666 A 107 VAL HA A 106 ARG H 1.0 . 5.00 700 667 A 106 ARG H A 106 ARG HDx 1.0 . 4.52 701 667 A 106 ARG HDy A 106 ARG H 1.0 . 4.52 702 668 A 24 VAL H A 106 ARG H 1.0 . 3.51 703 669 A 25 VAL HA A 106 ARG H 1.0 . 4.53 704 670 A 104 LEU HA A 106 ARG H 1.0 . 4.47 705 671 A 60 TRP H A 57 ILE H 1.0 . 4.10 706 672 A 57 ILE H A 56 VAL HA 1.0 . 3.15 707 673 A 57 ILE H A 60 TRP HBy 1.0 . 4.21 708 674 A 57 ILE H A 60 TRP HBx 1.0 . 4.43 709 675 A 57 ILE HB A 57 ILE H 1.0 . 4.17 710 676 A 57 ILE H A 56 VAL HB 1.0 . 3.06 711 677 A 57 ILE HG1x A 57 ILE H 1.0 . 3.55 712 678 A 57 ILE HD1% A 57 ILE H 1.0 . 3.96 713 679 A 57 ILE HG1y A 57 ILE H 1.0 . 3.28 714 680 A 57 ILE HG2% A 57 ILE H 1.0 . 3.02 715 681 A 1 MET HA A 4 GLN HE2x 1.0 . 4.86 716 682 A 1 MET HA A 4 GLN HE2y 1.0 . 4.86 717 683 A 3 VAL HGx% A 4 GLN HE2x 1.0 . 5.10 718 684 A 3 VAL HGx% A 4 GLN HE2y 1.0 . 5.10 719 685 A 66 GLN HE2y A 63 GLY HAx 1.0 . 4.27 720 685 A 63 GLY HAy A 66 GLN HE2y 1.0 . 4.27 721 686 A 66 GLN HE2x A 63 GLY HAx 1.0 . 3.92 722 686 A 63 GLY HAy A 66 GLN HE2x 1.0 . 3.92 723 687 A 66 GLN HE2x A 66 GLN HBy 1.0 . 4.80 724 688 A 66 GLN HE2x A 66 GLN HBx 1.0 . 4.80 725 689 A 65 ALA HB% A 66 GLN HE2x 1.0 . 4.97 726 690 A 3 VAL HGy% A 66 GLN HE2y 1.0 . 4.46 727 691 A 3 VAL HGx% A 66 GLN HE2y 1.0 . 4.66 728 692 A 3 VAL HGy% A 66 GLN HE2x 1.0 . 5.28 729 693 A 3 VAL HGx% A 66 GLN HE2x 1.0 . 5.50 730 694 A 21 GLN HA A 21 GLN HE2x 1.0 . 5.04 731 695 A 21 GLN HBx A 21 GLN HE2y 1.0 . 4.48 732 696 A 21 GLN HBx A 21 GLN HE2x 1.0 . 4.20 733 697 A 20 GLY H A 19 ALA HA 1.0 . 2.80 734 698 A 20 GLY H A 19 ALA HB% 1.0 . 3.36 735 699 A 21 GLN HBy A 20 GLY H 1.0 . 4.65 736 700 A 10 ALA HA A 71 GLN HE2y 1.0 . 5.50 737 701 A 71 GLN HE2x A 10 ALA HA 1.0 . 4.87 738 702 A 7 THR HA A 71 GLN HE2y 1.0 . 4.73 739 703 A 7 THR HA A 71 GLN HE2x 1.0 . 4.40 740 704 A 67 MET HE% A 71 GLN HE2x 1.0 . 4.66 741 705 A 7 THR HG2% A 71 GLN HE2y 1.0 . 3.88 742 706 A 7 THR HG2% A 71 GLN HE2x 1.0 . 3.64 743 707 A 55 GLU H A 56 VAL H 1.0 . 3.11 744 708 A 56 VAL H A 54 GLY HAx 1.0 . 3.75 745 708 A 54 GLY HAy A 56 VAL H 1.0 . 3.75 746 709 A 55 GLU HBy A 56 VAL H 1.0 . 3.69 747 710 A 56 VAL HB A 56 VAL H 1.0 . 4.14 748 711 A 34 GLY H A 33 ASP HBy 1.0 . 4.56 749 712 A 32 ALA HB% A 34 GLY H 1.0 . 4.53 750 713 A 34 GLY H A 30 THR HG2% 1.0 . 4.57 751 714 A 83 TYR HD% A 84 GLY H 1.0 . 4.76 752 715 A 34 GLY H A 33 ASP HBx 1.0 . 4.56 753 716 A 83 TYR H A 84 GLY H 1.0 . 3.48 754 717 A 82 ALA H A 84 GLY H 1.0 . 3.98 755 718 A 84 GLY H A 79 PRO HA 1.0 . 3.58 756 719 A 84 GLY H A 79 PRO HBx 1.0 . 3.75 757 719 A 79 PRO HBy A 84 GLY H 1.0 . 3.75 758 720 A 64 VAL H A 63 GLY H 1.0 . 3.22 759 721 A 63 GLY H A 62 GLU H 1.0 . 3.21 760 722 A 63 GLY H A 66 GLN HE2x 1.0 . 4.44 761 723 A 63 GLY H A 65 ALA H 1.0 . 4.29 762 724 A 63 GLY H A 63 GLY HAx 1.0 . 2.78 763 724 A 63 GLY H A 63 GLY HAy 1.0 . 2.78 764 725 A 63 GLY H A 61 ASP HBx 1.0 . 4.95 765 726 A 63 GLY H A 62 GLU HBy 1.0 . 3.73 766 727 A 63 GLY H A 62 GLU HBx 1.0 . 3.73 767 728 A 65 ALA HB% A 63 GLY H 1.0 . 4.61 768 729 A 3 VAL HGy% A 63 GLY H 1.0 . 3.83 769 730 A 63 GLY H A 75 LEU HDy% 1.0 . 4.02 770 731 A 63 GLY H A 75 LEU HDx% 1.0 . 4.02 771 732 A 82 ALA HB% A 84 GLY H 1.0 . 3.26 772 733 A 12 ASP H A 11 GLY H 1.0 . 4.16 773 734 A 68 SER HG A 11 GLY H 1.0 . 4.52 774 735 A 10 ALA HA A 11 GLY H 1.0 . 2.77 775 736 A 11 GLY H A 71 GLN HBx 1.0 . 3.58 776 736 A 71 GLN HBy A 11 GLY H 1.0 . 3.58 777 737 A 7 THR HG2% A 11 GLY H 1.0 . 4.92 778 738 A 69 VAL H A 68 SER H 1.0 . 4.68 779 739 A 16 TYR HD% A 68 SER H 1.0 . 4.92 780 740 A 16 TYR HE% A 68 SER H 1.0 . 4.56 781 741 A 68 SER HG A 68 SER H 1.0 . 3.47 782 742 A 68 SER H A 67 MET HA 1.0 . 3.19 783 743 A 71 GLN HA A 68 SER H 1.0 . 5.50 784 744 A 68 SER HBy A 68 SER H 1.0 . 4.15 785 745 A 13 GLU HA A 68 SER H 1.0 . 5.29 786 746 A 68 SER H A 67 MET HBx 1.0 . 3.94 787 747 A 104 LEU HG A 68 SER H 1.0 . 5.50 788 748 A 44 GLY H A 43 ARG H 1.0 . 4.91 789 749 A 44 GLY H A 45 LYS HA 1.0 . 5.49 790 750 A 44 GLY H A 43 ARG HGx 1.0 . 5.50 791 751 A 88 HIS H A 87 GLY H 1.0 . 4.65 792 752 A 87 GLY H A 86 ARG H 1.0 . 4.28 793 753 A 87 GLY H A 83 TYR HA 1.0 . 4.82 794 754 A 87 GLY H A 86 ARG HDx 1.0 . 4.06 795 754 A 86 ARG HDy A 87 GLY H 1.0 . 4.06 796 755 A 87 GLY H A 86 ARG HBx 1.0 . 3.43 797 755 A 87 GLY H A 86 ARG HBy 1.0 . 3.43 798 756 A 87 GLY H A 86 ARG HGy 1.0 . 4.82 799 757 A 92 ILE HG2% A 87 GLY H 1.0 . 4.72 800 758 A 59 GLY H A 81 TYR H 1.0 . 5.50 801 759 A 51 VAL H A 53 ARG H 1.0 . 5.07 802 760 A 73 ALA H A 9 ALA H 1.0 . 5.04 803 761 A 105 LEU H A 69 VAL HA 1.0 . 5.02 804 762 A 73 ALA H A 8 LEU H 1.0 . 5.29 805 763 A 49 PHE HD% A 23 ALA H 1.0 . 5.08 806 764 A 23 ALA H A 24 VAL HA 1.0 . 5.47 807 765 A 23 ALA H A 49 PHE HA 1.0 . 5.50 808 766 A 103 GLU H A 27 TYR H 1.0 . 5.39 809 767 A 73 ALA H A 103 GLU H 1.0 . 5.50 810 768 A 27 TYR HA A 102 VAL H 1.0 . 5.09 811 769 A 36 VAL H A 30 THR HA 1.0 . 5.00 812 770 A 36 VAL H A 35 LYS HEx 1.0 . 5.31 813 770 A 36 VAL H A 35 LYS HEy 1.0 . 5.31 814 771 A 77 CYS H A 100 PHE HD% 1.0 . 5.50 815 772 A 7 THR H A 7 THR HG1 1.0 . 5.06 816 773 A 81 TYR HD% A 58 ARG H 1.0 . 5.12 817 774 A 32 ALA H A 34 GLY H 1.0 . 5.01 818 775 A 18 LYS H A 21 GLN HE2y 1.0 . 5.01 819 776 A 41 ARG H A 26 HIS HE1 1.0 . 5.08 820 777 A 100 PHE H A 29 GLY HAy 1.0 . 5.50 821 778 A 67 MET H A 16 TYR HA 1.0 . 5.41 822 779 A 35 LYS H A 31 LEU HA 1.0 . 5.50 823 780 A 61 ASP H A 49 PHE HZ 1.0 . 5.10 824 781 A 24 VAL H A 48 ARG HA 1.0 . 5.04 825 782 A 74 LYS H A 6 VAL HA 1.0 . 5.15 826 783 A 92 ILE HG1x A 91 VAL H 1.0 . 5.04 827 784 A 14 ALA H A 12 ASP HBy 1.0 . 5.02 828 785 A 14 ALA H A 12 ASP HBx 1.0 . 5.02 829 786 A 43 ARG H A 42 THR HB 1.0 . 5.28 830 787 A 77 CYS H A 99 THR H 1.0 . 5.44 831 788 A 61 ASP HA A 65 ALA H 1.0 . 5.05 832 789 A 65 ALA H A 67 MET HGy 1.0 . 5.50 833 790 A 50 THR HA A 52 GLY H 1.0 . 5.50 834 791 A 13 GLU H A 14 ALA HA 1.0 . 5.50 835 792 A 94 PRO HBx A 95 ASN HD2y 1.0 . 5.02 836 793 A 66 GLN H A 67 MET HA 1.0 . 5.13 837 794 A 66 GLN HE2x A 66 GLN HA 1.0 . 5.50 838 795 A 71 GLN HE2y A 67 MET HA 1.0 . 5.17 839 796 A 8 LEU HDx% A 71 GLN HE2x 1.0 . 5.50 840 797 A 30 THR HA A 34 GLY H 1.0 . 5.50 841 798 A 31 LEU HA A 34 GLY H 1.0 . 5.08 842 799 A 63 GLY H A 61 ASP HA 1.0 . 5.10 843 800 A 88 HIS HA A 87 GLY H 1.0 . 5.50 844 801 A 12 ASP H A 11 GLY HAy 1.0 . 3.36 845 802 A 64 VAL H A 63 GLY HAx 1.0 . 3.24 846 802 A 64 VAL H A 63 GLY HAy 1.0 . 3.24 847 803 A 77 CYS H A 76 VAL HB 1.0 . 4.56 848 804 A 4 GLN H A 4 GLN HBy 1.0 . 3.69 849 805 A 8 LEU H A 8 LEU HBy 1.0 . 3.85 850 806 A 8 LEU H A 8 LEU HBx 1.0 . 3.85 851 807 A 8 LEU H A 7 THR HG2% 1.0 . 3.42 852 808 A 23 ALA H A 22 VAL HB 1.0 . 4.31 853 809 A 23 ALA H A 22 VAL HGx% 1.0 . 4.38 854 810 A 26 HIS H A 26 HIS HBx 1.0 . 3.81 855 811 A 26 HIS H A 26 HIS HBy 1.0 . 3.81 856 812 A 39 SER H A 38 ASP HBx 1.0 . 4.74 857 813 A 37 PHE HBx A 38 ASP H 1.0 . 3.89 858 814 A 40 SER H A 39 SER HBx 1.0 . 4.38 859 815 A 41 ARG H A 40 SER HBx 1.0 . 4.82 860 816 A 41 ARG H A 41 ARG HBx 1.0 . 3.76 861 817 A 41 ARG H A 41 ARG HBy 1.0 . 3.76 862 818 A 87 GLY H A 86 ARG HGx 1.0 . 4.82 863 819 A 49 PHE HE% A 50 THR H 1.0 . 5.31 864 820 A 51 VAL H A 50 THR HG2% 1.0 . 3.30 865 821 A 51 VAL H A 51 VAL HGy% 1.0 . 3.91 866 822 A 56 VAL H A 55 GLU HGx 1.0 . 4.28 867 822 A 56 VAL H A 55 GLU HGy 1.0 . 4.28 868 823 A 55 GLU H A 55 GLU HGx 1.0 . 3.34 869 823 A 55 GLU H A 55 GLU HGy 1.0 . 3.34 870 824 A 55 GLU H A 55 GLU HBx 1.0 . 3.81 871 825 A 56 VAL H A 55 GLU HBx 1.0 . 4.16 872 826 A 57 ILE H A 56 VAL HGy% 1.0 . 3.70 873 827 A 56 VAL H A 56 VAL HGx% 1.0 . 3.48 874 828 A 56 VAL HGy% A 56 VAL H 1.0 . 3.03 875 829 A 59 GLY H A 58 ARG HBx 1.0 . 3.78 876 830 A 58 ARG H A 58 ARG HBx 1.0 . 3.63 877 831 A 58 ARG H A 58 ARG HGx 1.0 . 3.55 878 832 A 58 ARG H A 58 ARG HGy 1.0 . 3.55 879 833 A 58 ARG HBy A 58 ARG H 1.0 . 3.36 880 834 A 61 ASP H A 60 TRP HBy 1.0 . 3.39 881 835 A 61 ASP H A 60 TRP HBx 1.0 . 3.46 882 836 A 61 ASP H A 61 ASP HBx 1.0 . 3.06 883 837 A 63 GLY H A 62 GLU HGy 1.0 . 4.96 884 838 A 63 GLY H A 62 GLU HGx 1.0 . 4.96 885 839 A 65 ALA H A 66 GLN HA 1.0 . 5.37 886 840 A 65 ALA H A 63 GLY HAx 1.0 . 4.25 887 840 A 65 ALA H A 63 GLY HAy 1.0 . 4.25 888 841 A 68 SER H A 67 MET HBy 1.0 . 3.94 889 842 A 68 SER H A 68 SER HBx 1.0 . 3.86 890 843 A 69 VAL H A 68 SER HBx 1.0 . 4.19 891 844 A 69 VAL H A 69 VAL HGy% 1.0 . 2.99 892 845 A 69 VAL H A 69 VAL HGx% 1.0 . 3.83 893 846 A 72 ARG H A 71 GLN HBx 1.0 . 3.61 894 846 A 71 GLN HBy A 72 ARG H 1.0 . 3.61 895 847 A 72 ARG H A 71 GLN HGx 1.0 . 3.91 896 848 A 73 ALA H A 72 ARG HGy 1.0 . 3.81 897 849 A 73 ALA H A 72 ARG HBy 1.0 . 4.41 898 850 A 73 ALA H A 72 ARG HDx 1.0 . 5.38 899 851 A 73 ALA H A 72 ARG HDy 1.0 . 5.38 900 852 A 76 VAL H A 75 LEU HG 1.0 . 4.65 901 853 A 76 VAL H A 75 LEU HBy 1.0 . 4.84 902 854 A 75 LEU H A 75 LEU HBy 1.0 . 3.59 903 855 A 81 TYR H A 80 ASP HBx 1.0 . 4.15 904 856 A 81 TYR H A 80 ASP HBy 1.0 . 4.15 905 857 A 80 ASP H A 80 ASP HBx 1.0 . 3.94 906 858 A 80 ASP H A 80 ASP HBy 1.0 . 3.94 907 859 A 81 TYR HA A 82 ALA H 1.0 . 3.24 908 860 A 86 ARG H A 86 ARG HBx 1.0 . 3.73 909 860 A 86 ARG H A 86 ARG HBy 1.0 . 3.73 910 861 A 98 LEU H A 97 THR HB 1.0 . 4.32 911 862 A 99 THR H A 98 LEU HDx% 1.0 . 4.94 912 863 A 98 LEU H A 98 LEU HBx 1.0 . 3.92 913 864 A 98 LEU H A 98 LEU HDx% 1.0 . 4.56 914 865 A 101 ASP H A 100 PHE HBx 1.0 . 3.65 915 866 A 103 GLU H A 102 VAL HB 1.0 . 4.30 916 867 A 25 VAL HB A 106 ARG H 1.0 . 5.50 917 868 A 105 LEU HBx A 106 ARG H 1.0 . 3.56 918 869 A 105 LEU HBy A 106 ARG H 1.0 . 3.50 919 870 A 105 LEU H A 24 VAL HGx% 1.0 . 5.01 920 871 A 107 VAL H A 106 ARG HBy 1.0 . 3.77 921 872 A 106 ARG H A 106 ARG HGx 1.0 . 3.39 922 872 A 106 ARG HGy A 106 ARG H 1.0 . 3.39 923 873 A 108 GLU H A 108 GLU HBy 1.0 . 3.28 924 874 A 108 GLU H A 108 GLU HBx 1.0 . 3.98 925 875 A 41 ARG H A 40 SER HBy 1.0 . 4.82 926 876 A 92 ILE H A 91 VAL HGx% 1.0 . 3.62 927 877 A 92 ILE H A 92 ILE HG2% 1.0 . 4.05 928 878 A 36 VAL H A 36 VAL HGy% 1.0 . 4.03 929 879 A 36 VAL H A 36 VAL HGx% 1.0 . 2.96 930 880 A 44 GLY H A 43 ARG HGy 1.0 . 5.50 931 881 A 44 GLY H A 43 ARG HBx 1.0 . 4.43 932 882 A 44 GLY H A 43 ARG HBy 1.0 . 4.43 933 883 A 64 VAL H A 64 VAL HGy% 1.0 . 4.06 934 884 A 64 VAL H A 75 LEU HDy% 1.0 . 4.67 935 885 A 64 VAL H A 64 VAL HGx% 1.0 . 4.06 936 886 A 21 GLN HBy A 21 GLN HE2x 1.0 . 3.38 937 887 A 21 GLN HBy A 21 GLN HE2y 1.0 . 4.39 938 888 A 60 TRP H A 62 GLU H 1.0 . 5.00 939 889 A 36 VAL H A 37 PHE H 1.0 . 4.64 940 890 A 38 ASP H A 39 SER H 1.0 . 4.63 941 891 A 48 ARG H A 49 PHE H 1.0 . 4.74 942 892 A 57 ILE H A 56 VAL H 1.0 . 4.52 943 893 A 60 TRP H A 61 ASP H 1.0 . 2.87 944 894 A 108 GLU H A 108 GLU HGx 1.0 . 4.25 945 895 A 108 GLU H A 108 GLU HGy 1.0 . 4.25 946 896 A 107 VAL H A 106 ARG H 1.0 . 4.53 947 897 A 6 VAL H A 7 THR H 1.0 . 4.62 948 898 A 8 LEU H A 7 THR H 1.0 . 4.86 949 899 A 74 LYS H A 7 THR H 1.0 . 4.96 950 900 A 10 ALA H A 9 ALA H 1.0 . 4.59 951 901 A 67 MET H A 68 SER H 1.0 . 4.68 952 902 A 92 ILE HG2% A 84 GLY H 1.0 . 5.12 953 903 A 68 SER H A 71 GLN HBx 1.0 . 3.31 954 903 A 71 GLN HBy A 68 SER H 1.0 . 3.31 955 904 A 71 GLN H A 68 SER H 1.0 . 4.30 956 905 A 63 GLY H A 60 TRP HA 1.0 . 3.90 957 906 A 57 ILE H A 60 TRP HE3 1.0 . 4.51 958 907 A 66 GLN H A 63 GLY HAx 1.0 . 3.92 959 907 A 66 GLN H A 63 GLY HAy 1.0 . 3.92 960 908 A 66 GLN H A 64 VAL HA 1.0 . 4.18 961 909 A 80 ASP H A 78 SER HA 1.0 . 4.36 962 910 A 28 THR H A 27 TYR HBy 1.0 . 3.29 963 911 A 65 ALA H A 67 MET HGx 1.0 . 5.50 964 912 A 29 GLY H A 30 THR H 1.0 . 4.79 965 913 A 101 ASP H A 30 THR H 1.0 . 5.06 966 914 A 57 ILE HG1y A 61 ASP H 1.0 . 5.50 967 915 A 35 LYS H A 30 THR HA 1.0 . 5.50 968 916 A 25 VAL H A 47 PHE H 1.0 . 3.96 969 917 A 37 PHE H A 36 VAL HGx% 1.0 . 3.78 970 918 A 37 PHE H A 30 THR HG2% 1.0 . 3.86 971 919 A 18 LYS H A 19 ALA H 1.0 . 5.12 972 920 A 72 ARG H A 72 ARG HBx 1.0 . 3.65 973 921 A 72 ARG H A 72 ARG HBy 1.0 . 3.64 974 922 A 32 ALA H A 31 LEU HDx% 1.0 . 4.56 975 923 A 48 ARG H A 24 VAL HGy% 1.0 . 4.77 976 924 A 101 ASP H A 75 LEU H 1.0 . 4.66 977 925 A 103 GLU H A 102 VAL H 1.0 . 4.69 978 926 A 104 LEU H A 103 GLU H 1.0 . 4.31 979 927 A 73 ALA H A 103 GLU HA 1.0 . 3.76 980 928 A 59 GLY H A 57 ILE HD1% 1.0 . 3.93 981 929 A 58 ARG H A 81 TYR HBx 1.0 . 4.32 982 929 A 81 TYR HBy A 58 ARG H 1.0 . 4.32 983 930 A 81 TYR HA A 58 ARG H 1.0 . 4.18 984 931 A 32 ALA H A 31 LEU HDy% 1.0 . 4.56 985 932 A 15 THR HG1 A 14 ALA H 1.0 . 5.50 986 933 A 68 SER HA A 14 ALA H 1.0 . 5.50 987 934 A 24 VAL HGy% A 106 ARG H 1.0 . 4.49 988 935 A 20 GLY H A 50 THR HG2% 1.0 . 3.84 989 936 A 20 GLY H A 52 GLY HAx 1.0 . 4.13 990 937 A 51 VAL HB A 20 GLY H 1.0 . 4.27 991 938 A 20 GLY H A 53 ARG HGy 1.0 . 5.40 992 939 A 60 TRP HA A 62 GLU H 1.0 . 5.21 993 940 A 58 ARG HA A 62 GLU H 1.0 . 4.05 994 941 A 63 GLY H A 59 GLY HAy 1.0 . 4.09 995 942 A 64 VAL H A 61 ASP HA 1.0 . 4.64 996 943 A 25 VAL H A 47 PHE HA 1.0 . 4.95 997 944 A 53 ARG H A 50 THR HG2% 1.0 . 4.42 998 945 A 60 TRP HE1 A 75 LEU HBy 1.0 . 5.50 999 946 A 26 HIS H A 102 VAL HA 1.0 . 4.64 1000 947 A 50 THR H A 56 VAL HGx% 1.0 . 4.63 1001 948 A 74 LYS H A 6 VAL HGx% 1.0 . 4.53 1002 949 A 6 VAL HGy% A 74 LYS H 1.0 . 4.85 1003 950 A 69 VAL H A 14 ALA H 1.0 . 4.50 1004 951 A 69 VAL H A 13 GLU H 1.0 . 4.97 1005 952 A 24 VAL H A 105 LEU H 1.0 . 4.71 1006 953 A 67 MET H A 17 PRO HDx 1.0 . 4.62 1007 954 A 15 THR H A 68 SER HBx 1.0 . 4.67 1008 955 A 104 LEU H A 71 GLN H 1.0 . 4.48 1009 956 A 72 ARG HA A 103 GLU H 1.0 . 5.08 1010 957 A 103 GLU H A 26 HIS HA 1.0 . 4.72 1011 958 A 108 GLU H A 23 ALA HB% 1.0 . 4.05 1012 959 A 41 ARG H A 27 TYR HD% 1.0 . 5.50 1013 960 A 75 LEU H A 100 PHE HBy 1.0 . 4.59 1014 961 A 75 LEU H A 100 PHE HBx 1.0 . 5.24 1015 962 A 31 LEU HBx A 34 GLY H 1.0 . 4.38 1016 963 A 31 LEU HBy A 34 GLY H 1.0 . 4.16 1017 964 A 65 ALA HB% A 62 GLU H 1.0 . 4.62 1018 965 A 81 TYR HD% A 62 GLU H 1.0 . 5.50 1019 966 A 101 ASP H A 28 THR HA 1.0 . 4.78 1020 967 A 34 GLY H A 32 ALA HA 1.0 . 4.02 1021 968 A 56 VAL H A 55 GLU HA 1.0 . 3.49 1022 969 A 24 VAL HB A 106 ARG H 1.0 . 3.24 1023 970 A 67 MET H A 65 ALA H 1.0 . 4.57 1024 971 A 95 ASN H A 93 PRO HA 1.0 . 5.50 1025 972 A 96 ALA HA A 95 ASN H 1.0 . 5.50 1026 973 A 25 VAL H A 49 PHE H 1.0 . 5.07 1027 974 A 27 TYR H A 27 TYR HE% 1.0 . 4.79 1028 975 A 67 MET H A 64 VAL HA 1.0 . 3.98 1029 976 A 22 VAL H A 21 GLN H 1.0 . 4.69 1030 977 A 9 ALA H A 72 ARG HBx 1.0 . 3.74 1031 978 A 67 MET H A 67 MET HGx 1.0 . 4.45 1032 979 A 48 ARG HBy A 49 PHE H 1.0 . 3.37 1033 980 A 48 ARG HBx A 49 PHE H 1.0 . 4.04 1034 981 A 31 LEU H A 31 LEU HBx 1.0 . 3.77 1035 982 A 31 LEU HBy A 31 LEU H 1.0 . 3.15 1036 983 A 64 VAL H A 60 TRP HBx 1.0 . 4.73 1037 984 A 14 ALA H A 68 SER HBx 1.0 . 3.99 1038 985 A 71 GLN H A 12 ASP H 1.0 . 4.75 1039 986 A 28 THR HB A 101 ASP HBy 1.0 . 4.39 1040 987 A 28 THR HB A 101 ASP HBx 1.0 . 4.39 1041 988 A 50 THR HB A 53 ARG HBy 1.0 . 4.68 1042 989 A 50 THR HB A 53 ARG HGy 1.0 . 4.18 1043 990 A 104 LEU HG A 69 VAL HA 1.0 . 3.95 1044 991 A 7 THR HA A 8 LEU HG 1.0 . 4.73 1045 992 A 82 ALA HB% A 79 PRO HA 1.0 . 3.60 1046 993 A 16 TYR HE% A 68 SER HBx 1.0 . 4.80 1047 994 A 13 GLU HA A 68 SER HBx 1.0 . 4.33 1048 995 A 64 VAL HA A 67 MET HGy 1.0 . 4.42 1049 996 A 64 VAL HA A 67 MET HBy 1.0 . 4.47 1050 997 A 64 VAL HA A 67 MET HBx 1.0 . 4.47 1051 998 A 49 PHE HE% A 51 VAL HA 1.0 . 3.83 1052 999 A 49 PHE HD% A 51 VAL HA 1.0 . 4.30 1053 1000 A 42 THR HA A 42 THR HG2% 1.0 . 3.45 1054 1001 A 51 VAL HA A 51 VAL HGx% 1.0 . 3.54 1055 1002 A 97 THR HA A 97 THR HG2% 1.0 . 3.46 1056 1003 A 97 THR HA A 79 PRO HDx 1.0 . 4.11 1057 1003 A 97 THR HA A 79 PRO HDy 1.0 . 4.11 1058 1004 A 47 PHE HA A 46 PRO HA 1.0 . 4.46 1059 1005 A 46 PRO HA A 24 VAL HGx% 1.0 . 4.68 1060 1006 A 93 PRO HA A 94 PRO HDy 1.0 . 3.82 1061 1007 A 79 PRO HDy A 78 SER HBy 1.0 . 3.67 1062 1007 A 78 SER HBy A 79 PRO HDx 1.0 . 3.67 1063 1008 A 79 PRO HDy A 78 SER HBx 1.0 . 3.67 1064 1008 A 78 SER HBx A 79 PRO HDx 1.0 . 3.67 1065 1009 A 93 PRO HA A 94 PRO HDx 1.0 . 3.82 1066 1010 A 99 THR HA A 76 VAL HA 1.0 . 3.43 1067 1011 A 82 ALA HA A 57 ILE HA 1.0 . 4.53 1068 1012 A 15 THR HA A 69 VAL HB 1.0 . 5.40 1069 1013 A 92 ILE HG2% A 93 PRO HA 1.0 . 4.53 1070 1014 A 22 VAL HA A 22 VAL HGx% 1.0 . 3.66 1071 1015 A 5 VAL HA A 5 VAL HGx% 1.0 . 3.44 1072 1016 A 57 ILE HG2% A 57 ILE HA 1.0 . 3.21 1073 1017 A 48 ARG HBy A 24 VAL HA 1.0 . 4.81 1074 1018 A 24 VAL HA A 48 ARG HBx 1.0 . 4.95 1075 1019 A 6 VAL HA A 6 VAL HGx% 1.0 . 3.14 1076 1020 A 6 VAL HGy% A 6 VAL HA 1.0 . 3.46 1077 1021 A 102 VAL HA A 102 VAL HGx% 1.0 . 3.63 1078 1022 A 107 VAL HA A 23 ALA HA 1.0 . 3.60 1079 1023 A 107 VAL HA A 107 VAL HGy% 1.0 . 3.51 1080 1024 A 37 PHE HD% A 30 THR HA 1.0 . 4.32 1081 1025 A 30 THR HA A 36 VAL HA 1.0 . 3.39 1082 1026 A 60 TRP HD1 A 60 TRP HA 1.0 . 4.23 1083 1027 A 3 VAL HA A 3 VAL HGy% 1.0 . 3.42 1084 1028 A 83 TYR HD% A 83 TYR HA 1.0 . 4.10 1085 1029 A 26 HIS HE1 A 41 ARG HA 1.0 . 4.46 1086 1030 A 49 PHE HE% A 61 ASP HA 1.0 . 4.03 1087 1031 A 66 GLN HE2x A 62 GLU HA 1.0 . 4.76 1088 1032 A 61 ASP HA A 51 VAL HA 1.0 . 4.38 1089 1033 A 51 VAL HB A 61 ASP HA 1.0 . 5.50 1090 1034 A 61 ASP HA A 51 VAL HGx% 1.0 . 4.80 1091 1035 A 56 VAL HGy% A 61 ASP HA 1.0 . 4.35 1092 1036 A 49 PHE HZ A 61 ASP HA 1.0 . 4.63 1093 1037 A 61 ASP HA A 51 VAL HGy% 1.0 . 4.80 1094 1038 A 25 VAL HA A 104 LEU HA 1.0 . 3.81 1095 1039 A 78 SER HA A 79 PRO HDx 1.0 . 3.20 1096 1039 A 79 PRO HDy A 78 SER HA 1.0 . 3.20 1097 1040 A 25 VAL HA A 105 LEU HBy 1.0 . 3.98 1098 1041 A 81 TYR HA A 58 ARG HBx 1.0 . 4.29 1099 1042 A 25 VAL HA A 25 VAL HGy% 1.0 . 4.10 1100 1043 A 97 THR HG2% A 78 SER HA 1.0 . 3.94 1101 1044 A 25 VAL HA A 25 VAL HGx% 1.0 . 4.10 1102 1045 A 25 VAL HA A 24 VAL HGx% 1.0 . 4.56 1103 1046 A 55 GLU HA A 55 GLU HGx 1.0 . 3.47 1104 1046 A 55 GLU HGy A 55 GLU HA 1.0 . 3.47 1105 1047 A 77 CYS HA A 3 VAL HB 1.0 . 4.81 1106 1048 A 3 VAL HGy% A 77 CYS HA 1.0 . 4.20 1107 1049 A 56 VAL HA A 56 VAL HGx% 1.0 . 3.28 1108 1050 A 77 CYS HA A 81 TYR HBx 1.0 . 5.03 1109 1050 A 81 TYR HBy A 77 CYS HA 1.0 . 5.03 1110 1051 A 13 GLU HA A 13 GLU HGy 1.0 . 4.20 1111 1052 A 81 TYR HA A 58 ARG HBy 1.0 . 4.23 1112 1053 A 47 PHE HA A 47 PHE HD% 1.0 . 4.11 1113 1054 A 28 THR HG2% A 39 SER HA 1.0 . 4.44 1114 1055 A 79 PRO HGy A 80 ASP HA 1.0 . 4.85 1115 1056 A 92 ILE HA A 92 ILE HG2% 1.0 . 3.88 1116 1057 A 37 PHE HD% A 37 PHE HA 1.0 . 4.65 1117 1058 A 27 TYR HA A 27 TYR HD% 1.0 . 4.52 1118 1059 A 27 TYR HA A 102 VAL HA 1.0 . 3.34 1119 1060 A 49 PHE HD% A 49 PHE HA 1.0 . 4.39 1120 1061 A 71 GLN HA A 70 GLY HAy 1.0 . 4.63 1121 1062 A 71 GLN HA A 71 GLN HGy 1.0 . 4.25 1122 1063 A 100 PHE HA A 29 GLY HAy 1.0 . 4.27 1123 1064 A 71 GLN HA A 71 GLN HGx 1.0 . 4.25 1124 1065 A 49 PHE HA A 56 VAL HGx% 1.0 . 4.77 1125 1066 A 100 PHE HD% A 100 PHE HA 1.0 . 4.33 1126 1067 A 100 PHE HA A 29 GLY HAx 1.0 . 4.85 1127 1068 A 100 PHE HA A 99 THR HG2% 1.0 . 4.84 1128 1069 A 106 ARG HA A 69 VAL HGx% 1.0 . 3.32 1129 1070 A 67 MET HA A 67 MET HGy 1.0 . 4.10 1130 1071 A 67 MET HA A 67 MET HGx 1.0 . 4.10 1131 1072 A 26 HIS HA A 26 HIS HD2 1.0 . 5.16 1132 1073 A 27 TYR HD% A 26 HIS HA 1.0 . 5.37 1133 1074 A 68 SER HA A 16 TYR HA 1.0 . 3.93 1134 1075 A 74 LYS HA A 74 LYS HGx 1.0 . 4.23 1135 1076 A 8 LEU HDx% A 74 LYS HA 1.0 . 4.51 1136 1077 A 26 HIS HA A 46 PRO HA 1.0 . 4.51 1137 1078 A 3 VAL HGy% A 4 GLN HA 1.0 . 4.40 1138 1079 A 4 GLN HA A 3 VAL HGx% 1.0 . 4.93 1139 1080 A 16 TYR HD% A 16 TYR HA 1.0 . 4.78 1140 1081 A 4 GLN HA A 4 GLN HGy 1.0 . 4.14 1141 1082 A 104 LEU HA A 25 VAL HB 1.0 . 4.01 1142 1083 A 65 ALA HA A 17 PRO HGx 1.0 . 4.02 1143 1084 A 31 LEU HA A 32 ALA HB% 1.0 . 4.37 1144 1085 A 53 ARG HGx A 53 ARG HA 1.0 . 4.00 1145 1086 A 72 ARG HA A 103 GLU HA 1.0 . 3.47 1146 1087 A 16 TYR HA A 17 PRO HDy 1.0 . 3.76 1147 1088 A 16 TYR HA A 17 PRO HDx 1.0 . 3.76 1148 1089 A 67 MET HE% A 103 GLU HA 1.0 . 3.89 1149 1090 A 103 GLU HA A 72 ARG HBy 1.0 . 4.12 1150 1091 A 72 ARG HA A 72 ARG HGx 1.0 . 3.97 1151 1092 A 16 TYR HE% A 14 ALA HA 1.0 . 4.09 1152 1093 A 48 ARG HA A 24 VAL HA 1.0 . 3.55 1153 1094 A 51 VAL HB A 19 ALA HA 1.0 . 4.09 1154 1095 A 74 LYS HA A 101 ASP HA 1.0 . 3.56 1155 1096 A 75 LEU HA A 5 VAL HA 1.0 . 3.79 1156 1097 A 101 ASP HA A 74 LYS HBx 1.0 . 4.50 1157 1097 A 74 LYS HBy A 101 ASP HA 1.0 . 4.50 1158 1098 A 73 ALA HB% A 101 ASP HA 1.0 . 5.50 1159 1099 A 75 LEU HA A 3 VAL HGy% 1.0 . 4.26 1160 1100 A 75 LEU HA A 75 LEU HDy% 1.0 . 4.54 1161 1101 A 8 LEU HDx% A 101 ASP HA 1.0 . 4.75 1162 1102 A 75 LEU HA A 75 LEU HDx% 1.0 . 4.54 1163 1103 A 88 HIS HA A 89 PRO HDy 1.0 . 3.72 1164 1104 A 88 HIS HA A 89 PRO HDx 1.0 . 3.72 1165 1105 A 7 THR HG2% A 10 ALA HA 1.0 . 3.77 1166 1106 A 57 ILE HB A 82 ALA HA 1.0 . 3.57 1167 1107 A 57 ILE HG1y A 82 ALA HA 1.0 . 4.83 1168 1108 A 92 ILE HA A 93 PRO HDy 1.0 . 3.66 1169 1109 A 92 ILE HA A 93 PRO HDx 1.0 . 3.66 1170 1110 A 96 ALA HB% A 93 PRO HDx 1.0 . 4.66 1171 1111 A 92 ILE HG2% A 93 PRO HDy 1.0 . 4.46 1172 1112 A 92 ILE HG1y A 93 PRO HDy 1.0 . 4.37 1173 1113 A 96 ALA HB% A 93 PRO HDy 1.0 . 4.66 1174 1114 A 73 ALA HA A 7 THR HA 1.0 . 3.57 1175 1115 A 73 ALA HA A 8 LEU HG 1.0 . 3.86 1176 1116 A 8 LEU HDx% A 73 ALA HA 1.0 . 4.23 1177 1117 A 45 LYS HA A 46 PRO HDy 1.0 . 3.26 1178 1118 A 97 THR HG2% A 79 PRO HDx 1.0 . 4.78 1179 1118 A 79 PRO HDy A 97 THR HG2% 1.0 . 4.78 1180 1119 A 3 VAL HGy% A 59 GLY HAx 1.0 . 4.37 1181 1120 A 81 TYR HD% A 59 GLY HAx 1.0 . 4.90 1182 1121 A 81 TYR HD% A 59 GLY HAy 1.0 . 4.21 1183 1122 A 59 GLY HAy A 81 TYR HBx 1.0 . 4.51 1184 1122 A 81 TYR HBy A 59 GLY HAy 1.0 . 4.51 1185 1123 A 3 VAL HGy% A 59 GLY HAy 1.0 . 4.26 1186 1124 A 60 TRP HA A 63 GLY HAx 1.0 . 4.35 1187 1124 A 60 TRP HA A 63 GLY HAy 1.0 . 4.35 1188 1125 A 19 ALA HB% A 52 GLY HAx 1.0 . 4.27 1189 1126 A 61 ASP HBx A 52 GLY HAy 1.0 . 5.06 1190 1127 A 100 PHE HD% A 29 GLY HAx 1.0 . 4.61 1191 1128 A 100 PHE HD% A 29 GLY HAy 1.0 . 4.56 1192 1129 A 37 PHE HD% A 29 GLY HAy 1.0 . 5.30 1193 1130 A 30 THR HB A 34 GLY HAy 1.0 . 5.10 1194 1131 A 50 THR HG2% A 20 GLY HAy 1.0 . 3.97 1195 1132 A 50 THR HG2% A 20 GLY HAx 1.0 . 3.97 1196 1133 A 30 THR HG2% A 34 GLY HAy 1.0 . 4.46 1197 1134 A 37 PHE HD% A 38 ASP HBx 1.0 . 4.90 1198 1135 A 75 LEU HBx A 100 PHE HBy 1.0 . 4.50 1199 1136 A 11 GLY HAy A 71 GLN HBx 1.0 . 4.38 1200 1136 A 71 GLN HBy A 11 GLY HAy 1.0 . 4.38 1201 1137 A 11 GLY HAx A 71 GLN HBx 1.0 . 4.06 1202 1137 A 71 GLN HBy A 11 GLY HAx 1.0 . 4.06 1203 1138 A 3 VAL HGy% A 75 LEU HBx 1.0 . 4.73 1204 1139 A 8 LEU HDx% A 72 ARG HDy 1.0 . 4.82 1205 1140 A 8 LEU HDx% A 72 ARG HDx 1.0 . 4.82 1206 1141 A 100 PHE HBy A 75 LEU HBy 1.0 . 4.66 1207 1142 A 27 TYR HE% A 47 PHE HBx 1.0 . 4.23 1208 1143 A 53 ARG HA A 53 ARG HDy 1.0 . 4.02 1209 1144 A 27 TYR HD% A 47 PHE HBy 1.0 . 4.71 1210 1145 A 27 TYR HE% A 47 PHE HBy 1.0 . 4.23 1211 1146 A 41 ARG HDy A 41 ARG HBy 1.0 . 3.72 1212 1146 A 41 ARG HBy A 41 ARG HDx 1.0 . 3.72 1213 1147 A 31 LEU HBx A 32 ALA HB% 1.0 . 4.63 1214 1148 A 31 LEU HBy A 32 ALA HB% 1.0 . 5.19 1215 1149 A 41 ARG HDy A 41 ARG HBx 1.0 . 3.72 1216 1149 A 41 ARG HBx A 41 ARG HDx 1.0 . 3.72 1217 1150 A 105 LEU HBx A 105 LEU HDx% 1.0 . 3.83 1218 1151 A 100 PHE HBx A 29 GLY HAy 1.0 . 4.22 1219 1152 A 58 ARG HA A 61 ASP HBx 1.0 . 4.30 1220 1153 A 74 LYS HBy A 74 LYS HEx 1.0 . 3.97 1221 1153 A 74 LYS HBx A 74 LYS HEx 1.0 . 3.97 1222 1153 A 74 LYS HEy A 74 LYS HBx 1.0 . 3.97 1223 1153 A 74 LYS HBy A 74 LYS HEy 1.0 . 3.97 1224 1154 A 8 LEU HDy% A 74 LYS HEx 1.0 . 4.17 1225 1154 A 8 LEU HDy% A 74 LYS HEy 1.0 . 4.17 1226 1155 A 49 PHE HBy A 56 VAL HGx% 1.0 . 3.95 1227 1156 A 49 PHE HBx A 56 VAL HGx% 1.0 . 4.47 1228 1157 A 58 ARG HA A 61 ASP HBy 1.0 . 4.17 1229 1158 A 67 MET HE% A 104 LEU HBx 1.0 . 4.75 1230 1159 A 67 MET HE% A 104 LEU HBy 1.0 . 4.75 1231 1160 A 88 HIS HBy A 92 ILE HB 1.0 . 4.21 1232 1161 A 88 HIS HBx A 92 ILE HB 1.0 . 5.01 1233 1162 A 37 PHE HBx A 36 VAL HGy% 1.0 . 5.27 1234 1163 A 37 PHE HBy A 36 VAL HGy% 1.0 . 4.48 1235 1164 A 57 ILE HB A 82 ALA HB% 1.0 . 4.74 1236 1165 A 58 ARG HBx A 81 TYR HBx 1.0 . 4.85 1237 1165 A 81 TYR HBy A 58 ARG HBx 1.0 . 4.85 1238 1166 A 3 VAL HGy% A 81 TYR HBx 1.0 . 5.14 1239 1166 A 81 TYR HBy A 3 VAL HGy% 1.0 . 5.14 1240 1167 A 3 VAL HGx% A 81 TYR HBx 1.0 . 5.44 1241 1167 A 81 TYR HBy A 3 VAL HGx% 1.0 . 5.44 1242 1168 A 3 VAL HB A 81 TYR HBx 1.0 . 4.73 1243 1168 A 81 TYR HBy A 3 VAL HB 1.0 . 4.73 1244 1169 A 91 VAL HB A 88 HIS HD2 1.0 . 5.26 1245 1170 A 56 VAL HB A 60 TRP HE3 1.0 . 4.81 1246 1171 A 61 ASP HBy A 56 VAL HB 1.0 . 5.13 1247 1172 A 56 VAL HB A 60 TRP HBy 1.0 . 4.59 1248 1173 A 56 VAL HB A 60 TRP HBx 1.0 . 4.63 1249 1174 A 92 ILE HG1x A 91 VAL HB 1.0 . 4.72 1250 1175 A 3 VAL HB A 59 GLY HAx 1.0 . 4.55 1251 1176 A 59 GLY HAy A 3 VAL HB 1.0 . 4.39 1252 1177 A 81 TYR HD% A 3 VAL HB 1.0 . 4.45 1253 1178 A 8 LEU HDx% A 72 ARG HBy 1.0 . 4.89 1254 1179 A 48 ARG HBy A 49 PHE HA 1.0 . 4.84 1255 1180 A 71 GLN HA A 72 ARG HBy 1.0 . 4.70 1256 1181 A 6 VAL HB A 74 LYS HBx 1.0 . 3.63 1257 1181 A 6 VAL HB A 74 LYS HBy 1.0 . 3.63 1258 1182 A 106 ARG HDy A 106 ARG HBy 1.0 . 4.14 1259 1182 A 106 ARG HBy A 106 ARG HDx 1.0 . 4.14 1260 1183 A 106 ARG HDy A 106 ARG HBx 1.0 . 4.14 1261 1183 A 106 ARG HBx A 106 ARG HDx 1.0 . 4.14 1262 1184 A 89 PRO HA A 88 HIS HBx 1.0 . 4.80 1263 1185 A 24 VAL HGx% A 46 PRO HBy 1.0 . 3.86 1264 1186 A 92 ILE HG1x A 88 HIS HBx 1.0 . 5.50 1265 1187 A 76 VAL HB A 99 THR HG2% 1.0 . 4.51 1266 1188 A 64 VAL HA A 67 MET HGx 1.0 . 4.42 1267 1189 A 15 THR HB A 69 VAL HB 1.0 . 3.77 1268 1190 A 104 LEU HG A 69 VAL HB 1.0 . 5.50 1269 1191 A 15 THR HG2% A 69 VAL HB 1.0 . 4.22 1270 1192 A 49 PHE HE% A 64 VAL HB 1.0 . 4.75 1271 1193 A 49 PHE HZ A 64 VAL HB 1.0 . 3.91 1272 1194 A 96 ALA HB% A 93 PRO HBy 1.0 . 4.71 1273 1195 A 58 ARG HBy A 57 ILE HG1x 1.0 . 5.50 1274 1196 A 10 ALA HB% A 71 GLN HBx 1.0 . 5.36 1275 1196 A 71 GLN HBy A 10 ALA HB% 1.0 . 5.36 1276 1197 A 55 GLU HBy A 53 ARG HGx 1.0 . 5.50 1277 1198 A 58 ARG HBy A 81 TYR HD% 1.0 . 4.62 1278 1199 A 55 GLU HBy A 49 PHE HBy 1.0 . 4.59 1279 1200 A 55 GLU HBy A 56 VAL HGx% 1.0 . 4.79 1280 1201 A 58 ARG HBy A 81 TYR HBx 1.0 . 4.54 1281 1201 A 81 TYR HBy A 58 ARG HBy 1.0 . 4.54 1282 1202 A 18 LYS HA A 18 LYS HDx 1.0 . 4.26 1283 1202 A 18 LYS HA A 18 LYS HDy 1.0 . 4.26 1284 1203 A 104 LEU HG A 69 VAL HGy% 1.0 . 4.42 1285 1204 A 65 ALA HA A 17 PRO HGy 1.0 . 4.90 1286 1205 A 64 VAL HB A 17 PRO HGx 1.0 . 5.33 1287 1206 A 37 PHE HD% A 31 LEU HG 1.0 . 4.48 1288 1207 A 25 VAL HA A 105 LEU HG 1.0 . 5.11 1289 1208 A 95 ASN HA A 79 PRO HGy 1.0 . 4.52 1290 1209 A 95 ASN HA A 79 PRO HGx 1.0 . 4.10 1291 1210 A 17 PRO HGx A 104 LEU HDx% 1.0 . 5.50 1292 1211 A 79 PRO HGx A 95 ASN HBy 1.0 . 5.03 1293 1212 A 8 LEU HDx% A 72 ARG HGy 1.0 . 4.31 1294 1213 A 24 VAL HGy% A 48 ARG HGy 1.0 . 4.44 1295 1214 A 24 VAL HGy% A 48 ARG HGx 1.0 . 4.44 1296 1215 A 79 PRO HGx A 95 ASN HBx 1.0 . 5.03 1297 1216 A 69 VAL HGy% A 106 ARG HGx 1.0 . 5.07 1298 1216 A 106 ARG HGy A 69 VAL HGy% 1.0 . 5.07 1299 1217 A 8 LEU HDx% A 72 ARG HGx 1.0 . 4.31 1300 1218 A 24 VAL HGy% A 106 ARG HGx 1.0 . 5.07 1301 1218 A 24 VAL HGy% A 106 ARG HGy 1.0 . 5.07 1302 1219 A 24 VAL HB A 106 ARG HGx 1.0 . 4.18 1303 1219 A 24 VAL HB A 106 ARG HGy 1.0 . 4.18 1304 1220 A 104 LEU HA A 104 LEU HDx% 1.0 . 4.69 1305 1221 A 105 LEU HA A 106 ARG HGx 1.0 . 4.72 1306 1221 A 106 ARG HGy A 105 LEU HA 1.0 . 4.72 1307 1222 A 67 MET HE% A 104 LEU HDx% 1.0 . 5.50 1308 1223 A 96 ALA HB% A 93 PRO HGy 1.0 . 4.03 1309 1224 A 24 VAL HGx% A 46 PRO HGy 1.0 . 4.23 1310 1225 A 24 VAL HGx% A 46 PRO HGx 1.0 . 4.23 1311 1226 A 8 LEU HDx% A 8 LEU HBx 1.0 . 3.36 1312 1227 A 8 LEU HDx% A 8 LEU HA 1.0 . 4.09 1313 1228 A 63 GLY HAy A 75 LEU HDx% 1.0 . 3.92 1314 1228 A 75 LEU HDx% A 63 GLY HAx 1.0 . 3.92 1315 1229 A 8 LEU HDx% A 8 LEU HBy 1.0 . 3.36 1316 1230 A 57 ILE HG1x A 60 TRP HBy 1.0 . 4.50 1317 1231 A 57 ILE HG1x A 60 TRP HBx 1.0 . 4.57 1318 1232 A 15 THR HG1 A 69 VAL HGy% 1.0 . 4.22 1319 1233 A 68 SER HA A 69 VAL HGy% 1.0 . 4.61 1320 1234 A 98 LEU HA A 98 LEU HDy% 1.0 . 4.37 1321 1235 A 104 LEU HA A 104 LEU HDy% 1.0 . 4.69 1322 1236 A 49 PHE HE% A 64 VAL HGx% 1.0 . 4.31 1323 1237 A 28 THR HG2% A 28 THR HA 1.0 . 3.51 1324 1238 A 30 THR HA A 30 THR HG2% 1.0 . 3.32 1325 1239 A 36 VAL HA A 30 THR HG2% 1.0 . 3.36 1326 1240 A 8 LEU HDy% A 8 LEU HA 1.0 . 3.20 1327 1241 A 3 VAL HGy% A 75 LEU HG 1.0 . 3.47 1328 1242 A 53 ARG HGx A 50 THR HG2% 1.0 . 3.75 1329 1243 A 17 PRO HGx A 64 VAL HGy% 1.0 . 4.39 1330 1244 A 49 PHE HE% A 56 VAL HGx% 1.0 . 3.52 1331 1245 A 49 PHE HD% A 56 VAL HGx% 1.0 . 4.07 1332 1246 A 56 VAL HGx% A 60 TRP HE3 1.0 . 3.91 1333 1247 A 15 THR HA A 15 THR HG2% 1.0 . 3.05 1334 1248 A 53 ARG HGy A 50 THR HG2% 1.0 . 3.28 1335 1249 A 99 THR HA A 99 THR HG2% 1.0 . 3.39 1336 1250 A 107 VAL HA A 107 VAL HGx% 1.0 . 3.51 1337 1251 A 76 VAL HA A 99 THR HG2% 1.0 . 3.96 1338 1252 A 36 VAL HA A 36 VAL HGy% 1.0 . 3.31 1339 1253 A 99 THR HG2% A 74 LYS HBx 1.0 . 3.23 1340 1253 A 74 LYS HBy A 99 THR HG2% 1.0 . 3.23 1341 1254 A 91 VAL HA A 91 VAL HGx% 1.0 . 3.33 1342 1255 A 105 LEU HBy A 24 VAL HGx% 1.0 . 4.71 1343 1256 A 24 VAL HGx% A 46 PRO HBx 1.0 . 3.86 1344 1257 A 102 VAL HA A 102 VAL HGy% 1.0 . 3.63 1345 1258 A 5 VAL HA A 5 VAL HGy% 1.0 . 3.44 1346 1259 A 51 VAL HA A 51 VAL HGy% 1.0 . 3.54 1347 1260 A 24 VAL HGx% A 106 ARG HDx 1.0 . 4.65 1348 1260 A 24 VAL HGx% A 106 ARG HDy 1.0 . 4.65 1349 1261 A 91 VAL HA A 91 VAL HGy% 1.0 . 3.33 1350 1262 A 96 ALA HB% A 93 PRO HBx 1.0 . 4.71 1351 1263 A 24 VAL HGy% A 106 ARG HDx 1.0 . 3.78 1352 1263 A 24 VAL HGy% A 106 ARG HDy 1.0 . 3.78 1353 1264 A 96 ALA HB% A 93 PRO HGx 1.0 . 4.03 1354 1265 A 24 VAL HA A 24 VAL HGy% 1.0 . 3.41 1355 1266 A 105 LEU HBy A 24 VAL HGy% 1.0 . 5.50 1356 1267 A 48 ARG HBx A 24 VAL HGy% 1.0 . 3.07 1357 1268 A 99 THR HA A 76 VAL HGy% 1.0 . 4.50 1358 1269 A 76 VAL HA A 76 VAL HGy% 1.0 . 3.49 1359 1270 A 6 VAL HGx% A 74 LYS HEx 1.0 . 5.05 1360 1270 A 6 VAL HGx% A 74 LYS HEy 1.0 . 5.05 1361 1271 A 6 VAL HGy% A 74 LYS HEx 1.0 . 5.39 1362 1271 A 6 VAL HGy% A 74 LYS HEy 1.0 . 5.39 1363 1272 A 6 VAL HGy% A 74 LYS HBx 1.0 . 4.34 1364 1272 A 74 LYS HBy A 6 VAL HGy% 1.0 . 4.34 1365 1273 A 49 PHE HE% A 56 VAL HGy% 1.0 . 4.12 1366 1274 A 82 ALA HB% A 83 TYR HD% 1.0 . 3.84 1367 1275 A 49 PHE HD% A 56 VAL HGy% 1.0 . 4.12 1368 1276 A 56 VAL HGy% A 60 TRP HE3 1.0 . 4.30 1369 1277 A 56 VAL HGy% A 60 TRP HBy 1.0 . 3.83 1370 1278 A 56 VAL HGy% A 60 TRP HBx 1.0 . 3.72 1371 1279 A 65 ALA HB% A 62 GLU HA 1.0 . 3.27 1372 1280 A 83 TYR HD% A 92 ILE HG2% 1.0 . 4.18 1373 1281 A 18 LYS HA A 19 ALA HB% 1.0 . 4.27 1374 1282 A 92 ILE HG2% A 93 PRO HDx 1.0 . 4.46 1375 1283 A 73 ALA HB% A 67 MET HE% 1.0 . 3.56 1376 1284 A 57 ILE HG2% A 82 ALA HA 1.0 . 3.65 1377 1285 A 82 ALA HB% A 92 ILE HG2% 1.0 . 5.02 1378 1286 A 57 ILE HG2% A 82 ALA HB% 1.0 . 4.09 1379 1287 A 57 ILE HG2% A 57 ILE HD1% 1.0 . 3.27 1380 1288 A 57 ILE HD1% A 60 TRP HD1 1.0 . 3.85 1381 1289 A 57 ILE HD1% A 82 ALA HA 1.0 . 3.54 1382 1290 A 57 ILE HB A 57 ILE HD1% 1.0 . 3.48 1383 1291 A 58 ARG HBy A 57 ILE HD1% 1.0 . 4.62 1384 1292 A 82 ALA HB% A 57 ILE HD1% 1.0 . 3.35 1385 1293 A 92 ILE HA A 92 ILE HD1% 1.0 . 4.04 1386 1294 A 92 ILE HG2% A 92 ILE HD1% 1.0 . 3.29 1387 1295 A 88 HIS HBy A 91 VAL HB 1.0 . 4.44 1388 1296 A 24 VAL HA A 24 VAL HGx% 1.0 . 3.33 1389 1297 A 41 ARG HA A 41 ARG HDx 1.0 . 4.58 1390 1297 A 41 ARG HDy A 41 ARG HA 1.0 . 4.58 1391 1298 A 86 ARG HBy A 86 ARG HDx 1.0 . 3.77 1392 1298 A 86 ARG HBx A 86 ARG HDx 1.0 . 3.77 1393 1298 A 86 ARG HDy A 86 ARG HBx 1.0 . 3.77 1394 1298 A 86 ARG HDy A 86 ARG HBy 1.0 . 3.77 1395 1299 A 53 ARG HA A 53 ARG HDx 1.0 . 4.02 1396 1300 A 57 ILE HD1% A 57 ILE HA 1.0 . 5.08 1397 1301 A 106 ARG HA A 69 VAL HGy% 1.0 . 3.48 1398 1302 A 50 THR HA A 50 THR HG2% 1.0 . 3.06 1399 1303 A 69 VAL HA A 69 VAL HGy% 1.0 . 3.82 1400 1304 A 69 VAL HA A 69 VAL HGx% 1.0 . 3.27 1401 1305 A 72 ARG HA A 67 MET HE% 1.0 . 3.92 1402 1306 A 72 ARG HA A 72 ARG HGy 1.0 . 3.97 1403 1307 A 72 ARG HBy A 72 ARG HDx 1.0 . 3.96 1404 1308 A 72 ARG HBy A 72 ARG HDy 1.0 . 3.96 1405 1309 A 74 LYS HA A 74 LYS HGy 1.0 . 4.23 1406 1310 A 81 TYR HA A 81 TYR HD% 1.0 . 4.32 1407 1311 A 85 SER HA A 95 ASN HA 1.0 . 3.75 1408 1312 A 98 LEU HA A 98 LEU HDx% 1.0 . 4.37 1409 1313 A 104 LEU HA A 104 LEU HG 1.0 . 3.93 1410 1314 A 105 LEU HBx A 105 LEU HDy% 1.0 . 3.83 1411 1315 A 4 GLN HA A 4 GLN HGx 1.0 . 4.14 1412 1316 A 7 THR HA A 7 THR HG2% 1.0 . 3.32 1413 1317 A 21 GLN HA A 21 GLN HGx 1.0 . 3.65 1414 1318 A 21 GLN HA A 21 GLN HGy 1.0 . 3.65 1415 1319 A 36 VAL HGx% A 37 PHE HA 1.0 . 4.55 1416 1320 A 36 VAL HGy% A 37 PHE HA 1.0 . 4.66 1417 1321 A 76 VAL HA A 76 VAL HGx% 1.0 . 3.49 1418 1322 A 46 PRO HDx A 45 LYS HA 1.0 . 3.05 1419 1323 A 64 VAL HA A 64 VAL HGx% 1.0 . 3.47 1420 1324 A 64 VAL HA A 64 VAL HGy% 1.0 . 3.47 1421 1325 A 96 ALA HA A 79 PRO HGx 1.0 . 5.05 1422 1326 A 22 VAL HA A 22 VAL HGy% 1.0 . 3.66 1423 1327 A 53 ARG HA A 54 GLY HAx 1.0 . 4.53 1424 1327 A 54 GLY HAy A 53 ARG HA 1.0 . 4.53 1425 1328 A 15 THR HB A 69 VAL HGy% 1.0 . 3.32 1426 1329 A 8 LEU HDy% A 74 LYS HDy 1.0 . 5.24 1427 1330 A 8 LEU HDy% A 74 LYS HDx 1.0 . 5.24 1428 1331 A 95 ASN HA A 79 PRO HBx 1.0 . 3.82 1429 1331 A 79 PRO HBy A 95 ASN HA 1.0 . 3.82 1430 1332 A 37 PHE HBy A 36 VAL HGx% 1.0 . 5.26 1431 1333 A 100 PHE HBx A 28 THR HA 1.0 . 5.50 1432 1334 A 27 TYR HD% A 47 PHE HBx 1.0 . 4.71 1433 1335 A 49 PHE HE% A 64 VAL HGy% 1.0 . 4.31 1434 1336 A 92 ILE HD1% A 83 TYR HE% 1.0 . 4.50 1435 1337 A 83 TYR HD% A 92 ILE HD1% 1.0 . 4.25 1436 1338 A 57 ILE HG2% A 83 TYR HE% 1.0 . 4.12 1437 1339 A 57 ILE HG2% A 83 TYR HD% 1.0 . 4.63 1438 1340 A 37 PHE HD% A 31 LEU HDy% 1.0 . 4.33 1439 1341 A 37 PHE HD% A 31 LEU HDx% 1.0 . 4.33 1440 1342 A 17 PRO HGx A 64 VAL HGx% 1.0 . 4.39 1441 1343 A 17 PRO HGy A 64 VAL HGx% 1.0 . 4.85 1442 1344 A 17 PRO HGy A 64 VAL HGy% 1.0 . 4.85 1443 1345 A 59 GLY HAx A 81 TYR HBx 1.0 . 4.33 1444 1345 A 81 TYR HBy A 59 GLY HAx 1.0 . 4.33 1445 1346 A 92 ILE HG1y A 93 PRO HDx 1.0 . 4.37 1446 1347 A 45 LYS HA A 45 LYS HGx 1.0 . 4.19 1447 1347 A 45 LYS HGy A 45 LYS HA 1.0 . 4.19 1448 1348 A 48 ARG HA A 24 VAL HGy% 1.0 . 4.07 1449 1349 A 48 ARG HA A 24 VAL HGx% 1.0 . 4.03 1450 1350 A 99 THR HA A 76 VAL HGx% 1.0 . 4.50 1451 1351 A 13 GLU HA A 13 GLU HGx 1.0 . 4.20 1452 1352 A 63 GLY HAx A 75 LEU HDy% 1.0 . 3.92 1453 1352 A 63 GLY HAy A 75 LEU HDy% 1.0 . 3.92 1454 1353 A 48 ARG HBy A 24 VAL HGy% 1.0 . 4.25 1455 1354 A 100 PHE HD% A 98 LEU HBy 1.0 . 5.10 1456 1355 A 100 PHE HD% A 98 LEU HBx 1.0 . 5.10 1457 1356 A 17 PRO HGx A 104 LEU HDy% 1.0 . 5.50 1458 1357 A 37 PHE HD% A 38 ASP HBy 1.0 . 4.90 1459 1358 A 102 VAL HA A 27 TYR HBx 1.0 . 4.67 1460 1359 A 102 VAL HA A 27 TYR HBy 1.0 . 4.96 1461 1360 A 70 GLY HAx A 11 GLY HAy 1.0 . 4.88 1462 1361 A 71 GLN HA A 70 GLY HAx 1.0 . 5.50 1463 1362 A 69 VAL HGy% A 107 VAL HB 1.0 . 4.01 1464 1363 A 81 TYR HD% A 2 GLY HAx 1.0 . 4.62 1465 1364 A 81 TYR HD% A 2 GLY HAy 1.0 . 5.50 1466 1365 A 67 MET HE% A 104 LEU HDy% 1.0 . 5.50 1467 1366 A 50 THR HA A 53 ARG HBy 1.0 . 5.04 1468 1367 A 22 VAL HA A 21 GLN HBx 1.0 . 4.81 1469 1368 A 1 MET HA A 4 GLN HE2x 1.0 . 4.22 1470 1368 A 1 MET HA A 4 GLN HE2y 1.0 . 4.22 1471 1369 A 3 VAL HGx% A 62 GLU HBx 1.0 . 4.07 1472 1369 A 3 VAL HGx% A 62 GLU HBy 1.0 . 4.07 1473 1370 A 3 VAL HGy% A 62 GLU HBx 1.0 . 4.92 1474 1370 A 3 VAL HGy% A 62 GLU HBy 1.0 . 4.92 1475 1371 A 4 GLN H A 4 GLN HBx 1.0 . 3.10 1476 1371 A 4 GLN H A 4 GLN HBy 1.0 . 3.10 1477 1372 A 4 GLN H A 4 GLN HGx 1.0 . 4.66 1478 1372 A 4 GLN H A 4 GLN HGy 1.0 . 4.66 1479 1373 A 5 VAL H A 4 GLN HBx 1.0 . 3.80 1480 1373 A 5 VAL H A 4 GLN HBy 1.0 . 3.80 1481 1374 A 76 VAL H A 4 GLN HBx 1.0 . 4.20 1482 1374 A 76 VAL H A 4 GLN HBy 1.0 . 4.20 1483 1375 A 4 GLN HE2x A 4 GLN HGy 1.0 . 3.23 1484 1375 A 4 GLN HE2y A 4 GLN HGx 1.0 . 3.23 1485 1375 A 4 GLN HE2y A 4 GLN HGy 1.0 . 3.23 1486 1375 A 4 GLN HE2x A 4 GLN HGx 1.0 . 3.23 1487 1376 A 5 VAL H A 4 GLN HGx 1.0 . 3.96 1488 1376 A 5 VAL H A 4 GLN HGy 1.0 . 3.96 1489 1377 A 5 VAL H A 5 VAL HGx% 1.0 . 3.14 1490 1377 A 5 VAL H A 5 VAL HGy% 1.0 . 3.14 1491 1378 A 5 VAL HA A 5 VAL HGx% 1.0 . 3.00 1492 1378 A 5 VAL HA A 5 VAL HGy% 1.0 . 3.00 1493 1379 A 6 VAL H A 5 VAL HGx% 1.0 . 3.29 1494 1379 A 6 VAL H A 5 VAL HGy% 1.0 . 3.29 1495 1380 A 7 THR H A 5 VAL HGx% 1.0 . 4.76 1496 1380 A 7 THR H A 5 VAL HGy% 1.0 . 4.76 1497 1381 A 66 GLN H A 5 VAL HGx% 1.0 . 5.44 1498 1381 A 66 GLN H A 5 VAL HGy% 1.0 . 5.44 1499 1382 A 5 VAL HGx% A 67 MET HGx 1.0 . 4.83 1500 1382 A 5 VAL HGy% A 67 MET HGx 1.0 . 4.83 1501 1382 A 67 MET HGy A 5 VAL HGx% 1.0 . 4.83 1502 1382 A 5 VAL HGy% A 67 MET HGy 1.0 . 4.83 1503 1383 A 71 GLN HE2x A 5 VAL HGx% 1.0 . 4.52 1504 1383 A 71 GLN HE2x A 5 VAL HGy% 1.0 . 4.52 1505 1384 A 71 GLN HE2y A 5 VAL HGx% 1.0 . 4.13 1506 1384 A 71 GLN HE2y A 5 VAL HGy% 1.0 . 4.13 1507 1385 A 73 ALA HB% A 5 VAL HGx% 1.0 . 3.01 1508 1385 A 73 ALA HB% A 5 VAL HGy% 1.0 . 3.01 1509 1386 A 6 VAL HGx% A 74 LYS HGx 1.0 . 5.34 1510 1386 A 6 VAL HGx% A 74 LYS HGy 1.0 . 5.34 1511 1387 A 6 VAL HGx% A 74 LYS HDx 1.0 . 5.34 1512 1387 A 6 VAL HGx% A 74 LYS HDy 1.0 . 5.34 1513 1388 A 6 VAL HGy% A 74 LYS HGx 1.0 . 5.34 1514 1388 A 6 VAL HGy% A 74 LYS HGy 1.0 . 5.34 1515 1389 A 6 VAL HGy% A 74 LYS HDx 1.0 . 4.86 1516 1389 A 6 VAL HGy% A 74 LYS HDy 1.0 . 4.86 1517 1390 A 7 THR HG2% A 71 GLN HGx 1.0 . 4.49 1518 1390 A 7 THR HG2% A 71 GLN HGy 1.0 . 4.49 1519 1391 A 8 LEU H A 71 GLN HGx 1.0 . 4.81 1520 1391 A 8 LEU H A 71 GLN HGy 1.0 . 4.81 1521 1392 A 8 LEU HDx% A 8 LEU HBx 1.0 . 2.83 1522 1392 A 8 LEU HDx% A 8 LEU HBy 1.0 . 2.83 1523 1393 A 9 ALA H A 8 LEU HBx 1.0 . 3.48 1524 1393 A 9 ALA H A 8 LEU HBy 1.0 . 3.48 1525 1394 A 8 LEU HDx% A 72 ARG HGy 1.0 . 3.76 1526 1394 A 8 LEU HDx% A 72 ARG HGx 1.0 . 3.76 1527 1395 A 8 LEU HDx% A 72 ARG HDx 1.0 . 4.18 1528 1395 A 8 LEU HDx% A 72 ARG HDy 1.0 . 4.18 1529 1396 A 8 LEU HDy% A 72 ARG HDx 1.0 . 5.34 1530 1396 A 8 LEU HDy% A 72 ARG HDy 1.0 . 5.34 1531 1397 A 9 ALA H A 71 GLN HGx 1.0 . 4.21 1532 1397 A 9 ALA H A 71 GLN HGy 1.0 . 4.21 1533 1398 A 10 ALA H A 71 GLN HGx 1.0 . 4.78 1534 1398 A 10 ALA H A 71 GLN HGy 1.0 . 4.78 1535 1399 A 10 ALA HA A 71 GLN HGx 1.0 . 3.95 1536 1399 A 10 ALA HA A 71 GLN HGy 1.0 . 3.95 1537 1400 A 11 GLY H A 71 GLN HGx 1.0 . 3.90 1538 1400 A 11 GLY H A 71 GLN HGy 1.0 . 3.90 1539 1401 A 12 ASP H A 12 ASP HBx 1.0 . 3.05 1540 1401 A 12 ASP H A 12 ASP HBy 1.0 . 3.05 1541 1402 A 13 GLU H A 12 ASP HBx 1.0 . 4.11 1542 1402 A 13 GLU H A 12 ASP HBy 1.0 . 4.11 1543 1403 A 69 VAL HGx% A 12 ASP HBx 1.0 . 4.64 1544 1403 A 69 VAL HGx% A 12 ASP HBy 1.0 . 4.64 1545 1404 A 13 GLU H A 13 GLU HGx 1.0 . 4.22 1546 1404 A 13 GLU H A 13 GLU HGy 1.0 . 4.22 1547 1405 A 13 GLU HA A 13 GLU HGx 1.0 . 3.62 1548 1405 A 13 GLU HA A 13 GLU HGy 1.0 . 3.62 1549 1406 A 16 TYR H A 16 TYR HBy 1.0 . 3.18 1550 1406 A 16 TYR H A 16 TYR HBx 1.0 . 3.18 1551 1407 A 16 TYR H A 17 PRO HDx 1.0 . 4.96 1552 1407 A 16 TYR H A 17 PRO HDy 1.0 . 4.96 1553 1408 A 16 TYR HA A 17 PRO HDx 1.0 . 3.27 1554 1408 A 16 TYR HA A 17 PRO HDy 1.0 . 3.27 1555 1409 A 16 TYR HA A 104 LEU HDy% 1.0 . 4.53 1556 1409 A 16 TYR HA A 104 LEU HDx% 1.0 . 4.53 1557 1410 A 16 TYR HBx A 17 PRO HDx 1.0 . 4.00 1558 1410 A 16 TYR HBy A 17 PRO HDx 1.0 . 4.00 1559 1410 A 17 PRO HDy A 16 TYR HBy 1.0 . 4.00 1560 1410 A 16 TYR HBx A 17 PRO HDy 1.0 . 4.00 1561 1411 A 16 TYR HBx A 104 LEU HDy% 1.0 . 5.28 1562 1411 A 16 TYR HBy A 104 LEU HDy% 1.0 . 5.28 1563 1411 A 104 LEU HDx% A 16 TYR HBy 1.0 . 5.28 1564 1411 A 16 TYR HBx A 104 LEU HDx% 1.0 . 5.28 1565 1412 A 21 GLN HBy A 17 PRO HBx 1.0 . 5.34 1566 1412 A 21 GLN HBy A 17 PRO HBy 1.0 . 5.34 1567 1413 A 17 PRO HBx A 51 VAL HGx% 1.0 . 3.40 1568 1413 A 51 VAL HGy% A 17 PRO HBx 1.0 . 3.40 1569 1413 A 17 PRO HBy A 51 VAL HGy% 1.0 . 3.40 1570 1413 A 17 PRO HBy A 51 VAL HGx% 1.0 . 3.40 1571 1414 A 17 PRO HBx A 104 LEU HDy% 1.0 . 4.71 1572 1414 A 17 PRO HBy A 104 LEU HDy% 1.0 . 4.71 1573 1414 A 104 LEU HDx% A 17 PRO HBx 1.0 . 4.71 1574 1414 A 104 LEU HDx% A 17 PRO HBy 1.0 . 4.71 1575 1415 A 17 PRO HGy A 51 VAL HGx% 1.0 . 3.64 1576 1415 A 17 PRO HGy A 51 VAL HGy% 1.0 . 3.64 1577 1416 A 17 PRO HGy A 64 VAL HGx% 1.0 . 3.91 1578 1416 A 17 PRO HGy A 64 VAL HGy% 1.0 . 3.91 1579 1417 A 17 PRO HGy A 104 LEU HDy% 1.0 . 4.32 1580 1417 A 17 PRO HGy A 104 LEU HDx% 1.0 . 4.32 1581 1418 A 17 PRO HGx A 51 VAL HGx% 1.0 . 5.36 1582 1418 A 17 PRO HGx A 51 VAL HGy% 1.0 . 5.36 1583 1419 A 17 PRO HGx A 64 VAL HGx% 1.0 . 3.38 1584 1419 A 17 PRO HGx A 64 VAL HGy% 1.0 . 3.38 1585 1420 A 17 PRO HGx A 104 LEU HDy% 1.0 . 4.12 1586 1420 A 17 PRO HGx A 104 LEU HDx% 1.0 . 4.12 1587 1421 A 67 MET H A 17 PRO HDx 1.0 . 3.78 1588 1421 A 67 MET H A 17 PRO HDy 1.0 . 3.78 1589 1422 A 68 SER H A 17 PRO HDx 1.0 . 5.35 1590 1422 A 68 SER H A 17 PRO HDy 1.0 . 5.35 1591 1423 A 68 SER HA A 17 PRO HDx 1.0 . 4.66 1592 1423 A 68 SER HA A 17 PRO HDy 1.0 . 4.66 1593 1424 A 17 PRO HDx A 104 LEU HDy% 1.0 . 3.70 1594 1424 A 17 PRO HDy A 104 LEU HDy% 1.0 . 3.70 1595 1424 A 104 LEU HDx% A 17 PRO HDx 1.0 . 3.70 1596 1424 A 17 PRO HDy A 104 LEU HDx% 1.0 . 3.70 1597 1425 A 18 LYS H A 18 LYS HBx 1.0 . 2.86 1598 1425 A 18 LYS H A 18 LYS HBy 1.0 . 2.86 1599 1426 A 18 LYS H A 107 VAL HGx% 1.0 . 3.76 1600 1426 A 18 LYS H A 107 VAL HGy% 1.0 . 3.76 1601 1427 A 18 LYS HA A 18 LYS HGy 1.0 . 3.63 1602 1427 A 18 LYS HA A 18 LYS HGx 1.0 . 3.63 1603 1428 A 19 ALA H A 18 LYS HBx 1.0 . 3.56 1604 1428 A 19 ALA H A 18 LYS HBy 1.0 . 3.56 1605 1429 A 21 GLN HBy A 18 LYS HBx 1.0 . 4.56 1606 1429 A 21 GLN HBy A 18 LYS HBy 1.0 . 4.56 1607 1430 A 21 GLN HE2x A 18 LYS HBx 1.0 . 4.65 1608 1430 A 21 GLN HE2x A 18 LYS HBy 1.0 . 4.65 1609 1431 A 21 GLN HE2y A 18 LYS HBx 1.0 . 4.63 1610 1431 A 21 GLN HE2y A 18 LYS HBy 1.0 . 4.63 1611 1432 A 19 ALA H A 18 LYS HGy 1.0 . 3.26 1612 1432 A 19 ALA H A 18 LYS HGx 1.0 . 3.26 1613 1433 A 19 ALA H A 51 VAL HGx% 1.0 . 5.01 1614 1433 A 19 ALA H A 51 VAL HGy% 1.0 . 5.01 1615 1434 A 19 ALA HA A 51 VAL HGx% 1.0 . 3.65 1616 1434 A 19 ALA HA A 51 VAL HGy% 1.0 . 3.65 1617 1435 A 20 GLY H A 51 VAL HGx% 1.0 . 4.82 1618 1435 A 20 GLY H A 51 VAL HGy% 1.0 . 4.82 1619 1436 A 21 GLN HA A 21 GLN HGx 1.0 . 3.20 1620 1436 A 21 GLN HA A 21 GLN HGy 1.0 . 3.20 1621 1437 A 21 GLN HBy A 107 VAL HGx% 1.0 . 4.63 1622 1437 A 21 GLN HBy A 107 VAL HGy% 1.0 . 4.63 1623 1438 A 21 GLN HBx A 107 VAL HGx% 1.0 . 4.18 1624 1438 A 21 GLN HBx A 107 VAL HGy% 1.0 . 4.18 1625 1439 A 21 GLN HE2x A 21 GLN HGx 1.0 . 3.08 1626 1439 A 21 GLN HE2x A 21 GLN HGy 1.0 . 3.08 1627 1440 A 21 GLN HE2y A 21 GLN HGx 1.0 . 3.55 1628 1440 A 21 GLN HE2y A 21 GLN HGy 1.0 . 3.55 1629 1441 A 22 VAL H A 21 GLN HGx 1.0 . 3.83 1630 1441 A 22 VAL H A 21 GLN HGy 1.0 . 3.83 1631 1442 A 21 GLN HE2x A 107 VAL HGx% 1.0 . 4.15 1632 1442 A 21 GLN HE2x A 107 VAL HGy% 1.0 . 4.15 1633 1443 A 21 GLN HE2y A 107 VAL HGx% 1.0 . 4.12 1634 1443 A 21 GLN HE2y A 107 VAL HGy% 1.0 . 4.12 1635 1444 A 22 VAL H A 22 VAL HGx% 1.0 . 2.98 1636 1444 A 22 VAL H A 22 VAL HGy% 1.0 . 2.98 1637 1445 A 22 VAL HA A 22 VAL HGx% 1.0 . 3.15 1638 1445 A 22 VAL HA A 22 VAL HGy% 1.0 . 3.15 1639 1446 A 23 ALA H A 22 VAL HGx% 1.0 . 3.15 1640 1446 A 23 ALA H A 22 VAL HGy% 1.0 . 3.15 1641 1447 A 48 ARG HBy A 22 VAL HGx% 1.0 . 3.39 1642 1447 A 48 ARG HBy A 22 VAL HGy% 1.0 . 3.39 1643 1448 A 48 ARG HBx A 22 VAL HGx% 1.0 . 4.42 1644 1448 A 48 ARG HBx A 22 VAL HGy% 1.0 . 4.42 1645 1449 A 22 VAL HGx% A 48 ARG HDy 1.0 . 4.35 1646 1449 A 22 VAL HGy% A 48 ARG HDy 1.0 . 4.35 1647 1449 A 48 ARG HDx A 22 VAL HGx% 1.0 . 4.35 1648 1449 A 22 VAL HGy% A 48 ARG HDx 1.0 . 4.35 1649 1450 A 49 PHE H A 22 VAL HGx% 1.0 . 3.21 1650 1450 A 49 PHE H A 22 VAL HGy% 1.0 . 3.21 1651 1451 A 50 THR H A 22 VAL HGx% 1.0 . 4.61 1652 1451 A 50 THR H A 22 VAL HGy% 1.0 . 4.61 1653 1452 A 23 ALA H A 48 ARG HDy 1.0 . 5.34 1654 1452 A 23 ALA H A 48 ARG HDx 1.0 . 5.34 1655 1453 A 23 ALA H A 51 VAL HGx% 1.0 . 3.84 1656 1453 A 23 ALA H A 51 VAL HGy% 1.0 . 3.84 1657 1454 A 23 ALA HA A 104 LEU HDy% 1.0 . 4.71 1658 1454 A 23 ALA HA A 104 LEU HDx% 1.0 . 4.71 1659 1455 A 24 VAL H A 104 LEU HDy% 1.0 . 3.95 1660 1455 A 24 VAL H A 104 LEU HDx% 1.0 . 3.95 1661 1456 A 24 VAL H A 106 ARG HBx 1.0 . 5.34 1662 1456 A 24 VAL H A 106 ARG HBy 1.0 . 5.34 1663 1457 A 24 VAL HB A 46 PRO HBy 1.0 . 5.34 1664 1457 A 24 VAL HB A 46 PRO HBx 1.0 . 5.34 1665 1458 A 24 VAL HGx% A 46 PRO HBy 1.0 . 3.12 1666 1458 A 24 VAL HGx% A 46 PRO HBx 1.0 . 3.12 1667 1459 A 24 VAL HGx% A 46 PRO HGy 1.0 . 3.64 1668 1459 A 24 VAL HGx% A 46 PRO HGx 1.0 . 3.64 1669 1460 A 24 VAL HGy% A 46 PRO HGy 1.0 . 4.90 1670 1460 A 24 VAL HGy% A 46 PRO HGx 1.0 . 4.90 1671 1461 A 24 VAL HGy% A 48 ARG HGy 1.0 . 3.75 1672 1461 A 24 VAL HGy% A 48 ARG HGx 1.0 . 3.75 1673 1462 A 24 VAL HGy% A 48 ARG HDy 1.0 . 4.59 1674 1462 A 24 VAL HGy% A 48 ARG HDx 1.0 . 4.59 1675 1463 A 24 VAL HGy% A 106 ARG HBx 1.0 . 5.32 1676 1463 A 24 VAL HGy% A 106 ARG HBy 1.0 . 5.32 1677 1464 A 25 VAL H A 25 VAL HGx% 1.0 . 3.09 1678 1464 A 25 VAL H A 25 VAL HGy% 1.0 . 3.09 1679 1465 A 25 VAL H A 46 PRO HBy 1.0 . 4.38 1680 1465 A 25 VAL H A 46 PRO HBx 1.0 . 4.38 1681 1466 A 25 VAL H A 47 PHE HBy 1.0 . 4.31 1682 1466 A 25 VAL H A 47 PHE HBx 1.0 . 4.31 1683 1467 A 25 VAL HA A 25 VAL HGx% 1.0 . 3.12 1684 1467 A 25 VAL HA A 25 VAL HGy% 1.0 . 3.12 1685 1468 A 25 VAL HA A 105 LEU HDy% 1.0 . 4.75 1686 1468 A 25 VAL HA A 105 LEU HDx% 1.0 . 4.75 1687 1469 A 25 VAL HB A 102 VAL HGx% 1.0 . 3.90 1688 1469 A 25 VAL HB A 102 VAL HGy% 1.0 . 3.90 1689 1470 A 25 VAL HB A 104 LEU HDy% 1.0 . 4.31 1690 1470 A 25 VAL HB A 104 LEU HDx% 1.0 . 4.31 1691 1471 A 26 HIS H A 25 VAL HGx% 1.0 . 4.02 1692 1471 A 26 HIS H A 25 VAL HGy% 1.0 . 4.02 1693 1472 A 26 HIS HA A 25 VAL HGx% 1.0 . 4.55 1694 1472 A 26 HIS HA A 25 VAL HGy% 1.0 . 4.55 1695 1473 A 27 TYR H A 25 VAL HGx% 1.0 . 4.66 1696 1473 A 27 TYR H A 25 VAL HGy% 1.0 . 4.66 1697 1474 A 27 TYR HD% A 25 VAL HGx% 1.0 . 4.57 1698 1474 A 27 TYR HD% A 25 VAL HGy% 1.0 . 4.57 1699 1475 A 25 VAL HGx% A 47 PHE HBy 1.0 . 3.87 1700 1475 A 25 VAL HGy% A 47 PHE HBy 1.0 . 3.87 1701 1475 A 47 PHE HBx A 25 VAL HGx% 1.0 . 3.87 1702 1475 A 25 VAL HGy% A 47 PHE HBx 1.0 . 3.87 1703 1476 A 47 PHE HD% A 25 VAL HGx% 1.0 . 4.49 1704 1476 A 47 PHE HD% A 25 VAL HGy% 1.0 . 4.49 1705 1477 A 48 ARG H A 25 VAL HGx% 1.0 . 5.44 1706 1477 A 48 ARG H A 25 VAL HGy% 1.0 . 5.44 1707 1478 A 48 ARG HA A 25 VAL HGx% 1.0 . 4.28 1708 1478 A 48 ARG HA A 25 VAL HGy% 1.0 . 4.28 1709 1479 A 49 PHE HD% A 25 VAL HGx% 1.0 . 4.38 1710 1479 A 49 PHE HD% A 25 VAL HGy% 1.0 . 4.38 1711 1480 A 49 PHE HE% A 25 VAL HGx% 1.0 . 3.77 1712 1480 A 49 PHE HE% A 25 VAL HGy% 1.0 . 3.77 1713 1481 A 49 PHE HZ A 25 VAL HGx% 1.0 . 4.80 1714 1481 A 49 PHE HZ A 25 VAL HGy% 1.0 . 4.80 1715 1482 A 67 MET HE% A 25 VAL HGx% 1.0 . 5.09 1716 1482 A 67 MET HE% A 25 VAL HGy% 1.0 . 5.09 1717 1483 A 103 GLU H A 25 VAL HGx% 1.0 . 4.42 1718 1483 A 103 GLU H A 25 VAL HGy% 1.0 . 4.42 1719 1484 A 104 LEU H A 25 VAL HGx% 1.0 . 4.48 1720 1484 A 104 LEU H A 25 VAL HGy% 1.0 . 4.48 1721 1485 A 25 VAL HGy% A 104 LEU HBx 1.0 . 4.66 1722 1485 A 25 VAL HGx% A 104 LEU HBx 1.0 . 4.66 1723 1485 A 104 LEU HBy A 25 VAL HGx% 1.0 . 4.66 1724 1485 A 25 VAL HGy% A 104 LEU HBy 1.0 . 4.66 1725 1486 A 26 HIS H A 46 PRO HBy 1.0 . 5.13 1726 1486 A 26 HIS H A 46 PRO HBx 1.0 . 5.13 1727 1487 A 26 HIS H A 102 VAL HGx% 1.0 . 4.51 1728 1487 A 26 HIS H A 102 VAL HGy% 1.0 . 4.51 1729 1488 A 26 HIS H A 103 GLU HBx 1.0 . 5.14 1730 1488 A 26 HIS H A 103 GLU HBy 1.0 . 5.14 1731 1489 A 26 HIS H A 103 GLU HGy 1.0 . 5.34 1732 1489 A 26 HIS H A 103 GLU HGx 1.0 . 5.34 1733 1490 A 26 HIS H A 105 LEU HDy% 1.0 . 4.16 1734 1490 A 26 HIS H A 105 LEU HDx% 1.0 . 4.16 1735 1491 A 26 HIS HA A 105 LEU HDy% 1.0 . 4.79 1736 1491 A 26 HIS HA A 105 LEU HDx% 1.0 . 4.79 1737 1492 A 26 HIS HBx A 41 ARG HGy 1.0 . 4.12 1738 1492 A 26 HIS HBy A 41 ARG HGy 1.0 . 4.12 1739 1492 A 41 ARG HGx A 26 HIS HBy 1.0 . 4.12 1740 1492 A 26 HIS HBx A 41 ARG HGx 1.0 . 4.12 1741 1493 A 26 HIS HBy A 46 PRO HBy 1.0 . 5.18 1742 1493 A 46 PRO HBx A 26 HIS HBy 1.0 . 5.18 1743 1493 A 46 PRO HBx A 26 HIS HBx 1.0 . 5.18 1744 1493 A 26 HIS HBx A 46 PRO HBy 1.0 . 5.18 1745 1494 A 103 GLU H A 26 HIS HBy 1.0 . 4.24 1746 1494 A 103 GLU H A 26 HIS HBx 1.0 . 4.24 1747 1495 A 26 HIS HBx A 103 GLU HBx 1.0 . 4.18 1748 1495 A 26 HIS HBy A 103 GLU HBx 1.0 . 4.18 1749 1495 A 103 GLU HBy A 26 HIS HBy 1.0 . 4.18 1750 1495 A 103 GLU HBy A 26 HIS HBx 1.0 . 4.18 1751 1496 A 26 HIS HBx A 103 GLU HGy 1.0 . 4.76 1752 1496 A 26 HIS HBy A 103 GLU HGy 1.0 . 4.76 1753 1496 A 103 GLU HGx A 26 HIS HBy 1.0 . 4.76 1754 1496 A 103 GLU HGx A 26 HIS HBx 1.0 . 4.76 1755 1497 A 26 HIS HD2 A 105 LEU HDy% 1.0 . 3.92 1756 1497 A 26 HIS HD2 A 105 LEU HDx% 1.0 . 3.92 1757 1498 A 27 TYR H A 40 SER HBx 1.0 . 4.11 1758 1498 A 27 TYR H A 40 SER HBy 1.0 . 4.11 1759 1499 A 27 TYR HA A 102 VAL HGx% 1.0 . 3.96 1760 1499 A 27 TYR HA A 102 VAL HGy% 1.0 . 3.96 1761 1500 A 27 TYR HBy A 102 VAL HGx% 1.0 . 4.35 1762 1500 A 27 TYR HBy A 102 VAL HGy% 1.0 . 4.35 1763 1501 A 27 TYR HBx A 102 VAL HGx% 1.0 . 3.34 1764 1501 A 27 TYR HBx A 102 VAL HGy% 1.0 . 3.34 1765 1502 A 27 TYR HD% A 47 PHE HBy 1.0 . 3.87 1766 1502 A 27 TYR HD% A 47 PHE HBx 1.0 . 3.87 1767 1503 A 27 TYR HE% A 38 ASP HBx 1.0 . 4.53 1768 1503 A 27 TYR HE% A 38 ASP HBy 1.0 . 4.53 1769 1504 A 27 TYR HE% A 40 SER HBx 1.0 . 4.62 1770 1504 A 27 TYR HE% A 40 SER HBy 1.0 . 4.62 1771 1505 A 27 TYR HE% A 47 PHE HBy 1.0 . 3.70 1772 1505 A 27 TYR HE% A 47 PHE HBx 1.0 . 3.70 1773 1506 A 28 THR H A 101 ASP HBx 1.0 . 3.76 1774 1506 A 28 THR H A 101 ASP HBy 1.0 . 3.76 1775 1507 A 28 THR H A 102 VAL HGx% 1.0 . 4.34 1776 1507 A 28 THR H A 102 VAL HGy% 1.0 . 4.34 1777 1508 A 28 THR HA A 39 SER HBx 1.0 . 4.22 1778 1508 A 28 THR HA A 39 SER HBy 1.0 . 4.22 1779 1509 A 28 THR HB A 101 ASP HBx 1.0 . 3.65 1780 1509 A 28 THR HB A 101 ASP HBy 1.0 . 3.65 1781 1510 A 28 THR HG2% A 39 SER HBx 1.0 . 4.20 1782 1510 A 28 THR HG2% A 39 SER HBy 1.0 . 4.20 1783 1511 A 28 THR HG2% A 101 ASP HBx 1.0 . 4.41 1784 1511 A 28 THR HG2% A 101 ASP HBy 1.0 . 4.41 1785 1512 A 29 GLY H A 39 SER HBx 1.0 . 3.85 1786 1512 A 29 GLY H A 39 SER HBy 1.0 . 3.85 1787 1513 A 29 GLY H A 101 ASP HBx 1.0 . 5.34 1788 1513 A 29 GLY H A 101 ASP HBy 1.0 . 5.34 1789 1514 A 31 LEU H A 31 LEU HDy% 1.0 . 3.82 1790 1514 A 31 LEU H A 31 LEU HDx% 1.0 . 3.82 1791 1515 A 31 LEU H A 35 LYS HGx 1.0 . 5.34 1792 1515 A 31 LEU H A 35 LYS HGy 1.0 . 5.34 1793 1516 A 31 LEU HA A 31 LEU HDy% 1.0 . 3.28 1794 1516 A 31 LEU HA A 31 LEU HDx% 1.0 . 3.28 1795 1517 A 31 LEU HBy A 31 LEU HDy% 1.0 . 2.99 1796 1517 A 31 LEU HBy A 31 LEU HDx% 1.0 . 2.99 1797 1518 A 32 ALA H A 31 LEU HDy% 1.0 . 3.80 1798 1518 A 32 ALA H A 31 LEU HDx% 1.0 . 3.80 1799 1519 A 32 ALA HB% A 31 LEU HDy% 1.0 . 5.25 1800 1519 A 32 ALA HB% A 31 LEU HDx% 1.0 . 5.25 1801 1520 A 33 ASP H A 31 LEU HDy% 1.0 . 4.00 1802 1520 A 33 ASP H A 31 LEU HDx% 1.0 . 4.00 1803 1521 A 35 LYS H A 31 LEU HDy% 1.0 . 4.07 1804 1521 A 35 LYS H A 31 LEU HDx% 1.0 . 4.07 1805 1522 A 31 LEU HDx% A 35 LYS HBx 1.0 . 3.93 1806 1522 A 31 LEU HDy% A 35 LYS HBx 1.0 . 3.93 1807 1522 A 35 LYS HBy A 31 LEU HDy% 1.0 . 3.93 1808 1522 A 31 LEU HDx% A 35 LYS HBy 1.0 . 3.93 1809 1523 A 37 PHE HE% A 31 LEU HDy% 1.0 . 3.81 1810 1523 A 37 PHE HE% A 31 LEU HDx% 1.0 . 3.81 1811 1524 A 33 ASP H A 33 ASP HBx 1.0 . 3.20 1812 1524 A 33 ASP H A 33 ASP HBy 1.0 . 3.20 1813 1525 A 35 LYS H A 33 ASP HBx 1.0 . 4.11 1814 1525 A 35 LYS H A 33 ASP HBy 1.0 . 4.11 1815 1526 A 35 LYS H A 35 LYS HBx 1.0 . 2.70 1816 1526 A 35 LYS H A 35 LYS HBy 1.0 . 2.70 1817 1527 A 35 LYS H A 35 LYS HGx 1.0 . 4.12 1818 1527 A 35 LYS H A 35 LYS HGy 1.0 . 4.12 1819 1528 A 36 VAL H A 35 LYS HBx 1.0 . 4.25 1820 1528 A 36 VAL H A 35 LYS HBy 1.0 . 4.25 1821 1529 A 36 VAL H A 35 LYS HGx 1.0 . 4.25 1822 1529 A 36 VAL H A 35 LYS HGy 1.0 . 4.25 1823 1530 A 36 VAL HGy% A 39 SER HBx 1.0 . 4.35 1824 1530 A 36 VAL HGy% A 39 SER HBy 1.0 . 4.35 1825 1531 A 37 PHE HBx A 91 VAL HGx% 1.0 . 5.09 1826 1531 A 37 PHE HBx A 91 VAL HGy% 1.0 . 5.09 1827 1532 A 37 PHE HD% A 38 ASP HBx 1.0 . 4.25 1828 1532 A 37 PHE HD% A 38 ASP HBy 1.0 . 4.25 1829 1533 A 38 ASP H A 91 VAL HGx% 1.0 . 5.08 1830 1533 A 38 ASP H A 91 VAL HGy% 1.0 . 5.08 1831 1534 A 40 SER H A 39 SER HBx 1.0 . 3.51 1832 1534 A 40 SER H A 39 SER HBy 1.0 . 3.51 1833 1535 A 41 ARG H A 39 SER HBx 1.0 . 4.71 1834 1535 A 41 ARG H A 39 SER HBy 1.0 . 4.71 1835 1536 A 40 SER H A 40 SER HBx 1.0 . 3.66 1836 1536 A 40 SER H A 40 SER HBy 1.0 . 3.66 1837 1537 A 40 SER H A 41 ARG HBx 1.0 . 4.77 1838 1537 A 40 SER H A 41 ARG HBy 1.0 . 4.77 1839 1538 A 40 SER H A 41 ARG HGy 1.0 . 4.74 1840 1538 A 40 SER H A 41 ARG HGx 1.0 . 4.74 1841 1539 A 41 ARG H A 40 SER HBx 1.0 . 3.99 1842 1539 A 41 ARG H A 40 SER HBy 1.0 . 3.99 1843 1540 A 47 PHE H A 40 SER HBx 1.0 . 4.87 1844 1540 A 47 PHE H A 40 SER HBy 1.0 . 4.87 1845 1541 A 41 ARG H A 41 ARG HBx 1.0 . 3.21 1846 1541 A 41 ARG H A 41 ARG HBy 1.0 . 3.21 1847 1542 A 41 ARG HA A 41 ARG HGy 1.0 . 3.68 1848 1542 A 41 ARG HA A 41 ARG HGx 1.0 . 3.68 1849 1543 A 43 ARG HA A 43 ARG HGy 1.0 . 3.67 1850 1543 A 43 ARG HA A 43 ARG HGx 1.0 . 3.67 1851 1544 A 43 ARG HBx A 43 ARG HDy 1.0 . 3.25 1852 1544 A 43 ARG HBy A 43 ARG HDy 1.0 . 3.25 1853 1544 A 43 ARG HDx A 43 ARG HBx 1.0 . 3.25 1854 1544 A 43 ARG HBy A 43 ARG HDx 1.0 . 3.25 1855 1545 A 45 LYS H A 43 ARG HBx 1.0 . 3.58 1856 1545 A 45 LYS H A 43 ARG HBy 1.0 . 3.58 1857 1546 A 44 GLY H A 43 ARG HGy 1.0 . 4.66 1858 1546 A 44 GLY H A 43 ARG HGx 1.0 . 4.66 1859 1547 A 44 GLY H A 45 LYS HBx 1.0 . 5.34 1860 1547 A 44 GLY H A 45 LYS HBy 1.0 . 5.34 1861 1548 A 45 LYS H A 45 LYS HBx 1.0 . 3.05 1862 1548 A 45 LYS H A 45 LYS HBy 1.0 . 3.05 1863 1549 A 45 LYS HA A 46 PRO HGy 1.0 . 4.62 1864 1549 A 45 LYS HA A 46 PRO HGx 1.0 . 4.62 1865 1550 A 46 PRO HDy A 45 LYS HBx 1.0 . 4.39 1866 1550 A 46 PRO HDy A 45 LYS HBy 1.0 . 4.39 1867 1551 A 46 PRO HA A 105 LEU HDy% 1.0 . 4.55 1868 1551 A 46 PRO HA A 105 LEU HDx% 1.0 . 4.55 1869 1552 A 47 PHE HA A 46 PRO HBy 1.0 . 5.34 1870 1552 A 47 PHE HA A 46 PRO HBx 1.0 . 5.34 1871 1553 A 46 PRO HBy A 105 LEU HDy% 1.0 . 3.00 1872 1553 A 46 PRO HBx A 105 LEU HDy% 1.0 . 3.00 1873 1553 A 105 LEU HDx% A 46 PRO HBy 1.0 . 3.00 1874 1553 A 46 PRO HBx A 105 LEU HDx% 1.0 . 3.00 1875 1554 A 47 PHE H A 46 PRO HGy 1.0 . 4.50 1876 1554 A 47 PHE H A 46 PRO HGx 1.0 . 4.50 1877 1555 A 46 PRO HGy A 105 LEU HDy% 1.0 . 4.36 1878 1555 A 46 PRO HGx A 105 LEU HDy% 1.0 . 4.36 1879 1555 A 105 LEU HDx% A 46 PRO HGy 1.0 . 4.36 1880 1555 A 46 PRO HGx A 105 LEU HDx% 1.0 . 4.36 1881 1556 A 47 PHE H A 47 PHE HBy 1.0 . 3.08 1882 1556 A 47 PHE H A 47 PHE HBx 1.0 . 3.08 1883 1557 A 47 PHE HA A 48 ARG HGy 1.0 . 5.34 1884 1557 A 47 PHE HA A 48 ARG HGx 1.0 . 5.34 1885 1558 A 48 ARG H A 47 PHE HBy 1.0 . 3.90 1886 1558 A 48 ARG H A 47 PHE HBx 1.0 . 3.90 1887 1559 A 48 ARG H A 48 ARG HDy 1.0 . 5.25 1888 1559 A 48 ARG H A 48 ARG HDx 1.0 . 5.25 1889 1560 A 48 ARG HBy A 48 ARG HDy 1.0 . 3.49 1890 1560 A 48 ARG HBy A 48 ARG HDx 1.0 . 3.49 1891 1561 A 49 PHE HE% A 51 VAL HGx% 1.0 . 4.48 1892 1561 A 49 PHE HE% A 51 VAL HGy% 1.0 . 4.48 1893 1562 A 49 PHE HE% A 64 VAL HGx% 1.0 . 3.64 1894 1562 A 49 PHE HE% A 64 VAL HGy% 1.0 . 3.64 1895 1563 A 49 PHE HZ A 64 VAL HGx% 1.0 . 4.03 1896 1563 A 49 PHE HZ A 64 VAL HGy% 1.0 . 4.03 1897 1564 A 50 THR HG2% A 53 ARG HDx 1.0 . 4.24 1898 1564 A 50 THR HG2% A 53 ARG HDy 1.0 . 4.24 1899 1565 A 51 VAL H A 51 VAL HGx% 1.0 . 2.89 1900 1565 A 51 VAL H A 51 VAL HGy% 1.0 . 2.89 1901 1566 A 51 VAL HA A 51 VAL HGx% 1.0 . 3.08 1902 1566 A 51 VAL HA A 51 VAL HGy% 1.0 . 3.08 1903 1567 A 52 GLY H A 51 VAL HGx% 1.0 . 3.64 1904 1567 A 52 GLY H A 51 VAL HGy% 1.0 . 3.64 1905 1568 A 52 GLY HAx A 51 VAL HGx% 1.0 . 3.98 1906 1568 A 52 GLY HAx A 51 VAL HGy% 1.0 . 3.98 1907 1569 A 53 ARG H A 51 VAL HGx% 1.0 . 4.99 1908 1569 A 53 ARG H A 51 VAL HGy% 1.0 . 4.99 1909 1570 A 65 ALA H A 51 VAL HGx% 1.0 . 4.45 1910 1570 A 65 ALA H A 51 VAL HGy% 1.0 . 4.45 1911 1571 A 65 ALA HB% A 51 VAL HGx% 1.0 . 3.59 1912 1571 A 65 ALA HB% A 51 VAL HGy% 1.0 . 3.59 1913 1572 A 66 GLN H A 51 VAL HGx% 1.0 . 5.44 1914 1572 A 66 GLN H A 51 VAL HGy% 1.0 . 5.44 1915 1573 A 53 ARG H A 53 ARG HDx 1.0 . 4.57 1916 1573 A 53 ARG H A 53 ARG HDy 1.0 . 4.57 1917 1574 A 53 ARG HA A 53 ARG HDx 1.0 . 3.46 1918 1574 A 53 ARG HA A 53 ARG HDy 1.0 . 3.46 1919 1575 A 58 ARG H A 58 ARG HDy 1.0 . 4.49 1920 1575 A 58 ARG H A 58 ARG HDx 1.0 . 4.49 1921 1576 A 58 ARG HA A 58 ARG HGy 1.0 . 3.59 1922 1576 A 58 ARG HA A 58 ARG HGx 1.0 . 3.59 1923 1577 A 58 ARG HBy A 58 ARG HDy 1.0 . 3.70 1924 1577 A 58 ARG HBy A 58 ARG HDx 1.0 . 3.70 1925 1578 A 58 ARG HBy A 77 CYS HBx 1.0 . 5.34 1926 1578 A 58 ARG HBy A 77 CYS HBy 1.0 . 5.34 1927 1579 A 59 GLY H A 58 ARG HGy 1.0 . 4.72 1928 1579 A 59 GLY H A 58 ARG HGx 1.0 . 4.72 1929 1580 A 82 ALA H A 58 ARG HGy 1.0 . 5.34 1930 1580 A 82 ALA H A 58 ARG HGx 1.0 . 5.34 1931 1581 A 81 TYR HA A 58 ARG HDy 1.0 . 5.19 1932 1581 A 81 TYR HA A 58 ARG HDx 1.0 . 5.19 1933 1582 A 59 GLY H A 77 CYS HBx 1.0 . 4.83 1934 1582 A 59 GLY H A 77 CYS HBy 1.0 . 4.83 1935 1583 A 59 GLY HAy A 62 GLU HBx 1.0 . 5.34 1936 1583 A 59 GLY HAy A 62 GLU HBy 1.0 . 5.34 1937 1584 A 60 TRP HA A 64 VAL HGx% 1.0 . 4.18 1938 1584 A 60 TRP HA A 64 VAL HGy% 1.0 . 4.18 1939 1585 A 60 TRP HA A 75 LEU HDy% 1.0 . 4.04 1940 1585 A 60 TRP HA A 75 LEU HDx% 1.0 . 4.04 1941 1586 A 60 TRP HBx A 64 VAL HGx% 1.0 . 4.64 1942 1586 A 60 TRP HBx A 64 VAL HGy% 1.0 . 4.64 1943 1587 A 60 TRP HE1 A 102 VAL HGx% 1.0 . 3.81 1944 1587 A 60 TRP HE1 A 102 VAL HGy% 1.0 . 3.81 1945 1588 A 61 ASP H A 62 GLU HBx 1.0 . 5.26 1946 1588 A 61 ASP H A 62 GLU HBy 1.0 . 5.26 1947 1589 A 61 ASP H A 64 VAL HGx% 1.0 . 4.49 1948 1589 A 61 ASP H A 64 VAL HGy% 1.0 . 4.49 1949 1590 A 61 ASP HA A 64 VAL HGx% 1.0 . 5.24 1950 1590 A 61 ASP HA A 64 VAL HGy% 1.0 . 5.24 1951 1591 A 62 GLU H A 62 GLU HBx 1.0 . 3.02 1952 1591 A 62 GLU H A 62 GLU HBy 1.0 . 3.02 1953 1592 A 62 GLU H A 62 GLU HGx 1.0 . 3.31 1954 1592 A 62 GLU H A 62 GLU HGy 1.0 . 3.31 1955 1593 A 62 GLU HA A 62 GLU HGx 1.0 . 3.60 1956 1593 A 62 GLU HA A 62 GLU HGy 1.0 . 3.60 1957 1594 A 63 GLY H A 62 GLU HBx 1.0 . 3.25 1958 1594 A 63 GLY H A 62 GLU HBy 1.0 . 3.25 1959 1595 A 64 VAL H A 62 GLU HBx 1.0 . 5.34 1960 1595 A 64 VAL H A 62 GLU HBy 1.0 . 5.34 1961 1596 A 65 ALA H A 62 GLU HBx 1.0 . 5.34 1962 1596 A 65 ALA H A 62 GLU HBy 1.0 . 5.34 1963 1597 A 66 GLN HE2x A 62 GLU HBx 1.0 . 4.29 1964 1597 A 66 GLN HE2x A 62 GLU HBy 1.0 . 4.29 1965 1598 A 66 GLN HE2y A 62 GLU HBx 1.0 . 4.53 1966 1598 A 66 GLN HE2y A 62 GLU HBy 1.0 . 4.53 1967 1599 A 63 GLY H A 62 GLU HGx 1.0 . 4.27 1968 1599 A 63 GLY H A 62 GLU HGy 1.0 . 4.27 1969 1600 A 63 GLY H A 75 LEU HDy% 1.0 . 3.45 1970 1600 A 63 GLY H A 75 LEU HDx% 1.0 . 3.45 1971 1601 A 63 GLY HAx A 75 LEU HDy% 1.0 . 3.29 1972 1601 A 75 LEU HDx% A 63 GLY HAx 1.0 . 3.29 1973 1601 A 63 GLY HAy A 75 LEU HDx% 1.0 . 3.29 1974 1601 A 63 GLY HAy A 75 LEU HDy% 1.0 . 3.29 1975 1602 A 64 VAL H A 64 VAL HGx% 1.0 . 2.85 1976 1602 A 64 VAL H A 64 VAL HGy% 1.0 . 2.85 1977 1603 A 64 VAL H A 67 MET HGx 1.0 . 4.50 1978 1603 A 64 VAL H A 67 MET HGy 1.0 . 4.50 1979 1604 A 64 VAL H A 75 LEU HDy% 1.0 . 3.95 1980 1604 A 64 VAL H A 75 LEU HDx% 1.0 . 3.95 1981 1605 A 64 VAL H A 102 VAL HGx% 1.0 . 4.91 1982 1605 A 64 VAL H A 102 VAL HGy% 1.0 . 4.91 1983 1606 A 64 VAL HA A 67 MET HBy 1.0 . 3.75 1984 1606 A 64 VAL HA A 67 MET HBx 1.0 . 3.75 1985 1607 A 64 VAL HA A 67 MET HGx 1.0 . 3.79 1986 1607 A 64 VAL HA A 67 MET HGy 1.0 . 3.79 1987 1608 A 64 VAL HA A 102 VAL HGx% 1.0 . 4.26 1988 1608 A 64 VAL HA A 102 VAL HGy% 1.0 . 4.26 1989 1609 A 65 ALA H A 64 VAL HGx% 1.0 . 3.83 1990 1609 A 65 ALA H A 64 VAL HGy% 1.0 . 3.83 1991 1610 A 65 ALA HA A 64 VAL HGx% 1.0 . 4.42 1992 1610 A 65 ALA HA A 64 VAL HGy% 1.0 . 4.42 1993 1611 A 66 GLN H A 64 VAL HGx% 1.0 . 5.44 1994 1611 A 66 GLN H A 64 VAL HGy% 1.0 . 5.44 1995 1612 A 67 MET H A 64 VAL HGx% 1.0 . 4.25 1996 1612 A 67 MET H A 64 VAL HGy% 1.0 . 4.25 1997 1613 A 64 VAL HGx% A 67 MET HGx 1.0 . 4.58 1998 1613 A 64 VAL HGy% A 67 MET HGx 1.0 . 4.58 1999 1613 A 67 MET HGy A 64 VAL HGx% 1.0 . 4.58 2000 1613 A 67 MET HGy A 64 VAL HGy% 1.0 . 4.58 2001 1614 A 65 ALA H A 66 GLN HBx 1.0 . 5.34 2002 1614 A 65 ALA H A 66 GLN HBy 1.0 . 5.34 2003 1615 A 65 ALA H A 66 GLN HGx 1.0 . 4.66 2004 1615 A 65 ALA H A 66 GLN HGy 1.0 . 4.66 2005 1616 A 65 ALA H A 67 MET HBy 1.0 . 5.34 2006 1616 A 65 ALA H A 67 MET HBx 1.0 . 5.34 2007 1617 A 65 ALA H A 67 MET HGx 1.0 . 4.70 2008 1617 A 65 ALA H A 67 MET HGy 1.0 . 4.70 2009 1618 A 66 GLN H A 66 GLN HBx 1.0 . 3.08 2010 1618 A 66 GLN H A 66 GLN HBy 1.0 . 3.08 2011 1619 A 66 GLN H A 66 GLN HGx 1.0 . 3.27 2012 1619 A 66 GLN H A 66 GLN HGy 1.0 . 3.27 2013 1620 A 66 GLN H A 67 MET HGx 1.0 . 4.27 2014 1620 A 66 GLN H A 67 MET HGy 1.0 . 4.27 2015 1621 A 66 GLN H A 75 LEU HDy% 1.0 . 5.44 2016 1621 A 66 GLN H A 75 LEU HDx% 1.0 . 5.44 2017 1622 A 66 GLN HE2x A 66 GLN HBx 1.0 . 3.97 2018 1622 A 66 GLN HE2x A 66 GLN HBy 1.0 . 3.97 2019 1623 A 66 GLN HE2y A 66 GLN HGx 1.0 . 3.52 2020 1623 A 66 GLN HE2y A 66 GLN HGy 1.0 . 3.52 2021 1624 A 67 MET H A 66 GLN HGx 1.0 . 4.62 2022 1624 A 67 MET H A 66 GLN HGy 1.0 . 4.62 2023 1625 A 67 MET H A 67 MET HBy 1.0 . 3.11 2024 1625 A 67 MET H A 67 MET HBx 1.0 . 3.11 2025 1626 A 67 MET H A 67 MET HGx 1.0 . 3.70 2026 1626 A 67 MET H A 67 MET HGy 1.0 . 3.70 2027 1627 A 67 MET H A 104 LEU HDy% 1.0 . 4.31 2028 1627 A 67 MET H A 104 LEU HDx% 1.0 . 4.31 2029 1628 A 68 SER H A 67 MET HBy 1.0 . 3.20 2030 1628 A 68 SER H A 67 MET HBx 1.0 . 3.20 2031 1629 A 71 GLN HE2y A 67 MET HBy 1.0 . 4.70 2032 1629 A 71 GLN HE2y A 67 MET HBx 1.0 . 4.70 2033 1630 A 68 SER H A 67 MET HGx 1.0 . 5.04 2034 1630 A 68 SER H A 67 MET HGy 1.0 . 5.04 2035 1631 A 71 GLN HE2y A 67 MET HGx 1.0 . 5.21 2036 1631 A 71 GLN HE2y A 67 MET HGy 1.0 . 5.21 2037 1632 A 73 ALA HB% A 67 MET HGx 1.0 . 4.34 2038 1632 A 73 ALA HB% A 67 MET HGy 1.0 . 4.34 2039 1633 A 67 MET HGx A 102 VAL HGx% 1.0 . 5.04 2040 1633 A 67 MET HGy A 102 VAL HGx% 1.0 . 5.04 2041 1633 A 102 VAL HGy% A 67 MET HGx 1.0 . 5.04 2042 1633 A 67 MET HGy A 102 VAL HGy% 1.0 . 5.04 2043 1634 A 67 MET HE% A 102 VAL HGx% 1.0 . 3.23 2044 1634 A 67 MET HE% A 102 VAL HGy% 1.0 . 3.23 2045 1635 A 67 MET HE% A 104 LEU HBx 1.0 . 4.11 2046 1635 A 67 MET HE% A 104 LEU HBy 1.0 . 4.11 2047 1636 A 67 MET HE% A 104 LEU HDy% 1.0 . 4.28 2048 1636 A 67 MET HE% A 104 LEU HDx% 1.0 . 4.28 2049 1637 A 68 SER H A 71 GLN HGx 1.0 . 4.41 2050 1637 A 68 SER H A 71 GLN HGy 1.0 . 4.41 2051 1638 A 68 SER H A 104 LEU HDy% 1.0 . 4.17 2052 1638 A 68 SER H A 104 LEU HDx% 1.0 . 4.17 2053 1639 A 68 SER HA A 104 LEU HDy% 1.0 . 3.92 2054 1639 A 68 SER HA A 104 LEU HDx% 1.0 . 3.92 2055 1640 A 69 VAL H A 104 LEU HDy% 1.0 . 3.70 2056 1640 A 69 VAL H A 104 LEU HDx% 1.0 . 3.70 2057 1641 A 69 VAL HA A 104 LEU HBx 1.0 . 4.30 2058 1641 A 69 VAL HA A 104 LEU HBy 1.0 . 4.30 2059 1642 A 69 VAL HA A 104 LEU HDy% 1.0 . 3.63 2060 1642 A 69 VAL HA A 104 LEU HDx% 1.0 . 3.63 2061 1643 A 69 VAL HB A 104 LEU HDy% 1.0 . 4.78 2062 1643 A 69 VAL HB A 104 LEU HDx% 1.0 . 4.78 2063 1644 A 70 GLY H A 104 LEU HBx 1.0 . 3.77 2064 1644 A 70 GLY H A 104 LEU HBy 1.0 . 3.77 2065 1645 A 70 GLY H A 104 LEU HDy% 1.0 . 4.12 2066 1645 A 70 GLY H A 104 LEU HDx% 1.0 . 4.12 2067 1646 A 71 GLN H A 104 LEU HDy% 1.0 . 4.12 2068 1646 A 71 GLN H A 104 LEU HDx% 1.0 . 4.12 2069 1647 A 71 GLN HA A 71 GLN HGx 1.0 . 3.64 2070 1647 A 71 GLN HA A 71 GLN HGy 1.0 . 3.64 2071 1648 A 72 ARG H A 71 GLN HGx 1.0 . 3.23 2072 1648 A 72 ARG H A 71 GLN HGy 1.0 . 3.23 2073 1649 A 73 ALA H A 71 GLN HGx 1.0 . 5.34 2074 1649 A 73 ALA H A 71 GLN HGy 1.0 . 5.34 2075 1650 A 73 ALA HB% A 71 GLN HGx 1.0 . 4.26 2076 1650 A 73 ALA HB% A 71 GLN HGy 1.0 . 4.26 2077 1651 A 72 ARG HA A 72 ARG HGy 1.0 . 3.41 2078 1651 A 72 ARG HA A 72 ARG HGx 1.0 . 3.41 2079 1652 A 72 ARG HA A 72 ARG HDx 1.0 . 4.72 2080 1652 A 72 ARG HA A 72 ARG HDy 1.0 . 4.72 2081 1653 A 72 ARG HA A 103 GLU HBx 1.0 . 4.61 2082 1653 A 72 ARG HA A 103 GLU HBy 1.0 . 4.61 2083 1654 A 72 ARG HA A 103 GLU HGy 1.0 . 5.17 2084 1654 A 72 ARG HA A 103 GLU HGx 1.0 . 5.17 2085 1655 A 72 ARG HBx A 72 ARG HDx 1.0 . 3.72 2086 1655 A 72 ARG HBx A 72 ARG HDy 1.0 . 3.72 2087 1656 A 73 ALA H A 72 ARG HGy 1.0 . 3.31 2088 1656 A 73 ALA H A 72 ARG HGx 1.0 . 3.31 2089 1657 A 102 VAL H A 72 ARG HGy 1.0 . 5.03 2090 1657 A 102 VAL H A 72 ARG HGx 1.0 . 5.03 2091 1658 A 103 GLU HA A 72 ARG HGy 1.0 . 4.37 2092 1658 A 103 GLU HA A 72 ARG HGx 1.0 . 4.37 2093 1659 A 104 LEU H A 72 ARG HGy 1.0 . 5.34 2094 1659 A 104 LEU H A 72 ARG HGx 1.0 . 5.34 2095 1660 A 73 ALA H A 72 ARG HDx 1.0 . 4.72 2096 1660 A 73 ALA H A 72 ARG HDy 1.0 . 4.72 2097 1661 A 72 ARG HDy A 103 GLU HBx 1.0 . 4.17 2098 1661 A 72 ARG HDx A 103 GLU HBx 1.0 . 4.17 2099 1661 A 103 GLU HBy A 72 ARG HDx 1.0 . 4.17 2100 1661 A 72 ARG HDy A 103 GLU HBy 1.0 . 4.17 2101 1662 A 73 ALA H A 102 VAL HGx% 1.0 . 4.81 2102 1662 A 73 ALA H A 102 VAL HGy% 1.0 . 4.81 2103 1663 A 73 ALA H A 103 GLU HBx 1.0 . 5.34 2104 1663 A 73 ALA H A 103 GLU HBy 1.0 . 5.34 2105 1664 A 74 LYS H A 74 LYS HGx 1.0 . 3.27 2106 1664 A 74 LYS H A 74 LYS HGy 1.0 . 3.27 2107 1665 A 74 LYS HA A 102 VAL HGx% 1.0 . 4.68 2108 1665 A 74 LYS HA A 102 VAL HGy% 1.0 . 4.68 2109 1666 A 75 LEU H A 74 LYS HGx 1.0 . 4.49 2110 1666 A 75 LEU H A 74 LYS HGy 1.0 . 4.49 2111 1667 A 99 THR HG2% A 74 LYS HGx 1.0 . 4.31 2112 1667 A 99 THR HG2% A 74 LYS HGy 1.0 . 4.31 2113 1668 A 101 ASP HA A 74 LYS HGx 1.0 . 5.34 2114 1668 A 101 ASP HA A 74 LYS HGy 1.0 . 5.34 2115 1669 A 75 LEU H A 75 LEU HDy% 1.0 . 4.43 2116 1669 A 75 LEU H A 75 LEU HDx% 1.0 . 4.43 2117 1670 A 75 LEU H A 102 VAL HGx% 1.0 . 3.81 2118 1670 A 75 LEU H A 102 VAL HGy% 1.0 . 3.81 2119 1671 A 75 LEU HA A 75 LEU HDy% 1.0 . 3.38 2120 1671 A 75 LEU HA A 75 LEU HDx% 1.0 . 3.38 2121 1672 A 75 LEU HBy A 75 LEU HDy% 1.0 . 3.14 2122 1672 A 75 LEU HBy A 75 LEU HDx% 1.0 . 3.14 2123 1673 A 75 LEU HBx A 76 VAL HGx% 1.0 . 5.44 2124 1673 A 75 LEU HBx A 76 VAL HGy% 1.0 . 5.44 2125 1674 A 75 LEU HBx A 102 VAL HGx% 1.0 . 4.61 2126 1674 A 75 LEU HBx A 102 VAL HGy% 1.0 . 4.61 2127 1675 A 76 VAL H A 75 LEU HDy% 1.0 . 3.85 2128 1675 A 76 VAL H A 75 LEU HDx% 1.0 . 3.85 2129 1676 A 76 VAL H A 76 VAL HGx% 1.0 . 3.17 2130 1676 A 76 VAL H A 76 VAL HGy% 1.0 . 3.17 2131 1677 A 77 CYS H A 76 VAL HGx% 1.0 . 3.29 2132 1677 A 77 CYS H A 76 VAL HGy% 1.0 . 3.29 2133 1678 A 99 THR HA A 76 VAL HGx% 1.0 . 3.95 2134 1678 A 99 THR HA A 76 VAL HGy% 1.0 . 3.95 2135 1679 A 77 CYS H A 77 CYS HBx 1.0 . 3.27 2136 1679 A 77 CYS H A 77 CYS HBy 1.0 . 3.27 2137 1680 A 78 SER H A 77 CYS HBx 1.0 . 3.55 2138 1680 A 78 SER H A 77 CYS HBy 1.0 . 3.55 2139 1681 A 82 ALA HB% A 77 CYS HBx 1.0 . 4.10 2140 1681 A 82 ALA HB% A 77 CYS HBy 1.0 . 4.10 2141 1682 A 78 SER H A 78 SER HBx 1.0 . 3.10 2142 1682 A 78 SER H A 78 SER HBy 1.0 . 3.10 2143 1683 A 80 ASP HA A 78 SER HBx 1.0 . 5.03 2144 1683 A 80 ASP HA A 78 SER HBy 1.0 . 5.03 2145 1684 A 82 ALA H A 78 SER HBx 1.0 . 5.34 2146 1684 A 82 ALA H A 78 SER HBy 1.0 . 5.34 2147 1685 A 79 PRO HBx A 84 GLY HAy 1.0 . 4.34 2148 1685 A 79 PRO HBy A 84 GLY HAy 1.0 . 4.34 2149 1685 A 84 GLY HAx A 79 PRO HBx 1.0 . 4.34 2150 1685 A 79 PRO HBy A 84 GLY HAx 1.0 . 4.34 2151 1686 A 79 PRO HGx A 95 ASN HBx 1.0 . 4.25 2152 1686 A 79 PRO HGx A 95 ASN HBy 1.0 . 4.25 2153 1687 A 81 TYR H A 80 ASP HBx 1.0 . 3.61 2154 1687 A 81 TYR H A 80 ASP HBy 1.0 . 3.61 2155 1688 A 82 ALA H A 80 ASP HBx 1.0 . 4.91 2156 1688 A 82 ALA H A 80 ASP HBy 1.0 . 4.91 2157 1689 A 83 TYR H A 84 GLY HAy 1.0 . 4.88 2158 1689 A 83 TYR H A 84 GLY HAx 1.0 . 4.88 2159 1690 A 84 GLY H A 83 TYR HBy 1.0 . 4.41 2160 1690 A 84 GLY H A 83 TYR HBx 1.0 . 4.41 2161 1691 A 87 GLY H A 83 TYR HBy 1.0 . 4.07 2162 1691 A 87 GLY H A 83 TYR HBx 1.0 . 4.07 2163 1692 A 83 TYR HBx A 87 GLY HAy 1.0 . 4.51 2164 1692 A 83 TYR HBy A 87 GLY HAy 1.0 . 4.51 2165 1692 A 87 GLY HAx A 83 TYR HBy 1.0 . 4.51 2166 1692 A 83 TYR HBx A 87 GLY HAx 1.0 . 4.51 2167 1693 A 92 ILE HG2% A 83 TYR HBy 1.0 . 4.50 2168 1693 A 92 ILE HG2% A 83 TYR HBx 1.0 . 4.50 2169 1694 A 83 TYR HD% A 98 LEU HDy% 1.0 . 4.13 2170 1694 A 83 TYR HD% A 98 LEU HDx% 1.0 . 4.13 2171 1695 A 83 TYR HE% A 98 LEU HDy% 1.0 . 4.54 2172 1695 A 83 TYR HE% A 98 LEU HDx% 1.0 . 4.54 2173 1696 A 87 GLY H A 84 GLY HAy 1.0 . 4.76 2174 1696 A 87 GLY H A 84 GLY HAx 1.0 . 4.76 2175 1697 A 92 ILE HG2% A 84 GLY HAy 1.0 . 4.06 2176 1697 A 92 ILE HG2% A 84 GLY HAx 1.0 . 4.06 2177 1698 A 85 SER HA A 95 ASN HD2x 1.0 . 4.83 2178 1698 A 85 SER HA A 95 ASN HD2y 1.0 . 4.83 2179 1699 A 86 ARG H A 86 ARG HGy 1.0 . 4.70 2180 1699 A 86 ARG H A 86 ARG HGx 1.0 . 4.70 2181 1700 A 87 GLY H A 86 ARG HGy 1.0 . 4.17 2182 1700 A 87 GLY H A 86 ARG HGx 1.0 . 4.17 2183 1701 A 86 ARG HDx A 87 GLY HAy 1.0 . 4.61 2184 1701 A 86 ARG HDy A 87 GLY HAy 1.0 . 4.61 2185 1701 A 87 GLY HAx A 86 ARG HDx 1.0 . 4.61 2186 1701 A 86 ARG HDy A 87 GLY HAx 1.0 . 4.61 2187 1702 A 88 HIS H A 87 GLY HAy 1.0 . 3.03 2188 1702 A 88 HIS H A 87 GLY HAx 1.0 . 3.03 2189 1703 A 92 ILE HG2% A 87 GLY HAy 1.0 . 4.52 2190 1703 A 92 ILE HG2% A 87 GLY HAx 1.0 . 4.52 2191 1704 A 88 HIS HA A 89 PRO HDx 1.0 . 3.22 2192 1704 A 88 HIS HA A 89 PRO HDy 1.0 . 3.22 2193 1705 A 88 HIS HBy A 91 VAL HGx% 1.0 . 4.65 2194 1705 A 88 HIS HBy A 91 VAL HGy% 1.0 . 4.65 2195 1706 A 88 HIS HBx A 89 PRO HDx 1.0 . 3.72 2196 1706 A 88 HIS HBx A 89 PRO HDy 1.0 . 3.72 2197 1707 A 88 HIS HBx A 91 VAL HGx% 1.0 . 3.45 2198 1707 A 88 HIS HBx A 91 VAL HGy% 1.0 . 3.45 2199 1708 A 88 HIS HD2 A 91 VAL HGx% 1.0 . 4.33 2200 1708 A 88 HIS HD2 A 91 VAL HGy% 1.0 . 4.33 2201 1709 A 91 VAL H A 90 GLY HAy 1.0 . 3.10 2202 1709 A 91 VAL H A 90 GLY HAx 1.0 . 3.10 2203 1710 A 90 GLY HAy A 91 VAL HGx% 1.0 . 4.66 2204 1710 A 90 GLY HAx A 91 VAL HGx% 1.0 . 4.66 2205 1710 A 91 VAL HGy% A 90 GLY HAy 1.0 . 4.66 2206 1710 A 91 VAL HGy% A 90 GLY HAx 1.0 . 4.66 2207 1711 A 91 VAL H A 91 VAL HGx% 1.0 . 3.16 2208 1711 A 91 VAL H A 91 VAL HGy% 1.0 . 3.16 2209 1712 A 92 ILE HG1x A 91 VAL HGx% 1.0 . 3.56 2210 1712 A 92 ILE HG1x A 91 VAL HGy% 1.0 . 3.56 2211 1713 A 92 ILE H A 93 PRO HDx 1.0 . 4.41 2212 1713 A 92 ILE H A 93 PRO HDy 1.0 . 4.41 2213 1714 A 92 ILE HA A 93 PRO HGy 1.0 . 4.52 2214 1714 A 92 ILE HA A 93 PRO HGx 1.0 . 4.52 2215 1715 A 92 ILE HG2% A 93 PRO HDx 1.0 . 3.63 2216 1715 A 92 ILE HG2% A 93 PRO HDy 1.0 . 3.63 2217 1716 A 92 ILE HG1y A 93 PRO HDx 1.0 . 3.74 2218 1716 A 92 ILE HG1y A 93 PRO HDy 1.0 . 3.74 2219 1717 A 93 PRO HA A 94 PRO HGy 1.0 . 4.42 2220 1717 A 93 PRO HA A 94 PRO HGx 1.0 . 4.42 2221 1718 A 93 PRO HA A 94 PRO HDx 1.0 . 3.21 2222 1718 A 93 PRO HA A 94 PRO HDy 1.0 . 3.21 2223 1719 A 93 PRO HBy A 94 PRO HDx 1.0 . 3.43 2224 1719 A 93 PRO HBx A 94 PRO HDx 1.0 . 3.43 2225 1719 A 94 PRO HDy A 93 PRO HBy 1.0 . 3.43 2226 1719 A 94 PRO HDy A 93 PRO HBx 1.0 . 3.43 2227 1720 A 96 ALA HB% A 93 PRO HBy 1.0 . 3.94 2228 1720 A 96 ALA HB% A 93 PRO HBx 1.0 . 3.94 2229 1721 A 96 ALA HB% A 93 PRO HGy 1.0 . 3.32 2230 1721 A 96 ALA HB% A 93 PRO HGx 1.0 . 3.32 2231 1722 A 93 PRO HGx A 98 LEU HDy% 1.0 . 3.01 2232 1722 A 98 LEU HDx% A 93 PRO HGy 1.0 . 3.01 2233 1722 A 98 LEU HDx% A 93 PRO HGx 1.0 . 3.01 2234 1722 A 93 PRO HGy A 98 LEU HDy% 1.0 . 3.01 2235 1723 A 96 ALA HB% A 93 PRO HDx 1.0 . 3.95 2236 1723 A 96 ALA HB% A 93 PRO HDy 1.0 . 3.95 2237 1724 A 93 PRO HDy A 98 LEU HDy% 1.0 . 5.28 2238 1724 A 93 PRO HDx A 98 LEU HDy% 1.0 . 5.28 2239 1724 A 98 LEU HDx% A 93 PRO HDx 1.0 . 5.28 2240 1724 A 98 LEU HDx% A 93 PRO HDy 1.0 . 5.28 2241 1725 A 94 PRO HBx A 95 ASN HBx 1.0 . 4.22 2242 1725 A 94 PRO HBx A 95 ASN HBy 1.0 . 4.22 2243 1726 A 94 PRO HBy A 95 ASN HD2x 1.0 . 4.17 2244 1726 A 94 PRO HBy A 95 ASN HD2y 1.0 . 4.17 2245 1727 A 95 ASN H A 94 PRO HDx 1.0 . 4.93 2246 1727 A 95 ASN H A 94 PRO HDy 1.0 . 4.93 2247 1728 A 95 ASN HA A 95 ASN HD2x 1.0 . 4.25 2248 1728 A 95 ASN HA A 95 ASN HD2y 1.0 . 4.25 2249 1729 A 95 ASN HD2x A 95 ASN HBx 1.0 . 3.00 2250 1729 A 95 ASN HD2y A 95 ASN HBy 1.0 . 3.00 2251 1729 A 95 ASN HD2x A 95 ASN HBy 1.0 . 3.00 2252 1729 A 95 ASN HD2y A 95 ASN HBx 1.0 . 3.00 2253 1730 A 96 ALA HB% A 98 LEU HDy% 1.0 . 3.18 2254 1730 A 96 ALA HB% A 98 LEU HDx% 1.0 . 3.18 2255 1731 A 97 THR H A 98 LEU HDy% 1.0 . 5.02 2256 1731 A 97 THR H A 98 LEU HDx% 1.0 . 5.02 2257 1732 A 98 LEU H A 98 LEU HDy% 1.0 . 3.74 2258 1732 A 98 LEU H A 98 LEU HDx% 1.0 . 3.74 2259 1733 A 98 LEU HA A 98 LEU HDy% 1.0 . 3.17 2260 1733 A 98 LEU HA A 98 LEU HDx% 1.0 . 3.17 2261 1734 A 98 LEU HBx A 98 LEU HDy% 1.0 . 2.77 2262 1734 A 98 LEU HBy A 98 LEU HDy% 1.0 . 2.77 2263 1734 A 98 LEU HDx% A 98 LEU HBx 1.0 . 2.77 2264 1734 A 98 LEU HDx% A 98 LEU HBy 1.0 . 2.77 2265 1735 A 99 THR H A 98 LEU HBx 1.0 . 3.50 2266 1735 A 99 THR H A 98 LEU HBy 1.0 . 3.50 2267 1736 A 100 PHE H A 98 LEU HBx 1.0 . 4.71 2268 1736 A 100 PHE H A 98 LEU HBy 1.0 . 4.71 2269 1737 A 100 PHE HD% A 98 LEU HBx 1.0 . 4.48 2270 1737 A 100 PHE HD% A 98 LEU HBy 1.0 . 4.48 2271 1738 A 100 PHE HE% A 98 LEU HBx 1.0 . 4.56 2272 1738 A 100 PHE HE% A 98 LEU HBy 1.0 . 4.56 2273 1739 A 99 THR H A 98 LEU HDy% 1.0 . 3.80 2274 1739 A 99 THR H A 98 LEU HDx% 1.0 . 3.80 2275 1740 A 100 PHE H A 102 VAL HGx% 1.0 . 4.80 2276 1740 A 100 PHE H A 102 VAL HGy% 1.0 . 4.80 2277 1741 A 100 PHE HA A 102 VAL HGx% 1.0 . 5.04 2278 1741 A 100 PHE HA A 102 VAL HGy% 1.0 . 5.04 2279 1742 A 100 PHE HBy A 102 VAL HGx% 1.0 . 3.92 2280 1742 A 100 PHE HBy A 102 VAL HGy% 1.0 . 3.92 2281 1743 A 100 PHE HBx A 102 VAL HGx% 1.0 . 3.66 2282 1743 A 100 PHE HBx A 102 VAL HGy% 1.0 . 3.66 2283 1744 A 101 ASP H A 101 ASP HBx 1.0 . 2.98 2284 1744 A 101 ASP H A 101 ASP HBy 1.0 . 2.98 2285 1745 A 101 ASP H A 102 VAL HGx% 1.0 . 4.78 2286 1745 A 101 ASP H A 102 VAL HGy% 1.0 . 4.78 2287 1746 A 101 ASP HA A 102 VAL HGx% 1.0 . 4.75 2288 1746 A 101 ASP HA A 102 VAL HGy% 1.0 . 4.75 2289 1747 A 102 VAL H A 101 ASP HBx 1.0 . 3.97 2290 1747 A 102 VAL H A 101 ASP HBy 1.0 . 3.97 2291 1748 A 102 VAL H A 102 VAL HGx% 1.0 . 3.24 2292 1748 A 102 VAL H A 102 VAL HGy% 1.0 . 3.24 2293 1749 A 102 VAL HA A 102 VAL HGx% 1.0 . 3.14 2294 1749 A 102 VAL HA A 102 VAL HGy% 1.0 . 3.14 2295 1750 A 103 GLU H A 102 VAL HGx% 1.0 . 3.28 2296 1750 A 103 GLU H A 102 VAL HGy% 1.0 . 3.28 2297 1751 A 103 GLU H A 103 GLU HBx 1.0 . 3.26 2298 1751 A 103 GLU H A 103 GLU HBy 1.0 . 3.26 2299 1752 A 103 GLU H A 105 LEU HDy% 1.0 . 5.44 2300 1752 A 103 GLU H A 105 LEU HDx% 1.0 . 5.44 2301 1753 A 104 LEU H A 103 GLU HBx 1.0 . 4.48 2302 1753 A 104 LEU H A 103 GLU HBy 1.0 . 4.48 2303 1754 A 103 GLU HBx A 105 LEU HDy% 1.0 . 4.44 2304 1754 A 103 GLU HBy A 105 LEU HDy% 1.0 . 4.44 2305 1754 A 105 LEU HDx% A 103 GLU HBx 1.0 . 4.44 2306 1754 A 105 LEU HDx% A 103 GLU HBy 1.0 . 4.44 2307 1755 A 104 LEU H A 103 GLU HGy 1.0 . 3.97 2308 1755 A 104 LEU H A 103 GLU HGx 1.0 . 3.97 2309 1756 A 103 GLU HGy A 105 LEU HDy% 1.0 . 2.98 2310 1756 A 103 GLU HGx A 105 LEU HDy% 1.0 . 2.98 2311 1756 A 105 LEU HDx% A 103 GLU HGy 1.0 . 2.98 2312 1756 A 105 LEU HDx% A 103 GLU HGx 1.0 . 2.98 2313 1757 A 104 LEU H A 104 LEU HBx 1.0 . 3.05 2314 1757 A 104 LEU H A 104 LEU HBy 1.0 . 3.05 2315 1758 A 104 LEU H A 104 LEU HDy% 1.0 . 4.01 2316 1758 A 104 LEU H A 104 LEU HDx% 1.0 . 4.01 2317 1759 A 104 LEU HA A 104 LEU HDy% 1.0 . 3.25 2318 1759 A 104 LEU HA A 104 LEU HDx% 1.0 . 3.25 2319 1760 A 106 ARG H A 104 LEU HBx 1.0 . 5.34 2320 1760 A 106 ARG H A 104 LEU HBy 1.0 . 5.34 2321 1761 A 105 LEU H A 104 LEU HDy% 1.0 . 3.21 2322 1761 A 105 LEU H A 104 LEU HDx% 1.0 . 3.21 2323 1762 A 106 ARG H A 104 LEU HDy% 1.0 . 3.21 2324 1762 A 106 ARG H A 104 LEU HDx% 1.0 . 3.21 2325 1763 A 105 LEU H A 105 LEU HDy% 1.0 . 5.14 2326 1763 A 105 LEU H A 105 LEU HDx% 1.0 . 5.14 2327 1764 A 105 LEU HA A 105 LEU HDy% 1.0 . 3.44 2328 1764 A 105 LEU HA A 105 LEU HDx% 1.0 . 3.44 2329 1765 A 106 ARG HA A 107 VAL HGx% 1.0 . 3.86 2330 1765 A 106 ARG HA A 107 VAL HGy% 1.0 . 3.86 2331 1766 A 107 VAL H A 106 ARG HBx 1.0 . 2.90 2332 1766 A 107 VAL H A 106 ARG HBy 1.0 . 2.90 2333 1767 A 107 VAL HA A 106 ARG HBx 1.0 . 4.55 2334 1767 A 107 VAL HA A 106 ARG HBy 1.0 . 4.55 2335 1768 A 107 VAL H A 107 VAL HGx% 1.0 . 3.41 2336 1768 A 107 VAL H A 107 VAL HGy% 1.0 . 3.41 2337 1769 A 108 GLU H A 107 VAL HGx% 1.0 . 3.20 2338 1769 A 108 GLU H A 107 VAL HGy% 1.0 . 3.20 2339 1770 A 107 VAL HGx% A 108 GLU HGx 1.0 . 4.31 2340 1770 A 107 VAL HGy% A 108 GLU HGx 1.0 . 4.31 2341 1770 A 108 GLU HGy A 107 VAL HGx% 1.0 . 4.31 2342 1770 A 107 VAL HGy% A 108 GLU HGy 1.0 . 4.31 2343 1771 A 108 GLU H A 108 GLU HGx 1.0 . 3.47 2344 1771 A 108 GLU H A 108 GLU HGy 1.0 . 3.47 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 hbond _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 GLN H A 76 VAL O 1.0 . 2.0 2 2 A 76 VAL O A 4 GLN N 1.0 . 3.0 3 3 A 6 VAL H A 74 LYS O 1.0 . 2.0 4 4 A 74 LYS O A 6 VAL N 1.0 . 3.0 5 5 A 8 LEU H A 72 ARG O 1.0 . 2.0 6 6 A 72 ARG O A 8 LEU N 1.0 . 3.0 7 7 A 9 ALA H A 72 ARG O 1.0 . 2.0 8 8 A 72 ARG O A 9 ALA N 1.0 . 3.0 9 9 A 12 ASP H A 69 VAL O 1.0 . 2.0 10 10 A 69 VAL O A 12 ASP N 1.0 . 3.0 11 11 A 20 GLY H A 51 VAL O 1.0 . 2.0 12 12 A 51 VAL O A 20 GLY N 1.0 . 3.0 13 13 A 21 GLN H A 18 LYS O 1.0 . 2.0 14 14 A 18 LYS O A 21 GLN N 1.0 . 3.0 15 15 A 23 ALA H A 49 PHE O 1.0 . 2.0 16 16 A 49 PHE O A 23 ALA N 1.0 . 3.0 17 17 A 24 VAL H A 106 ARG O 1.0 . 2.0 18 18 A 106 ARG O A 24 VAL N 1.0 . 3.0 19 19 A 25 VAL H A 47 PHE O 1.0 . 2.0 20 20 A 47 PHE O A 25 VAL N 1.0 . 3.0 21 21 A 26 HIS H A 103 GLU O 1.0 . 2.0 22 22 A 103 GLU O A 26 HIS N 1.0 . 3.0 23 23 A 28 THR H A 101 ASP O 1.0 . 2.0 24 24 A 101 ASP O A 28 THR N 1.0 . 3.0 25 25 A 29 GLY H A 38 ASP O 1.0 . 2.0 26 26 A 38 ASP O A 29 GLY N 1.0 . 3.0 27 27 A 31 LEU H A 35 LYS O 1.0 . 2.0 28 28 A 35 LYS O A 31 LEU N 1.0 . 3.0 29 29 A 34 GLY H A 31 LEU O 1.0 . 2.0 30 30 A 31 LEU O A 34 GLY N 1.0 . 3.0 31 31 A 37 PHE H A 29 GLY O 1.0 . 2.0 32 32 A 29 GLY O A 37 PHE N 1.0 . 3.0 33 33 A 40 SER H A 27 TYR O 1.0 . 2.0 34 34 A 27 TYR O A 40 SER N 1.0 . 3.0 35 35 A 47 PHE H A 25 VAL O 1.0 . 2.0 36 36 A 25 VAL O A 47 PHE N 1.0 . 3.0 37 37 A 49 PHE H A 23 ALA O 1.0 . 2.0 38 38 A 23 ALA O A 49 PHE N 1.0 . 3.0 39 39 A 51 VAL H A 21 GLN O 1.0 . 2.0 40 40 A 21 GLN O A 51 VAL N 1.0 . 3.0 41 41 A 53 ARG H A 50 THR O 1.0 . 2.0 42 42 A 50 THR O A 53 ARG N 1.0 . 3.0 43 43 A 59 GLY H A 81 TYR O 1.0 . 2.0 44 44 A 81 TYR O A 59 GLY N 1.0 . 3.0 45 45 A 61 ASP H A 57 ILE O 1.0 . 2.0 46 46 A 57 ILE O A 61 ASP N 1.0 . 3.0 47 47 A 62 GLU H A 58 ARG O 1.0 . 2.0 48 48 A 58 ARG O A 62 GLU N 1.0 . 3.0 49 49 A 63 GLY H A 59 GLY O 1.0 . 2.0 50 50 A 59 GLY O A 63 GLY N 1.0 . 3.0 51 51 A 64 VAL H A 60 TRP O 1.0 . 2.0 52 52 A 60 TRP O A 64 VAL N 1.0 . 3.0 53 53 A 65 ALA H A 61 ASP O 1.0 . 2.0 54 54 A 61 ASP O A 65 ALA N 1.0 . 3.0 55 55 A 66 GLN H A 62 GLU O 1.0 . 2.0 56 56 A 62 GLU O A 66 GLN N 1.0 . 3.0 57 57 A 67 MET H A 64 VAL O 1.0 . 2.0 58 58 A 64 VAL O A 67 MET N 1.0 . 3.0 59 59 A 69 VAL H A 15 THR O 1.0 . 2.0 60 60 A 15 THR O A 69 VAL N 1.0 . 3.0 61 61 A 70 GLY H A 104 LEU O 1.0 . 2.0 62 62 A 104 LEU O A 70 GLY N 1.0 . 3.0 63 63 A 71 GLN H A 68 SER O 1.0 . 2.0 64 64 A 68 SER O A 71 GLN N 1.0 . 3.0 65 65 A 72 ARG H A 9 ALA O 1.0 . 2.0 66 66 A 9 ALA O A 72 ARG N 1.0 . 3.0 67 67 A 73 ALA H A 102 VAL O 1.0 . 2.0 68 68 A 102 VAL O A 73 ALA N 1.0 . 3.0 69 69 A 74 LYS H A 6 VAL O 1.0 . 2.0 70 70 A 6 VAL O A 74 LYS N 1.0 . 3.0 71 71 A 75 LEU H A 100 PHE O 1.0 . 2.0 72 72 A 100 PHE O A 75 LEU N 1.0 . 3.0 73 73 A 76 VAL H A 4 GLN O 1.0 . 2.0 74 74 A 4 GLN O A 76 VAL N 1.0 . 3.0 75 75 A 77 CYS H A 98 LEU O 1.0 . 2.0 76 76 A 98 LEU O A 77 CYS N 1.0 . 3.0 77 77 A 78 SER H A 2 GLY O 1.0 . 2.0 78 78 A 2 GLY O A 78 SER N 1.0 . 3.0 79 79 A 82 ALA H A 79 PRO O 1.0 . 2.0 80 80 A 79 PRO O A 82 ALA N 1.0 . 3.0 81 81 A 88 HIS H A 92 ILE O 1.0 . 2.0 82 82 A 92 ILE O A 88 HIS N 1.0 . 3.0 83 83 A 91 VAL H A 88 HIS O 1.0 . 2.0 84 84 A 88 HIS O A 91 VAL N 1.0 . 3.0 85 85 A 92 ILE H A 88 HIS O 1.0 . 2.0 86 86 A 88 HIS O A 92 ILE N 1.0 . 3.0 87 87 A 95 ASN H A 84 GLY O 1.0 . 2.0 88 88 A 84 GLY O A 95 ASN N 1.0 . 3.0 89 89 A 98 LEU H A 77 CYS O 1.0 . 2.0 90 90 A 77 CYS O A 98 LEU N 1.0 . 3.0 91 91 A 99 THR H A 30 THR O 1.0 . 2.0 92 92 A 30 THR O A 99 THR N 1.0 . 3.0 93 93 A 100 PHE H A 75 LEU O 1.0 . 2.0 94 94 A 75 LEU O A 100 PHE N 1.0 . 3.0 95 95 A 101 ASP H A 28 THR O 1.0 . 2.0 96 96 A 28 THR O A 101 ASP N 1.0 . 3.0 97 97 A 102 VAL H A 73 ALA O 1.0 . 2.0 98 98 A 73 ALA O A 102 VAL N 1.0 . 3.0 99 99 A 103 GLU H A 26 HIS O 1.0 . 2.0 100 100 A 26 HIS O A 103 GLU N 1.0 . 3.0 101 101 A 104 LEU H A 71 GLN O 1.0 . 2.0 102 102 A 71 GLN O A 104 LEU N 1.0 . 3.0 103 103 A 105 LEU H A 24 VAL O 1.0 . 2.0 104 104 A 24 VAL O A 105 LEU N 1.0 . 3.0 105 105 A 108 GLU H A 22 VAL O 1.0 . 2.0 106 106 A 22 VAL O A 108 GLU N 1.0 . 3.0 stop_ save_ save_DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 1 MET C A 2 GLY N A 2 GLY CA A 2 GLY C 1.0 58.1 104.0 PHI 2 2 A 2 GLY N A 2 GLY CA A 2 GLY C A 3 VAL N 1.0 -17.9 33.1 PSI 3 3 A 2 GLY C A 3 VAL N A 3 VAL CA A 3 VAL C 1.0 -159.7 -87.0 PHI 4 4 A 3 VAL N A 3 VAL CA A 3 VAL C A 4 GLN N 1.0 123.8 176.8 PSI 5 5 A 3 VAL C A 4 GLN N A 4 GLN CA A 4 GLN C 1.0 -157.7 -79.7 PHI 6 6 A 4 GLN N A 4 GLN CA A 4 GLN C A 5 VAL N 1.0 107.1 147.1 PSI 7 7 A 4 GLN C A 5 VAL N A 5 VAL CA A 5 VAL C 1.0 -127.4 -87.4 PHI 8 8 A 5 VAL N A 5 VAL CA A 5 VAL C A 6 VAL N 1.0 100.2 140.2 PSI 9 9 A 5 VAL C A 6 VAL N A 6 VAL CA A 6 VAL C 1.0 -159.8 -74.2 PHI 10 10 A 6 VAL N A 6 VAL CA A 6 VAL C A 7 THR N 1.0 89.9 148.2 PSI 11 11 A 7 THR C A 8 LEU N A 8 LEU CA A 8 LEU C 1.0 -125.3 -79.5 PHI 12 12 A 8 LEU N A 8 LEU CA A 8 LEU C A 9 ALA N 1.0 -73.5 21.5 PSI 13 13 A 9 ALA C A 10 ALA N A 10 ALA CA A 10 ALA C 1.0 -133.3 -29.1 PHI 14 14 A 10 ALA N A 10 ALA CA A 10 ALA C A 11 GLY N 1.0 112.8 182.1 PSI 15 15 A 15 THR C A 16 TYR N A 16 TYR CA A 16 TYR C 1.0 -171.3 -70.4 PHI 16 16 A 16 TYR N A 16 TYR CA A 16 TYR C A 17 PRO N 1.0 54.5 189.5 PSI 17 17 A 17 PRO N A 17 PRO CA A 17 PRO C A 18 LYS N 1.0 120.1 164.8 PSI 18 18 A 17 PRO C A 18 LYS N A 18 LYS CA A 18 LYS C 1.0 -149.9 -58.2 PHI 19 19 A 18 LYS N A 18 LYS CA A 18 LYS C A 19 ALA N 1.0 124.2 199.5 PSI 20 20 A 18 LYS C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -90.1 -34.2 PHI 21 21 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 GLY N 1.0 112.6 154.1 PSI 22 22 A 19 ALA C A 20 GLY N A 20 GLY CA A 20 GLY C 1.0 75.4 115.4 PHI 23 23 A 20 GLY N A 20 GLY CA A 20 GLY C A 21 GLN N 1.0 -39.7 1.9 PSI 24 24 A 21 GLN C A 22 VAL N A 22 VAL CA A 22 VAL C 1.0 -158.9 -63.7 PHI 25 25 A 22 VAL N A 22 VAL CA A 22 VAL C A 23 ALA N 1.0 103.3 177.0 PSI 26 26 A 22 VAL C A 23 ALA N A 23 ALA CA A 23 ALA C 1.0 -163.0 -58.5 PHI 27 27 A 23 ALA N A 23 ALA CA A 23 ALA C A 24 VAL N 1.0 105.7 161.6 PSI 28 28 A 23 ALA C A 24 VAL N A 24 VAL CA A 24 VAL C 1.0 -122.2 -78.0 PHI 29 29 A 24 VAL N A 24 VAL CA A 24 VAL C A 25 VAL N 1.0 109.2 166.3 PSI 30 30 A 24 VAL C A 25 VAL N A 25 VAL CA A 25 VAL C 1.0 -156.1 -116.1 PHI 31 31 A 25 VAL N A 25 VAL CA A 25 VAL C A 26 HIS N 1.0 134.5 190.7 PSI 32 32 A 25 VAL C A 26 HIS N A 26 HIS CA A 26 HIS C 1.0 -153.4 -106.5 PHI 33 33 A 26 HIS N A 26 HIS CA A 26 HIS C A 27 TYR N 1.0 121.1 161.1 PSI 34 34 A 26 HIS C A 27 TYR N A 27 TYR CA A 27 TYR C 1.0 -174.5 -102.2 PHI 35 35 A 27 TYR N A 27 TYR CA A 27 TYR C A 28 THR N 1.0 127.6 175.9 PSI 36 36 A 27 TYR C A 28 THR N A 28 THR CA A 28 THR C 1.0 -165.1 -108.7 PHI 37 37 A 28 THR N A 28 THR CA A 28 THR C A 29 GLY N 1.0 105.7 147.1 PSI 38 38 A 28 THR C A 29 GLY N A 29 GLY CA A 29 GLY C 1.0 -149.8 -66.2 PHI 39 39 A 29 GLY N A 29 GLY CA A 29 GLY C A 30 THR N 1.0 116.3 156.3 PSI 40 40 A 29 GLY C A 30 THR N A 30 THR CA A 30 THR C 1.0 -173.6 -93.4 PHI 41 41 A 30 THR N A 30 THR CA A 30 THR C A 31 LEU N 1.0 134.4 176.2 PSI 42 42 A 30 THR C A 31 LEU N A 31 LEU CA A 31 LEU C 1.0 -98.6 -54.3 PHI 43 43 A 31 LEU N A 31 LEU CA A 31 LEU C A 32 ALA N 1.0 131.6 188.3 PSI 44 44 A 31 LEU C A 32 ALA N A 32 ALA CA A 32 ALA C 1.0 -79.5 -39.5 PHI 45 45 A 32 ALA N A 32 ALA CA A 32 ALA C A 33 ASP N 1.0 -45.2 -5.2 PSI 46 46 A 32 ALA C A 33 ASP N A 33 ASP CA A 33 ASP C 1.0 -104.8 -64.8 PHI 47 47 A 33 ASP N A 33 ASP CA A 33 ASP C A 34 GLY N 1.0 -15.5 24.5 PSI 48 48 A 33 ASP C A 34 GLY N A 34 GLY CA A 34 GLY C 1.0 70.6 110.6 PHI 49 49 A 34 GLY N A 34 GLY CA A 34 GLY C A 35 LYS N 1.0 -26.4 21.6 PSI 50 50 A 34 GLY C A 35 LYS N A 35 LYS CA A 35 LYS C 1.0 -95.0 -46.6 PHI 51 51 A 35 LYS N A 35 LYS CA A 35 LYS C A 36 VAL N 1.0 111.6 151.8 PSI 52 52 A 35 LYS C A 36 VAL N A 36 VAL CA A 36 VAL C 1.0 -129.6 -64.2 PHI 53 53 A 36 VAL N A 36 VAL CA A 36 VAL C A 37 PHE N 1.0 106.2 146.2 PSI 54 54 A 36 VAL C A 37 PHE N A 37 PHE CA A 37 PHE C 1.0 -171.5 -72.0 PHI 55 55 A 37 PHE N A 37 PHE CA A 37 PHE C A 38 ASP N 1.0 127.4 184.2 PSI 56 56 A 37 PHE C A 38 ASP N A 38 ASP CA A 38 ASP C 1.0 -196.5 -58.0 PHI 57 57 A 38 ASP N A 38 ASP CA A 38 ASP C A 39 SER N 1.0 117.7 174.0 PSI 58 58 A 38 ASP C A 39 SER N A 39 SER CA A 39 SER C 1.0 -123.0 -61.0 PHI 59 59 A 39 SER N A 39 SER CA A 39 SER C A 40 SER N 1.0 69.1 185.2 PSI 60 60 A 39 SER C A 40 SER N A 40 SER CA A 40 SER C 1.0 -78.2 -38.2 PHI 61 61 A 40 SER N A 40 SER CA A 40 SER C A 41 ARG N 1.0 -54.4 -14.4 PSI 62 62 A 40 SER C A 41 ARG N A 41 ARG CA A 41 ARG C 1.0 -82.3 -42.3 PHI 63 63 A 41 ARG N A 41 ARG CA A 41 ARG C A 42 THR N 1.0 -63.0 -22.9 PSI 64 64 A 41 ARG C A 42 THR N A 42 THR CA A 42 THR C 1.0 -85.3 -45.3 PHI 65 65 A 42 THR N A 42 THR CA A 42 THR C A 43 ARG N 1.0 -60.7 -5.1 PSI 66 66 A 42 THR C A 43 ARG N A 43 ARG CA A 43 ARG C 1.0 -117.3 -72.0 PHI 67 67 A 43 ARG N A 43 ARG CA A 43 ARG C A 44 GLY N 1.0 -52.2 19.5 PSI 68 68 A 43 ARG C A 44 GLY N A 44 GLY CA A 44 GLY C 1.0 49.3 99.7 PHI 69 69 A 44 GLY N A 44 GLY CA A 44 GLY C A 45 LYS N 1.0 -1.1 54.3 PSI 70 70 A 44 GLY C A 45 LYS N A 45 LYS CA A 45 LYS C 1.0 -150.9 -65.7 PHI 71 71 A 45 LYS N A 45 LYS CA A 45 LYS C A 46 PRO N 1.0 65.2 187.8 PSI 72 72 A 46 PRO N A 46 PRO CA A 46 PRO C A 47 PHE N 1.0 117.0 167.4 PSI 73 73 A 46 PRO C A 47 PHE N A 47 PHE CA A 47 PHE C 1.0 -145.0 -63.9 PHI 74 74 A 47 PHE N A 47 PHE CA A 47 PHE C A 48 ARG N 1.0 99.4 160.9 PSI 75 75 A 47 PHE C A 48 ARG N A 48 ARG CA A 48 ARG C 1.0 -162.4 -82.6 PHI 76 76 A 48 ARG N A 48 ARG CA A 48 ARG C A 49 PHE N 1.0 125.0 167.0 PSI 77 77 A 48 ARG C A 49 PHE N A 49 PHE CA A 49 PHE C 1.0 -173.3 -105.7 PHI 78 78 A 49 PHE N A 49 PHE CA A 49 PHE C A 50 THR N 1.0 109.9 175.9 PSI 79 79 A 49 PHE C A 50 THR N A 50 THR CA A 50 THR C 1.0 -124.9 -70.0 PHI 80 80 A 50 THR N A 50 THR CA A 50 THR C A 51 VAL N 1.0 81.1 148.3 PSI 81 81 A 52 GLY C A 53 ARG N A 53 ARG CA A 53 ARG C 1.0 -128.9 -37.3 PHI 82 82 A 53 ARG N A 53 ARG CA A 53 ARG C A 54 GLY N 1.0 102.8 191.4 PSI 83 83 A 54 GLY C A 55 GLU N A 55 GLU CA A 55 GLU C 1.0 -122.9 -62.5 PHI 84 84 A 55 GLU N A 55 GLU CA A 55 GLU C A 56 VAL N 1.0 -48.0 19.4 PSI 85 85 A 55 GLU C A 56 VAL N A 56 VAL CA A 56 VAL C 1.0 -154.7 -93.5 PHI 86 86 A 56 VAL N A 56 VAL CA A 56 VAL C A 57 ILE N 1.0 147.5 187.5 PSI 87 87 A 57 ILE C A 58 ARG N A 58 ARG CA A 58 ARG C 1.0 -78.4 -38.4 PHI 88 88 A 58 ARG N A 58 ARG CA A 58 ARG C A 59 GLY N 1.0 -58.6 -18.6 PSI 89 89 A 58 ARG C A 59 GLY N A 59 GLY CA A 59 GLY C 1.0 -83.1 -43.1 PHI 90 90 A 59 GLY N A 59 GLY CA A 59 GLY C A 60 TRP N 1.0 -62.6 1.8 PSI 91 91 A 59 GLY C A 60 TRP N A 60 TRP CA A 60 TRP C 1.0 -91.2 -49.9 PHI 92 92 A 60 TRP N A 60 TRP CA A 60 TRP C A 61 ASP N 1.0 -63.5 -23.5 PSI 93 93 A 60 TRP C A 61 ASP N A 61 ASP CA A 61 ASP C 1.0 -81.8 -41.8 PHI 94 94 A 61 ASP N A 61 ASP CA A 61 ASP C A 62 GLU N 1.0 -62.9 -22.9 PSI 95 95 A 61 ASP C A 62 GLU N A 62 GLU CA A 62 GLU C 1.0 -87.5 -47.5 PHI 96 96 A 62 GLU N A 62 GLU CA A 62 GLU C A 63 GLY N 1.0 -71.0 -5.0 PSI 97 97 A 62 GLU C A 63 GLY N A 63 GLY CA A 63 GLY C 1.0 -98.6 -47.8 PHI 98 98 A 63 GLY N A 63 GLY CA A 63 GLY C A 64 VAL N 1.0 -63.4 -9.4 PSI 99 99 A 63 GLY C A 64 VAL N A 64 VAL CA A 64 VAL C 1.0 -85.0 -45.0 PHI 100 100 A 64 VAL N A 64 VAL CA A 64 VAL C A 65 ALA N 1.0 -59.4 -19.4 PSI 101 101 A 64 VAL C A 65 ALA N A 65 ALA CA A 65 ALA C 1.0 -81.6 -41.6 PHI 102 102 A 65 ALA N A 65 ALA CA A 65 ALA C A 66 GLN N 1.0 -45.1 -5.1 PSI 103 103 A 65 ALA C A 66 GLN N A 66 GLN CA A 66 GLN C 1.0 -129.6 -72.8 PHI 104 104 A 66 GLN N A 66 GLN CA A 66 GLN C A 67 MET N 1.0 -33.2 36.5 PSI 105 105 A 67 MET C A 68 SER N A 68 SER CA A 68 SER C 1.0 -153.4 -78.4 PHI 106 106 A 68 SER N A 68 SER CA A 68 SER C A 69 VAL N 1.0 132.0 187.1 PSI 107 107 A 68 SER C A 69 VAL N A 69 VAL CA A 69 VAL C 1.0 -78.5 -38.5 PHI 108 108 A 69 VAL N A 69 VAL CA A 69 VAL C A 70 GLY N 1.0 111.6 151.6 PSI 109 109 A 70 GLY C A 71 GLN N A 71 GLN CA A 71 GLN C 1.0 -151.0 -45.3 PHI 110 110 A 71 GLN N A 71 GLN CA A 71 GLN C A 72 ARG N 1.0 119.3 162.3 PSI 111 111 A 71 GLN C A 72 ARG N A 72 ARG CA A 72 ARG C 1.0 -149.8 -102.0 PHI 112 112 A 72 ARG N A 72 ARG CA A 72 ARG C A 73 ALA N 1.0 109.4 149.4 PSI 113 113 A 72 ARG C A 73 ALA N A 73 ALA CA A 73 ALA C 1.0 -167.4 -99.8 PHI 114 114 A 73 ALA N A 73 ALA CA A 73 ALA C A 74 LYS N 1.0 121.2 177.7 PSI 115 115 A 73 ALA C A 74 LYS N A 74 LYS CA A 74 LYS C 1.0 -136.6 -94.4 PHI 116 116 A 74 LYS N A 74 LYS CA A 74 LYS C A 75 LEU N 1.0 102.0 148.7 PSI 117 117 A 74 LYS C A 75 LEU N A 75 LEU CA A 75 LEU C 1.0 -129.9 -84.8 PHI 118 118 A 75 LEU N A 75 LEU CA A 75 LEU C A 76 VAL N 1.0 97.2 149.9 PSI 119 119 A 75 LEU C A 76 VAL N A 76 VAL CA A 76 VAL C 1.0 -138.9 -83.5 PHI 120 120 A 76 VAL N A 76 VAL CA A 76 VAL C A 77 CYS N 1.0 96.7 151.9 PSI 121 121 A 76 VAL C A 77 CYS N A 77 CYS CA A 77 CYS C 1.0 -126.1 -86.1 PHI 122 122 A 77 CYS N A 77 CYS CA A 77 CYS C A 78 SER N 1.0 97.3 162.3 PSI 123 123 A 77 CYS C A 78 SER N A 78 SER CA A 78 SER C 1.0 -107.0 -50.2 PHI 124 124 A 78 SER N A 78 SER CA A 78 SER C A 79 PRO N 1.0 92.6 196.4 PSI 125 125 A 79 PRO N A 79 PRO CA A 79 PRO C A 80 ASP N 1.0 -58.3 -18.3 PSI 126 126 A 79 PRO C A 80 ASP N A 80 ASP CA A 80 ASP C 1.0 -93.0 -53.0 PHI 127 127 A 80 ASP N A 80 ASP CA A 80 ASP C A 81 TYR N 1.0 -35.7 15.6 PSI 128 128 A 80 ASP C A 81 TYR N A 81 TYR CA A 81 TYR C 1.0 -126.2 -79.8 PHI 129 129 A 81 TYR N A 81 TYR CA A 81 TYR C A 82 ALA N 1.0 -27.4 36.9 PSI 130 130 A 82 ALA C A 83 TYR N A 83 TYR CA A 83 TYR C 1.0 -104.7 -33.8 PHI 131 131 A 83 TYR N A 83 TYR CA A 83 TYR C A 84 GLY N 1.0 -62.5 16.1 PSI 132 132 A 83 TYR C A 84 GLY N A 84 GLY CA A 84 GLY C 1.0 -81.3 -41.3 PHI 133 133 A 84 GLY N A 84 GLY CA A 84 GLY C A 85 SER N 1.0 -64.3 -24.4 PSI 134 134 A 84 GLY C A 85 SER N A 85 SER CA A 85 SER C 1.0 -82.2 -42.2 PHI 135 135 A 85 SER N A 85 SER CA A 85 SER C A 86 ARG N 1.0 -71.0 -7.8 PSI 136 136 A 85 SER C A 86 ARG N A 86 ARG CA A 86 ARG C 1.0 -107.6 -48.5 PHI 137 137 A 86 ARG N A 86 ARG CA A 86 ARG C A 87 GLY N 1.0 -58.5 -14.0 PSI 138 138 A 87 GLY C A 88 HIS N A 88 HIS CA A 88 HIS C 1.0 -158.2 -71.1 PHI 139 139 A 88 HIS N A 88 HIS CA A 88 HIS C A 89 PRO N 1.0 79.9 173.7 PSI 140 140 A 89 PRO N A 89 PRO CA A 89 PRO C A 90 GLY N 1.0 118.5 163.2 PSI 141 141 A 89 PRO C A 90 GLY N A 90 GLY CA A 90 GLY C 1.0 60.3 117.8 PHI 142 142 A 90 GLY N A 90 GLY CA A 90 GLY C A 91 VAL N 1.0 -26.2 13.8 PSI 143 143 A 91 VAL C A 92 ILE N A 92 ILE CA A 92 ILE C 1.0 -164.3 -96.4 PHI 144 144 A 92 ILE N A 92 ILE CA A 92 ILE C A 93 PRO N 1.0 80.7 200.7 PSI 145 145 A 93 PRO N A 93 PRO CA A 93 PRO C A 94 PRO N 1.0 117.8 157.8 PSI 146 146 A 95 ASN C A 96 ALA N A 96 ALA CA A 96 ALA C 1.0 -126.6 -47.3 PHI 147 147 A 96 ALA N A 96 ALA CA A 96 ALA C A 97 THR N 1.0 99.0 150.6 PSI 148 148 A 96 ALA C A 97 THR N A 97 THR CA A 97 THR C 1.0 -128.6 -55.6 PHI 149 149 A 97 THR N A 97 THR CA A 97 THR C A 98 LEU N 1.0 109.0 149.4 PSI 150 150 A 97 THR C A 98 LEU N A 98 LEU CA A 98 LEU C 1.0 -134.8 -94.3 PHI 151 151 A 98 LEU N A 98 LEU CA A 98 LEU C A 99 THR N 1.0 117.8 160.9 PSI 152 152 A 98 LEU C A 99 THR N A 99 THR CA A 99 THR C 1.0 -141.0 -65.2 PHI 153 153 A 99 THR N A 99 THR CA A 99 THR C A 100 PHE N 1.0 103.6 159.8 PSI 154 154 A 99 THR C A 100 PHE N A 100 PHE CA A 100 PHE C 1.0 -154.5 -98.8 PHI 155 155 A 100 PHE N A 100 PHE CA A 100 PHE C A 101 ASP N 1.0 116.3 156.3 PSI 156 156 A 100 PHE C A 101 ASP N A 101 ASP CA A 101 ASP C 1.0 -126.4 -64.2 PHI 157 157 A 101 ASP N A 101 ASP CA A 101 ASP C A 102 VAL N 1.0 99.3 143.3 PSI 158 158 A 101 ASP C A 102 VAL N A 102 VAL CA A 102 VAL C 1.0 -141.6 -101.6 PHI 159 159 A 102 VAL N A 102 VAL CA A 102 VAL C A 103 GLU N 1.0 117.2 157.2 PSI 160 160 A 102 VAL C A 103 GLU N A 103 GLU CA A 103 GLU C 1.0 -141.6 -93.7 PHI 161 161 A 103 GLU N A 103 GLU CA A 103 GLU C A 104 LEU N 1.0 102.2 142.2 PSI 162 162 A 103 GLU C A 104 LEU N A 104 LEU CA A 104 LEU C 1.0 -111.7 -65.7 PHI 163 163 A 104 LEU N A 104 LEU CA A 104 LEU C A 105 LEU N 1.0 91.5 131.5 PSI 164 164 A 104 LEU C A 105 LEU N A 105 LEU CA A 105 LEU C 1.0 -111.6 -64.0 PHI 165 165 A 105 LEU N A 105 LEU CA A 105 LEU C A 106 ARG N 1.0 -64.1 -18.1 PSI 166 166 A 105 LEU C A 106 ARG N A 106 ARG CA A 106 ARG C 1.0 -182.0 -142.0 PHI 167 167 A 106 ARG N A 106 ARG CA A 106 ARG C A 107 VAL N 1.0 140.5 180.5 PSI 168 168 A 106 ARG C A 107 VAL N A 107 VAL CA A 107 VAL C 1.0 -154.4 -76.7 PHI 169 169 A 107 VAL N A 107 VAL CA A 107 VAL C A 108 GLU N 1.0 102.2 159.0 PSI stop_ save_