data_nef_c18118_2lmi 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 GLY start . false 2 A 2 SER middle . . 3 A 3 LYS middle . . 4 A 4 LEU middle . . 5 A 5 GLU middle . . 6 A 6 GLU middle . . 7 A 7 GLU middle . . 8 A 8 VAL middle . . 9 A 9 ASP middle . . 10 A 10 ASP middle . . 11 A 11 VAL middle . . 12 A 12 PHE middle . . 13 A 13 LEU middle . . 14 A 14 ILE middle . . 15 A 15 ARG middle . . 16 A 16 ALA middle . . 17 A 17 GLN middle . . 18 A 18 GLY middle . false 19 A 19 LEU middle . . 20 A 20 PRO middle . false 21 A 21 TRP middle . . 22 A 22 SER middle . . 23 A 23 CYS middle . . 24 A 24 THR middle . . 25 A 25 MET middle . . 26 A 26 GLU middle . . 27 A 27 ASP middle . . 28 A 28 VAL middle . . 29 A 29 LEU middle . . 30 A 30 ASN middle . . 31 A 31 PHE middle . . 32 A 32 PHE middle . . 33 A 33 SER middle . . 34 A 34 ASP middle . . 35 A 35 CYS middle . . 36 A 36 ARG middle . . 37 A 37 ILE middle . . 38 A 38 ARG middle . . 39 A 39 ASN middle . . 40 A 40 GLY middle . false 41 A 41 GLU middle . . 42 A 42 ASN middle . . 43 A 43 GLY middle . false 44 A 44 ILE middle . . 45 A 45 HIS middle . . 46 A 46 PHE middle . . 47 A 47 LEU middle . . 48 A 48 LEU middle . . 49 A 49 ASN middle . . 50 A 50 ARG middle . . 51 A 51 ASP middle . . 52 A 52 GLY middle . false 53 A 53 LYS middle . . 54 A 54 ARG middle . . 55 A 55 ARG middle . . 56 A 56 GLY middle . false 57 A 57 ASP middle . . 58 A 58 ALA middle . . 59 A 59 LEU middle . . 60 A 60 ILE middle . . 61 A 61 GLU middle . . 62 A 62 MET middle . . 63 A 63 GLU middle . . 64 A 64 SER middle . . 65 A 65 GLU middle . . 66 A 66 GLN middle . . 67 A 67 ASP middle . . 68 A 68 VAL middle . . 69 A 69 GLN middle . . 70 A 70 LYS middle . . 71 A 71 ALA middle . . 72 A 72 LEU middle . . 73 A 73 GLU middle . . 74 A 74 LYS middle . . 75 A 75 HIS middle . . 76 A 76 ARG middle . . 77 A 77 MET middle . . 78 A 78 TYR middle . . 79 A 79 MET middle . . 80 A 80 GLY middle . false 81 A 81 GLN middle . . 82 A 82 ARG middle . . 83 A 83 TYR middle . . 84 A 84 VAL middle . . 85 A 85 GLU middle . . 86 A 86 VAL middle . . 87 A 87 TYR middle . . 88 A 88 GLU middle . . 89 A 89 ILE middle . . 90 A 90 ASN middle . . 91 A 91 ASN middle . . 92 A 92 GLU middle . . 93 A 93 ASP middle . . 94 A 94 VAL middle . . 95 A 95 ASP middle . . 96 A 96 ALA middle . . 97 A 97 LEU middle . . 98 A 98 MET middle . . 99 A 99 LYS middle . . 100 A 100 SER middle . . 101 A 101 LEU middle . . 102 A 102 GLN middle . . 103 A 103 VAL middle . . 104 A 104 LYS middle . . 105 A 105 SER middle . . 106 A 106 SER middle . . 107 A 107 PRO end . false stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 2 SER H H 1 8.195 0.000 A 2 SER HA H 1 4.707 0.000 A 2 SER HBx H 1 3.787 0.000 A 2 SER HBy H 1 3.787 0.000 A 2 SER CA C 13 55.678 0.000 A 2 SER CB C 13 61.009 0.000 A 2 SER N N 15 118.867 0.000 A 3 LYS H H 1 8.427 0.000 A 3 LYS CA C 13 53.708 0.000 A 3 LYS CB C 13 30.374 0.000 A 3 LYS N N 15 123.188 0.000 A 4 LEU H H 1 8.311 0.000 A 4 LEU HA H 1 4.204 0.000 A 4 LEU HBx H 1 1.531 0.000 A 4 LEU CA C 13 52.990 0.000 A 4 LEU CB C 13 39.667 0.000 A 4 LEU CDx C 13 18.847 0.000 A 4 LEU N N 15 123.342 0.000 A 5 GLU H H 1 8.321 0.000 A 5 GLU HA H 1 4.157 0.000 A 5 GLU HBx H 1 1.856 0.000 A 5 GLU HBy H 1 1.967 0.000 A 5 GLU HGx H 1 2.169 0.000 A 5 GLU HGy H 1 2.169 0.000 A 5 GLU CA C 13 54.230 0.000 A 5 GLU CB C 13 27.847 0.000 A 5 GLU CG C 13 33.681 0.000 A 5 GLU N N 15 120.431 0.000 A 6 GLU H H 1 8.177 0.000 A 6 GLU HA H 1 4.191 0.000 A 6 GLU HBy H 1 1.967 0.000 A 6 GLU HBx H 1 1.856 0.000 A 6 GLU HGx H 1 2.157 0.000 A 6 GLU CA C 13 53.842 0.000 A 6 GLU CB C 13 27.723 0.000 A 6 GLU CG C 13 33.755 0.000 A 6 GLU N N 15 120.027 0.000 A 7 GLU H H 1 8.228 0.000 A 7 GLU HA H 1 4.191 0.000 A 7 GLU HBy H 1 1.966 0.000 A 7 GLU HBx H 1 1.853 0.000 A 7 GLU HGx H 1 2.172 0.000 A 7 GLU HGy H 1 2.172 0.000 A 7 GLU CA C 13 53.679 0.000 A 7 GLU CB C 13 27.548 0.000 A 7 GLU CG C 13 33.738 0.000 A 7 GLU N N 15 121.663 0.000 A 8 VAL H H 1 8.102 0.000 A 8 VAL HA H 1 4.086 0.000 A 8 VAL HB H 1 1.994 0.000 A 8 VAL HGx% H 1 0.832 0.000 A 8 VAL HGy% H 1 0.814 0.000 A 8 VAL CA C 13 59.139 0.000 A 8 VAL CB C 13 30.700 0.000 A 8 VAL CGy C 13 18.713 0.000 A 8 VAL CGx C 13 17.780 0.000 A 8 VAL N N 15 120.733 0.000 A 9 ASP H H 1 8.313 0.000 A 9 ASP HA H 1 4.557 0.000 A 9 ASP HBx H 1 2.455 0.000 A 9 ASP HBy H 1 2.581 0.000 A 9 ASP CA C 13 51.180 0.000 A 9 ASP CB C 13 38.781 0.000 A 9 ASP N N 15 124.190 0.000 A 10 ASP H H 1 8.106 0.000 A 10 ASP HA H 1 4.379 0.000 A 10 ASP HBy H 1 2.404 0.000 A 10 ASP HBx H 1 2.309 0.000 A 10 ASP CA C 13 51.555 0.000 A 10 ASP CB C 13 39.138 0.000 A 10 ASP N N 15 120.966 0.000 A 11 VAL H H 1 7.528 0.000 A 11 VAL HA H 1 3.919 0.000 A 11 VAL HB H 1 1.680 0.000 A 11 VAL HGx% H 1 0.699 0.000 A 11 VAL HGy% H 1 0.699 0.000 A 11 VAL CA C 13 58.721 0.000 A 11 VAL CB C 13 31.300 0.000 A 11 VAL CGx C 13 18.531 0.000 A 11 VAL CGy C 13 18.531 0.000 A 11 VAL N N 15 119.321 0.000 A 12 PHE H H 1 8.573 0.000 A 12 PHE HA H 1 4.586 0.000 A 12 PHE HBx H 1 2.649 0.000 A 12 PHE HBy H 1 2.649 0.000 A 12 PHE HDx H 1 7.004 0.000 A 12 PHE HDy H 1 7.004 0.000 A 12 PHE CA C 13 53.764 0.000 A 12 PHE CB C 13 37.698 0.000 A 12 PHE CDy C 13 127.330 0.000 A 12 PHE CDx C 13 127.328 0.000 A 12 PHE N N 15 125.723 0.000 A 13 LEU H H 1 8.794 0.000 A 13 LEU HA H 1 5.232 0.000 A 13 LEU HBx H 1 1.241 0.000 A 13 LEU HBy H 1 1.426 0.000 A 13 LEU HDx% H 1 0.714 0.000 A 13 LEU HDy% H 1 0.714 0.000 A 13 LEU CA C 13 51.361 0.000 A 13 LEU CB C 13 44.651 0.000 A 13 LEU CDx C 13 23.630 0.000 A 13 LEU CDy C 13 23.634 0.000 A 13 LEU N N 15 123.923 0.000 A 14 ILE H H 1 8.316 0.000 A 14 ILE HA H 1 4.891 0.000 A 14 ILE HB H 1 1.645 0.000 A 14 ILE HD1% H 1 0.300 0.000 A 14 ILE HG1x H 1 0.821 0.000 A 14 ILE HG1y H 1 1.068 0.000 A 14 ILE HG2% H 1 0.648 0.000 A 14 ILE CA C 13 55.381 0.000 A 14 ILE CB C 13 39.318 0.000 A 14 ILE CD1 C 13 12.048 0.000 A 14 ILE CG1 C 13 24.154 0.000 A 14 ILE CG2 C 13 17.372 0.000 A 14 ILE N N 15 114.563 0.000 A 15 ARG H H 1 9.231 0.000 A 15 ARG HA H 1 5.334 0.000 A 15 ARG HBx H 1 1.440 0.000 A 15 ARG HBy H 1 1.706 0.000 A 15 ARG HDx H 1 3.058 0.000 A 15 ARG HDy H 1 3.058 0.000 A 15 ARG HGy H 1 1.459 0.000 A 15 ARG HGx H 1 1.310 0.000 A 15 ARG CA C 13 51.293 0.000 A 15 ARG CB C 13 31.850 0.000 A 15 ARG CD C 13 41.028 0.000 A 15 ARG CG C 13 25.523 0.000 A 15 ARG N N 15 122.555 0.000 A 16 ALA H H 1 9.005 0.000 A 16 ALA HA H 1 5.696 0.000 A 16 ALA HB% H 1 1.217 0.000 A 16 ALA CA C 13 46.775 0.000 A 16 ALA CB C 13 18.337 0.000 A 16 ALA N N 15 127.755 0.000 A 17 GLN H H 1 9.557 0.000 A 17 GLN HA H 1 5.135 0.000 A 17 GLN HBx H 1 1.993 0.000 A 17 GLN HBy H 1 2.116 0.000 A 17 GLN HE2x H 1 6.828 0.000 A 17 GLN HE2y H 1 7.574 0.000 A 17 GLN HGy H 1 2.377 0.000 A 17 GLN HGx H 1 2.254 0.000 A 17 GLN CA C 13 51.832 0.000 A 17 GLN CB C 13 30.738 0.000 A 17 GLN CG C 13 32.023 0.000 A 17 GLN N N 15 121.076 0.000 A 17 GLN NE2 N 15 111.738 0.000 A 18 GLY H H 1 8.294 0.000 A 18 GLY HAy H 1 4.490 0.000 A 18 GLY HAx H 1 3.600 0.000 A 18 GLY CA C 13 42.822 0.000 A 18 GLY N N 15 110.950 0.000 A 19 LEU H H 1 8.292 0.000 A 19 LEU HA H 1 4.032 0.000 A 19 LEU HBx H 1 1.323 0.000 A 19 LEU HBy H 1 1.530 0.000 A 19 LEU HDx% H 1 0.708 0.000 A 19 LEU HDy% H 1 0.580 0.000 A 19 LEU HG H 1 1.501 0.000 A 19 LEU CA C 13 50.705 0.000 A 19 LEU CB C 13 37.568 0.000 A 19 LEU CDy C 13 24.042 0.000 A 19 LEU CDx C 13 21.048 0.000 A 19 LEU CG C 13 24.643 0.000 A 19 LEU N N 15 118.809 0.000 A 20 PRO HA H 1 4.292 0.000 A 20 PRO HDx H 1 3.371 0.000 A 20 PRO HDy H 1 3.607 0.000 A 20 PRO HGx H 1 1.910 0.000 A 20 PRO HGy H 1 1.910 0.000 A 20 PRO CA C 13 60.101 0.000 A 20 PRO CB C 13 29.199 0.000 A 20 PRO CD C 13 47.848 0.000 A 20 PRO CG C 13 25.272 0.000 A 21 TRP H H 1 8.527 0.000 A 21 TRP HA H 1 4.690 0.000 A 21 TRP HBx H 1 3.178 0.000 A 21 TRP HD1 H 1 7.127 0.000 A 21 TRP HE1 H 1 10.006 0.000 A 21 TRP HZ2 H 1 7.428 0.000 A 21 TRP CA C 13 56.237 0.000 A 21 TRP CB C 13 25.965 0.000 A 21 TRP CD1 C 13 121.444 0.000 A 21 TRP CZ2 C 13 116.076 0.000 A 21 TRP N N 15 124.383 0.000 A 21 TRP NE1 N 15 128.859 0.000 A 22 SER H H 1 7.436 0.000 A 22 SER HA H 1 4.099 0.000 A 22 SER HBx H 1 3.132 0.000 A 22 SER HBy H 1 3.754 0.000 A 22 SER CA C 13 54.162 0.000 A 22 SER CB C 13 60.334 0.000 A 22 SER N N 15 109.532 0.000 A 23 CYS H H 1 7.221 0.000 A 23 CYS HA H 1 4.466 0.000 A 23 CYS HBy H 1 3.120 0.000 A 23 CYS HBx H 1 2.705 0.000 A 23 CYS CA C 13 55.975 0.000 A 23 CYS CB C 13 25.489 0.000 A 23 CYS N N 15 119.744 0.000 A 24 THR H H 1 9.082 0.000 A 24 THR HA H 1 4.697 0.000 A 24 THR HB H 1 4.467 0.000 A 24 THR HG2% H 1 1.238 0.000 A 24 THR CA C 13 57.172 0.000 A 24 THR CB C 13 56.222 0.000 A 24 THR CG2 C 13 19.217 0.000 A 24 THR N N 15 115.371 0.000 A 25 MET H H 1 8.794 0.000 A 25 MET HA H 1 4.161 0.000 A 25 MET HBy H 1 2.239 0.000 A 25 MET HBx H 1 1.850 0.000 A 25 MET HE% H 1 2.140 0.000 A 25 MET HGy H 1 2.716 0.000 A 25 MET CA C 13 57.241 0.000 A 25 MET CB C 13 29.452 0.000 A 25 MET CE C 13 15.532 0.000 A 25 MET CG C 13 30.664 0.000 A 25 MET N N 15 118.539 0.000 A 26 GLU H H 1 8.462 0.000 A 26 GLU HA H 1 3.802 0.000 A 26 GLU HBx H 1 1.842 0.000 A 26 GLU HBy H 1 1.978 0.000 A 26 GLU HGy H 1 2.227 0.000 A 26 GLU HGx H 1 2.191 0.000 A 26 GLU CA C 13 57.247 0.000 A 26 GLU CB C 13 26.663 0.000 A 26 GLU CG C 13 34.120 0.000 A 26 GLU N N 15 118.967 0.000 A 27 ASP H H 1 7.812 0.000 A 27 ASP HA H 1 4.299 0.000 A 27 ASP HBy H 1 3.124 0.000 A 27 ASP HBx H 1 2.559 0.000 A 27 ASP CA C 13 55.071 0.000 A 27 ASP CB C 13 38.656 0.000 A 27 ASP N N 15 118.711 0.000 A 28 VAL H H 1 7.528 0.000 A 28 VAL HA H 1 3.444 0.000 A 28 VAL HB H 1 2.323 0.000 A 28 VAL HGx% H 1 0.903 0.000 A 28 VAL HGy% H 1 1.039 0.000 A 28 VAL CA C 13 64.841 0.000 A 28 VAL CB C 13 29.052 0.000 A 28 VAL CGx C 13 20.340 0.000 A 28 VAL CGy C 13 21.535 0.000 A 28 VAL N N 15 120.825 0.000 A 29 LEU H H 1 8.399 0.000 A 29 LEU HA H 1 3.778 0.000 A 29 LEU HBx H 1 1.378 0.000 A 29 LEU HBy H 1 1.764 0.000 A 29 LEU HDx% H 1 0.711 0.000 A 29 LEU HDy% H 1 0.711 0.000 A 29 LEU HG H 1 1.540 0.000 A 29 LEU CA C 13 55.982 0.000 A 29 LEU CB C 13 38.954 0.000 A 29 LEU CDy C 13 21.410 0.000 A 29 LEU CDx C 13 21.407 0.000 A 29 LEU CG C 13 24.419 0.000 A 29 LEU N N 15 120.586 0.000 A 30 ASN H H 1 8.156 0.000 A 30 ASN HA H 1 4.398 0.000 A 30 ASN HBx H 1 2.729 0.000 A 30 ASN HBy H 1 2.811 0.000 A 30 ASN HD2x H 1 6.972 0.000 A 30 ASN HD2y H 1 7.588 0.000 A 30 ASN CA C 13 52.480 0.000 A 30 ASN CB C 13 36.132 0.000 A 30 ASN N N 15 114.059 0.000 A 30 ASN ND2 N 15 112.833 0.000 A 31 PHE H H 1 8.033 0.000 A 31 PHE HA H 1 4.127 0.000 A 31 PHE HBy H 1 3.064 0.000 A 31 PHE HBx H 1 2.682 0.000 A 31 PHE HDx H 1 6.186 0.000 A 31 PHE HDy H 1 6.186 0.000 A 31 PHE HEx H 1 6.617 0.000 A 31 PHE HEy H 1 6.617 0.000 A 31 PHE HZ H 1 6.941 0.000 A 31 PHE CA C 13 58.819 0.000 A 31 PHE CB C 13 37.176 0.000 A 31 PHE CDy C 13 126.490 0.000 A 31 PHE CDx C 13 126.485 0.000 A 31 PHE CEy C 13 126.180 0.000 A 31 PHE CEx C 13 126.176 0.000 A 31 PHE CZ C 13 125.262 0.000 A 31 PHE N N 15 123.816 0.000 A 32 PHE H H 1 7.622 0.000 A 32 PHE HA H 1 4.653 0.000 A 32 PHE HBy H 1 3.348 0.000 A 32 PHE HBx H 1 2.613 0.000 A 32 PHE HDx H 1 7.288 0.000 A 32 PHE HDy H 1 7.288 0.000 A 32 PHE HEx H 1 7.079 0.000 A 32 PHE HEy H 1 7.079 0.000 A 32 PHE CA C 13 54.039 0.000 A 32 PHE CB C 13 35.047 0.000 A 32 PHE CDx C 13 127.280 0.000 A 32 PHE CDy C 13 127.282 0.000 A 32 PHE CEx C 13 125.950 0.000 A 32 PHE CEy C 13 125.954 0.000 A 32 PHE N N 15 115.681 0.000 A 33 SER H H 1 6.834 0.000 A 33 SER HA H 1 4.111 0.000 A 33 SER HBy H 1 4.166 0.000 A 33 SER HBx H 1 3.946 0.000 A 33 SER CA C 13 59.041 0.000 A 33 SER CB C 13 60.339 0.000 A 33 SER N N 15 113.797 0.000 A 34 ASP H H 1 8.717 0.000 A 34 ASP HA H 1 4.581 0.000 A 34 ASP HBx H 1 2.671 0.000 A 34 ASP HBy H 1 2.671 0.000 A 34 ASP CA C 13 51.606 0.000 A 34 ASP CB C 13 37.727 0.000 A 34 ASP N N 15 119.155 0.000 A 35 CYS H H 1 8.009 0.000 A 35 CYS HA H 1 4.508 0.000 A 35 CYS HBy H 1 2.918 0.000 A 35 CYS HBx H 1 2.660 0.000 A 35 CYS CA C 13 54.961 0.000 A 35 CYS CB C 13 27.986 0.000 A 35 CYS N N 15 117.269 0.000 A 36 ARG H H 1 8.666 0.000 A 36 ARG HA H 1 4.289 0.000 A 36 ARG HBy H 1 1.814 0.000 A 36 ARG HBx H 1 1.459 0.000 A 36 ARG HDx H 1 3.113 0.000 A 36 ARG HDy H 1 3.113 0.000 A 36 ARG HGx H 1 1.869 0.000 A 36 ARG HGy H 1 2.018 0.000 A 36 ARG CA C 13 52.728 0.000 A 36 ARG CB C 13 26.279 0.000 A 36 ARG CD C 13 40.844 0.000 A 36 ARG CG C 13 28.146 0.000 A 36 ARG N N 15 123.980 0.000 A 37 ILE H H 1 8.084 0.000 A 37 ILE HA H 1 4.211 0.000 A 37 ILE HB H 1 1.437 0.000 A 37 ILE HD1% H 1 0.653 0.000 A 37 ILE HG1y H 1 1.344 0.000 A 37 ILE HG1x H 1 0.656 0.000 A 37 ILE HG2% H 1 0.764 0.000 A 37 ILE CA C 13 58.579 0.000 A 37 ILE CB C 13 36.026 0.000 A 37 ILE CD1 C 13 11.438 0.000 A 37 ILE CG1 C 13 26.477 0.000 A 37 ILE CG2 C 13 14.290 0.000 A 37 ILE N N 15 128.014 0.000 A 38 ARG H H 1 8.662 0.000 A 38 ARG HA H 1 3.845 0.000 A 38 ARG HBx H 1 1.038 0.000 A 38 ARG HBy H 1 1.543 0.000 A 38 ARG HDx H 1 3.157 0.000 A 38 ARG HDy H 1 3.157 0.000 A 38 ARG HGx H 1 1.443 0.000 A 38 ARG HGy H 1 1.443 0.000 A 38 ARG CA C 13 54.767 0.000 A 38 ARG CB C 13 27.829 0.000 A 38 ARG CD C 13 41.041 0.000 A 38 ARG CG C 13 24.246 0.000 A 38 ARG N N 15 133.264 0.000 A 39 ASN H H 1 8.992 0.000 A 39 ASN HA H 1 4.182 0.000 A 39 ASN HBx H 1 2.806 0.000 A 39 ASN HBy H 1 2.864 0.000 A 39 ASN HD2y H 1 7.689 0.000 A 39 ASN HD2x H 1 6.877 0.000 A 39 ASN CA C 13 51.702 0.000 A 39 ASN CB C 13 34.846 0.000 A 39 ASN N N 15 117.723 0.000 A 39 ASN ND2 N 15 115.141 0.000 A 40 GLY H H 1 7.949 0.000 A 40 GLY HAy H 1 3.769 0.000 A 40 GLY HAx H 1 3.390 0.000 A 40 GLY CA C 13 44.283 0.000 A 40 GLY N N 15 108.314 0.000 A 41 GLU H H 1 9.235 0.000 A 41 GLU HA H 1 3.812 0.000 A 41 GLU HBx H 1 2.020 0.000 A 41 GLU HBy H 1 2.020 0.000 A 41 GLU HGx H 1 2.177 0.000 A 41 GLU HGy H 1 2.177 0.000 A 41 GLU CA C 13 56.741 0.000 A 41 GLU CB C 13 26.718 0.000 A 41 GLU CG C 13 33.621 0.000 A 41 GLU N N 15 124.398 0.000 A 42 ASN H H 1 7.523 0.000 A 42 ASN HA H 1 4.507 0.000 A 42 ASN HBx H 1 2.680 0.000 A 42 ASN HBy H 1 2.822 0.000 A 42 ASN HD2y H 1 7.601 0.000 A 42 ASN HD2x H 1 7.060 0.000 A 42 ASN CA C 13 51.901 0.000 A 42 ASN CB C 13 36.065 0.000 A 42 ASN N N 15 113.155 0.000 A 42 ASN ND2 N 15 113.782 0.000 A 43 GLY H H 1 8.131 0.000 A 43 GLY HAx H 1 4.057 0.000 A 43 GLY HAy H 1 4.204 0.000 A 43 GLY CA C 13 42.561 0.000 A 43 GLY N N 15 109.898 0.000 A 44 ILE H H 1 6.715 0.000 A 44 ILE HA H 1 3.777 0.000 A 44 ILE HB H 1 1.706 0.000 A 44 ILE HD1% H 1 0.766 0.000 A 44 ILE HG1x H 1 0.511 0.000 A 44 ILE HG1y H 1 1.527 0.000 A 44 ILE HG2% H 1 0.124 0.000 A 44 ILE CA C 13 58.280 0.000 A 44 ILE CB C 13 36.145 0.000 A 44 ILE CD1 C 13 12.534 0.000 A 44 ILE CG1 C 13 25.622 0.000 A 44 ILE CG2 C 13 14.784 0.000 A 44 ILE N N 15 119.116 0.000 A 45 HIS H H 1 8.493 0.000 A 45 HIS HA H 1 4.883 0.000 A 45 HIS HBy H 1 3.306 0.000 A 45 HIS HBx H 1 2.960 0.000 A 45 HIS HD1 H 1 8.995 0.000 A 45 HIS HD2 H 1 6.686 0.000 A 45 HIS CA C 13 49.681 0.000 A 45 HIS CB C 13 25.934 0.000 A 45 HIS CD2 C 13 116.057 0.000 A 45 HIS N N 15 124.064 0.000 A 46 PHE H H 1 9.014 0.000 A 46 PHE HA H 1 4.563 0.000 A 46 PHE HBx H 1 2.849 0.000 A 46 PHE HBy H 1 2.987 0.000 A 46 PHE HDx H 1 7.174 0.000 A 46 PHE HDy H 1 7.174 0.000 A 46 PHE HEx H 1 7.003 0.000 A 46 PHE CA C 13 57.122 0.000 A 46 PHE CB C 13 36.299 0.000 A 46 PHE CDx C 13 126.420 0.000 A 46 PHE CDy C 13 126.423 0.000 A 46 PHE CEx C 13 127.330 0.000 A 46 PHE CEy C 13 127.334 0.000 A 46 PHE N N 15 123.886 0.000 A 47 LEU H H 1 8.066 0.000 A 47 LEU HA H 1 4.504 0.000 A 47 LEU HBy H 1 1.787 0.000 A 47 LEU HBx H 1 1.377 0.000 A 47 LEU HDx% H 1 0.751 0.000 A 47 LEU HDy% H 1 0.751 0.000 A 47 LEU HG H 1 1.597 0.000 A 47 LEU CA C 13 51.885 0.000 A 47 LEU CB C 13 38.896 0.000 A 47 LEU CDy C 13 20.270 0.000 A 47 LEU CDx C 13 20.258 0.000 A 47 LEU CG C 13 25.078 0.000 A 47 LEU N N 15 124.343 0.000 A 48 LEU H H 1 8.754 0.000 A 48 LEU HA H 1 4.825 0.000 A 48 LEU HBy H 1 1.718 0.000 A 48 LEU HBx H 1 1.217 0.000 A 48 LEU HDx% H 1 0.599 0.000 A 48 LEU HDy% H 1 0.832 0.000 A 48 LEU HG H 1 1.646 0.000 A 48 LEU CA C 13 50.930 0.000 A 48 LEU CB C 13 41.655 0.000 A 48 LEU CDx C 13 20.088 0.000 A 48 LEU CDy C 13 22.732 0.000 A 48 LEU CG C 13 24.453 0.000 A 48 LEU N N 15 122.809 0.000 A 49 ASN H H 1 8.757 0.000 A 49 ASN HA H 1 4.791 0.000 A 49 ASN HBy H 1 3.296 0.000 A 49 ASN HBx H 1 2.784 0.000 A 49 ASN HD2x H 1 6.983 0.000 A 49 ASN HD2y H 1 7.618 0.000 A 49 ASN CA C 13 48.595 0.000 A 49 ASN CB C 13 36.735 0.000 A 49 ASN N N 15 119.420 0.000 A 49 ASN ND2 N 15 112.225 0.000 A 50 ARG H H 1 8.618 0.000 A 50 ARG HA H 1 4.026 0.000 A 50 ARG HBx H 1 1.796 0.000 A 50 ARG HBy H 1 1.796 0.000 A 50 ARG HDx H 1 3.127 0.000 A 50 ARG HDy H 1 3.127 0.000 A 50 ARG HGx H 1 1.602 0.000 A 50 ARG HGy H 1 1.602 0.000 A 50 ARG CA C 13 55.918 0.000 A 50 ARG CB C 13 27.194 0.000 A 50 ARG CD C 13 40.846 0.000 A 50 ARG CG C 13 24.384 0.000 A 50 ARG N N 15 119.367 0.000 A 51 ASP H H 1 7.577 0.000 A 51 ASP HA H 1 4.585 0.000 A 51 ASP HBy H 1 2.699 0.000 A 51 ASP HBx H 1 2.617 0.000 A 51 ASP CA C 13 51.280 0.000 A 51 ASP CB C 13 38.544 0.000 A 51 ASP N N 15 116.650 0.000 A 52 GLY H H 1 8.171 0.000 A 52 GLY HAx H 1 3.585 0.000 A 52 GLY HAy H 1 4.123 0.000 A 52 GLY CA C 13 43.341 0.000 A 52 GLY N N 15 107.719 0.000 A 53 LYS H H 1 7.750 0.000 A 53 LYS HA H 1 4.419 0.000 A 53 LYS HBx H 1 1.602 0.000 A 53 LYS HBy H 1 1.602 0.000 A 53 LYS HDy H 1 1.607 0.000 A 53 LYS HDx H 1 1.519 0.000 A 53 LYS HEx H 1 2.752 0.000 A 53 LYS HEy H 1 2.830 0.000 A 53 LYS HGy H 1 1.272 0.000 A 53 LYS HGx H 1 1.185 0.000 A 53 LYS CA C 13 51.788 0.000 A 53 LYS CB C 13 30.976 0.000 A 53 LYS CD C 13 26.177 0.000 A 53 LYS CE C 13 39.756 0.000 A 53 LYS CG C 13 22.564 0.000 A 53 LYS N N 15 119.174 0.000 A 54 ARG H H 1 8.570 0.000 A 54 ARG HA H 1 4.169 0.000 A 54 ARG HBx H 1 1.660 0.000 A 54 ARG HBy H 1 1.660 0.000 A 54 ARG HDx H 1 2.699 0.000 A 54 ARG HDy H 1 2.699 0.000 A 54 ARG HGy H 1 1.717 0.000 A 54 ARG HGx H 1 1.389 0.000 A 54 ARG CA C 13 54.949 0.000 A 54 ARG CB C 13 28.054 0.000 A 54 ARG CD C 13 41.097 0.000 A 54 ARG CG C 13 25.080 0.000 A 54 ARG N N 15 121.126 0.000 A 55 ARG H H 1 8.352 0.000 A 55 ARG HA H 1 4.041 0.000 A 55 ARG HBy H 1 1.716 0.000 A 55 ARG HBx H 1 1.636 0.000 A 55 ARG HDy H 1 2.776 0.000 A 55 ARG HDx H 1 2.531 0.000 A 55 ARG HGx H 1 1.379 0.000 A 55 ARG HGy H 1 1.379 0.000 A 55 ARG CA C 13 53.172 0.000 A 55 ARG CB C 13 29.692 0.000 A 55 ARG CD C 13 41.230 0.000 A 55 ARG CG C 13 24.388 0.000 A 55 ARG N N 15 121.856 0.000 A 56 GLY H H 1 8.683 0.000 A 56 GLY HAx H 1 3.835 0.000 A 56 GLY HAy H 1 4.413 0.000 A 56 GLY CA C 13 43.461 0.000 A 56 GLY N N 15 108.554 0.000 A 57 ASP H H 1 8.018 0.000 A 57 ASP HA H 1 5.757 0.000 A 57 ASP HBx H 1 2.546 0.000 A 57 ASP HBy H 1 2.712 0.000 A 57 ASP CA C 13 49.244 0.000 A 57 ASP CB C 13 41.265 0.000 A 57 ASP N N 15 117.136 0.000 A 58 ALA H H 1 9.137 0.000 A 58 ALA HA H 1 5.105 0.000 A 58 ALA HB% H 1 0.745 0.000 A 58 ALA CA C 13 48.358 0.000 A 58 ALA CB C 13 19.444 0.000 A 58 ALA N N 15 122.425 0.000 A 59 LEU H H 1 8.604 0.000 A 59 LEU HA H 1 5.247 0.000 A 59 LEU HBy H 1 1.549 0.000 A 59 LEU HBx H 1 1.348 0.000 A 59 LEU HDx% H 1 0.778 0.000 A 59 LEU HDy% H 1 0.778 0.000 A 59 LEU CA C 13 50.358 0.000 A 59 LEU CB C 13 42.166 0.000 A 59 LEU CDy C 13 21.495 0.000 A 59 LEU CG C 13 25.595 0.000 A 59 LEU N N 15 121.454 0.000 A 60 ILE H H 1 9.081 0.000 A 60 ILE HA H 1 4.838 0.000 A 60 ILE HB H 1 1.236 0.000 A 60 ILE HD1% H 1 0.410 0.000 A 60 ILE HG1x H 1 0.581 0.000 A 60 ILE HG1y H 1 0.581 0.000 A 60 ILE HG2% H 1 0.456 0.000 A 60 ILE CA C 13 57.384 0.000 A 60 ILE CB C 13 38.147 0.000 A 60 ILE CD1 C 13 12.744 0.000 A 60 ILE CG1 C 13 25.561 0.000 A 60 ILE CG2 C 13 17.198 0.000 A 60 ILE N N 15 123.974 0.000 A 61 GLU H H 1 8.832 0.000 A 61 GLU HA H 1 4.545 0.000 A 61 GLU HBx H 1 1.975 0.000 A 61 GLU HBy H 1 2.148 0.000 A 61 GLU HGy H 1 2.248 0.000 A 61 GLU HGx H 1 2.127 0.000 A 61 GLU CA C 13 52.464 0.000 A 61 GLU CB C 13 29.517 0.000 A 61 GLU CG C 13 34.679 0.000 A 61 GLU N N 15 126.177 0.000 A 62 MET H H 1 8.854 0.000 A 62 MET HA H 1 5.131 0.000 A 62 MET HBx H 1 2.131 0.000 A 62 MET HBy H 1 2.283 0.000 A 62 MET HE% H 1 1.316 0.000 A 62 MET HGx H 1 1.872 0.000 A 62 MET CA C 13 49.938 0.000 A 62 MET CB C 13 30.874 0.000 A 62 MET CE C 13 15.284 0.000 A 62 MET CG C 13 31.268 0.000 A 62 MET N N 15 121.191 0.000 A 63 GLU H H 1 8.092 0.000 A 63 GLU HA H 1 4.071 0.000 A 63 GLU HBy H 1 2.017 0.000 A 63 GLU HBx H 1 1.855 0.000 A 63 GLU HGy H 1 2.077 0.000 A 63 GLU HGx H 1 1.954 0.000 A 63 GLU CA C 13 57.155 0.000 A 63 GLU CB C 13 28.080 0.000 A 63 GLU CG C 13 34.014 0.000 A 63 GLU N N 15 117.598 0.000 A 64 SER H H 1 7.710 0.000 A 64 SER HA H 1 4.113 0.000 A 64 SER HBy H 1 3.871 0.000 A 64 SER HBx H 1 3.698 0.000 A 64 SER CA C 13 54.607 0.000 A 64 SER CB C 13 65.273 0.000 A 64 SER N N 15 109.627 0.000 A 65 GLU H H 1 8.364 0.000 A 65 GLU HA H 1 3.485 0.000 A 65 GLU HBy H 1 1.857 0.000 A 65 GLU HBx H 1 1.728 0.000 A 65 GLU HGx H 1 2.140 0.000 A 65 GLU HGy H 1 2.140 0.000 A 65 GLU CA C 13 56.100 0.000 A 65 GLU CB C 13 26.282 0.000 A 65 GLU CG C 13 32.867 0.000 A 65 GLU N N 15 121.394 0.000 A 66 GLN H H 1 7.979 0.000 A 66 GLN HA H 1 3.902 0.000 A 66 GLN HBy H 1 1.936 0.000 A 66 GLN HBx H 1 1.825 0.000 A 66 GLN HE2y H 1 7.492 0.000 A 66 GLN HE2x H 1 6.800 0.000 A 66 GLN HGy H 1 2.290 0.000 A 66 GLN HGx H 1 2.241 0.000 A 66 GLN CA C 13 56.438 0.000 A 66 GLN CB C 13 25.394 0.000 A 66 GLN CG C 13 31.878 0.000 A 66 GLN N N 15 118.987 0.000 A 66 GLN NE2 N 15 112.312 0.000 A 67 ASP H H 1 7.325 0.000 A 67 ASP HA H 1 4.334 0.000 A 67 ASP HBx H 1 2.709 0.000 A 67 ASP HBy H 1 2.709 0.000 A 67 ASP CA C 13 55.727 0.000 A 67 ASP CB C 13 41.607 0.000 A 67 ASP N N 15 118.539 0.000 A 68 VAL H H 1 7.165 0.000 A 68 VAL HA H 1 3.175 0.000 A 68 VAL HB H 1 2.319 0.000 A 68 VAL HGx% H 1 0.874 0.000 A 68 VAL HGy% H 1 0.779 0.000 A 68 VAL CA C 13 64.830 0.000 A 68 VAL CB C 13 28.834 0.000 A 68 VAL CGy C 13 21.056 0.000 A 68 VAL CGx C 13 18.026 0.000 A 68 VAL N N 15 119.502 0.000 A 69 GLN H H 1 7.718 0.000 A 69 GLN HA H 1 3.734 0.000 A 69 GLN HBx H 1 2.008 0.000 A 69 GLN HBy H 1 2.059 0.000 A 69 GLN HE2x H 1 6.776 0.000 A 69 GLN HE2y H 1 7.468 0.000 A 69 GLN HGy H 1 2.387 0.000 A 69 GLN HGx H 1 2.349 0.000 A 69 GLN CA C 13 56.404 0.000 A 69 GLN CB C 13 25.212 0.000 A 69 GLN CG C 13 31.239 0.000 A 69 GLN N N 15 115.899 0.000 A 69 GLN NE2 N 15 113.265 0.000 A 70 LYS H H 1 7.767 0.000 A 70 LYS HA H 1 3.928 0.000 A 70 LYS HBx H 1 1.764 0.000 A 70 LYS HBy H 1 1.764 0.000 A 70 LYS HDy H 1 1.606 0.000 A 70 LYS HDx H 1 1.523 0.000 A 70 LYS HEx H 1 2.753 0.000 A 70 LYS HEy H 1 2.829 0.000 A 70 LYS HGy H 1 1.464 0.000 A 70 LYS HGx H 1 1.366 0.000 A 70 LYS CA C 13 55.937 0.000 A 70 LYS CB C 13 29.946 0.000 A 70 LYS CD C 13 26.281 0.000 A 70 LYS CE C 13 39.686 0.000 A 70 LYS CG C 13 23.026 0.000 A 70 LYS N N 15 118.403 0.000 A 71 ALA H H 1 8.160 0.000 A 71 ALA HA H 1 4.027 0.000 A 71 ALA HB% H 1 1.365 0.000 A 71 ALA CA C 13 52.743 0.000 A 71 ALA CB C 13 16.114 0.000 A 71 ALA N N 15 124.650 0.000 A 72 LEU H H 1 8.055 0.000 A 72 LEU HA H 1 3.794 0.000 A 72 LEU HBx H 1 1.411 0.000 A 72 LEU HBy H 1 1.833 0.000 A 72 LEU HDx% H 1 0.656 0.000 A 72 LEU HDy% H 1 0.781 0.000 A 72 LEU HG H 1 1.811 0.000 A 72 LEU CA C 13 54.664 0.000 A 72 LEU CB C 13 38.833 0.000 A 72 LEU CDx C 13 20.041 0.000 A 72 LEU CDy C 13 23.495 0.000 A 72 LEU CG C 13 24.165 0.000 A 72 LEU N N 15 116.557 0.000 A 73 GLU H H 1 7.369 0.000 A 73 GLU HA H 1 4.090 0.000 A 73 GLU HBx H 1 2.085 0.000 A 73 GLU HBy H 1 2.085 0.000 A 73 GLU HGx H 1 2.240 0.000 A 73 GLU HGy H 1 2.581 0.000 A 73 GLU CA C 13 55.462 0.000 A 73 GLU CB C 13 26.806 0.000 A 73 GLU CG C 13 33.996 0.000 A 73 GLU N N 15 117.807 0.000 A 74 LYS H H 1 7.805 0.000 A 74 LYS HA H 1 4.192 0.000 A 74 LYS HBx H 1 1.744 0.000 A 74 LYS HBy H 1 1.859 0.000 A 74 LYS HDx H 1 1.142 0.000 A 74 LYS HDy H 1 1.142 0.000 A 74 LYS HEx H 1 2.601 0.000 A 74 LYS HEy H 1 2.601 0.000 A 74 LYS HGx H 1 1.007 0.000 A 74 LYS HGy H 1 1.312 0.000 A 74 LYS CA C 13 51.741 0.000 A 74 LYS CB C 13 28.464 0.000 A 74 LYS CD C 13 24.866 0.000 A 74 LYS CE C 13 39.743 0.000 A 74 LYS CG C 13 21.902 0.000 A 74 LYS N N 15 116.715 0.000 A 75 HIS H H 1 7.184 0.000 A 75 HIS HA H 1 4.328 0.000 A 75 HIS HBy H 1 3.114 0.000 A 75 HIS HBx H 1 3.019 0.000 A 75 HIS HD2 H 1 6.896 0.000 A 75 HIS CA C 13 55.811 0.000 A 75 HIS CB C 13 29.583 0.000 A 75 HIS CD2 C 13 112.793 0.000 A 75 HIS N N 15 117.177 0.000 A 76 ARG H H 1 9.042 0.000 A 76 ARG HA H 1 4.306 0.000 A 76 ARG HBx H 1 1.741 0.000 A 76 ARG HBy H 1 1.741 0.000 A 76 ARG CA C 13 55.719 0.000 A 76 ARG CB C 13 33.288 0.000 A 76 ARG CD C 13 39.655 0.000 A 76 ARG CG C 13 26.299 0.000 A 76 ARG N N 15 121.753 0.000 A 77 MET H H 1 7.835 0.000 A 77 MET HA H 1 4.598 0.000 A 77 MET HBy H 1 2.521 0.000 A 77 MET HBx H 1 2.377 0.000 A 77 MET HE% H 1 2.045 0.000 A 77 MET HGx H 1 2.157 0.000 A 77 MET HGy H 1 2.157 0.000 A 77 MET CA C 13 52.590 0.000 A 77 MET CB C 13 31.234 0.000 A 77 MET CE C 13 15.207 0.000 A 77 MET N N 15 117.206 0.000 A 78 TYR H H 1 8.359 0.000 A 78 TYR HA H 1 4.602 0.000 A 78 TYR HBy H 1 2.741 0.000 A 78 TYR HBx H 1 2.671 0.000 A 78 TYR HDx H 1 6.749 0.000 A 78 TYR HDy H 1 6.749 0.000 A 78 TYR HEx H 1 6.601 0.000 A 78 TYR HEy H 1 6.601 0.000 A 78 TYR CA C 13 56.028 0.000 A 78 TYR CB C 13 37.334 0.000 A 78 TYR CDy C 13 127.970 0.000 A 78 TYR CDx C 13 127.966 0.000 A 78 TYR CEx C 13 113.250 0.000 A 78 TYR CEy C 13 113.253 0.000 A 78 TYR N N 15 117.960 0.000 A 79 MET H H 1 8.642 0.000 A 79 MET HA H 1 4.325 0.000 A 79 MET HBy H 1 1.570 0.000 A 79 MET HBx H 1 1.213 0.000 A 79 MET HE% H 1 1.542 0.000 A 79 MET HGx H 1 1.968 0.000 A 79 MET HGy H 1 2.158 0.000 A 79 MET CA C 13 52.338 0.000 A 79 MET CB C 13 31.907 0.000 A 79 MET CE C 13 14.307 0.000 A 79 MET CG C 13 29.238 0.000 A 79 MET N N 15 124.673 0.000 A 80 GLY H H 1 8.709 0.000 A 80 GLY HAx H 1 3.534 0.000 A 80 GLY HAy H 1 3.858 0.000 A 80 GLY CA C 13 44.426 0.000 A 80 GLY N N 15 115.191 0.000 A 81 GLN H H 1 8.598 0.000 A 81 GLN HA H 1 4.147 0.000 A 81 GLN HBy H 1 2.209 0.000 A 81 GLN HBx H 1 1.888 0.000 A 81 GLN HE2y H 1 7.459 0.000 A 81 GLN HE2x H 1 6.759 0.000 A 81 GLN HGx H 1 2.243 0.000 A 81 GLN HGy H 1 2.243 0.000 A 81 GLN CA C 13 53.557 0.000 A 81 GLN CB C 13 26.736 0.000 A 81 GLN CG C 13 31.902 0.000 A 81 GLN N N 15 121.981 0.000 A 81 GLN NE2 N 15 112.312 0.000 A 82 ARG H H 1 7.660 0.000 A 82 ARG HA H 1 4.500 0.000 A 82 ARG HBy H 1 1.888 0.000 A 82 ARG HBx H 1 1.714 0.000 A 82 ARG HDx H 1 3.036 0.000 A 82 ARG HDy H 1 3.036 0.000 A 82 ARG HGy H 1 1.521 0.000 A 82 ARG HGx H 1 1.417 0.000 A 82 ARG CA C 13 51.593 0.000 A 82 ARG CB C 13 29.507 0.000 A 82 ARG CD C 13 40.226 0.000 A 82 ARG CG C 13 24.137 0.000 A 82 ARG N N 15 118.652 0.000 A 84 VAL H H 1 8.222 0.000 A 84 VAL HA H 1 4.318 0.000 A 84 VAL HB H 1 1.773 0.000 A 84 VAL HGx% H 1 0.350 0.000 A 84 VAL HGy% H 1 0.564 0.000 A 84 VAL CA C 13 58.647 0.000 A 84 VAL CB C 13 31.015 0.000 A 84 VAL CGy C 13 19.598 0.000 A 84 VAL CGx C 13 18.564 0.000 A 84 VAL N N 15 125.216 0.000 A 86 VAL HA H 1 4.807 0.000 A 86 VAL HB H 1 1.727 0.000 A 86 VAL HGx% H 1 0.804 0.000 A 86 VAL HGy% H 1 1.012 0.000 A 86 VAL CA C 13 58.928 0.000 A 86 VAL CB C 13 33.201 0.000 A 86 VAL CGy C 13 20.046 0.000 A 86 VAL CGx C 13 18.852 0.000 A 86 VAL N N 15 120.000 0.000 A 87 TYR H H 1 8.731 0.000 A 87 TYR HA H 1 4.624 0.000 A 87 TYR HBx H 1 2.393 0.000 A 87 TYR HBy H 1 3.065 0.000 A 87 TYR HDx H 1 6.833 0.000 A 87 TYR HDy H 1 6.833 0.000 A 87 TYR HEx H 1 6.609 0.000 A 87 TYR HEy H 1 6.609 0.000 A 87 TYR CA C 13 53.444 0.000 A 87 TYR CB C 13 40.105 0.000 A 87 TYR CDx C 13 128.566 0.000 A 87 TYR CDy C 13 128.570 0.000 A 87 TYR CEx C 13 113.280 0.000 A 87 TYR CEy C 13 113.280 0.000 A 87 TYR N N 15 120.377 0.000 A 88 GLU H H 1 8.873 0.000 A 88 GLU HA H 1 4.350 0.000 A 88 GLU HBy H 1 1.964 0.000 A 88 GLU HBx H 1 1.876 0.000 A 88 GLU CA C 13 53.640 0.000 A 88 GLU CB C 13 28.430 0.000 A 88 GLU N N 15 122.304 0.000 A 89 ILE H H 1 7.983 0.000 A 89 ILE HA H 1 4.258 0.000 A 89 ILE HB H 1 1.773 0.000 A 89 ILE HD1% H 1 0.575 0.000 A 89 ILE HG1y H 1 1.110 0.000 A 89 ILE HG1x H 1 1.077 0.000 A 89 ILE HG2% H 1 0.750 0.000 A 89 ILE CA C 13 55.831 0.000 A 89 ILE CB C 13 34.985 0.000 A 89 ILE CD1 C 13 9.035 0.000 A 89 ILE CG1 C 13 24.387 0.000 A 89 ILE CG2 C 13 15.056 0.000 A 89 ILE N N 15 125.082 0.000 A 90 ASN H H 1 8.890 0.000 A 90 ASN HA H 1 4.591 0.000 A 90 ASN HBx H 1 2.745 0.000 A 90 ASN HBy H 1 2.792 0.000 A 90 ASN HD2y H 1 7.637 0.000 A 90 ASN HD2x H 1 6.877 0.000 A 90 ASN CA C 13 50.615 0.000 A 90 ASN CB C 13 36.638 0.000 A 90 ASN N N 15 126.142 0.000 A 90 ASN ND2 N 15 113.010 0.000 A 91 ASN H H 1 8.867 0.000 A 91 ASN HA H 1 4.296 0.000 A 91 ASN HBy H 1 2.754 0.000 A 91 ASN HBx H 1 2.673 0.000 A 91 ASN HD2x H 1 6.906 0.000 A 91 ASN HD2y H 1 7.627 0.000 A 91 ASN CA C 13 53.950 0.000 A 91 ASN CB C 13 36.305 0.000 A 91 ASN N N 15 121.333 0.000 A 91 ASN ND2 N 15 112.961 0.000 A 92 GLU H H 1 8.869 0.000 A 92 GLU HA H 1 4.092 0.000 A 92 GLU HBx H 1 1.879 0.000 A 92 GLU HBy H 1 1.951 0.000 A 92 GLU HGy H 1 2.219 0.000 A 92 GLU HGx H 1 2.166 0.000 A 92 GLU CA C 13 55.551 0.000 A 92 GLU CB C 13 26.767 0.000 A 92 GLU CG C 13 33.883 0.000 A 92 GLU N N 15 117.848 0.000 A 93 ASP H H 1 7.965 0.000 A 93 ASP HA H 1 4.652 0.000 A 93 ASP HBy H 1 2.678 0.000 A 93 ASP HBx H 1 2.598 0.000 A 93 ASP CA C 13 52.137 0.000 A 93 ASP CB C 13 39.522 0.000 A 93 ASP N N 15 118.819 0.000 A 94 VAL H H 1 7.406 0.000 A 94 VAL HA H 1 3.274 0.000 A 94 VAL HB H 1 1.968 0.000 A 94 VAL HGx% H 1 0.753 0.000 A 94 VAL HGy% H 1 0.753 0.000 A 94 VAL CA C 13 64.179 0.000 A 94 VAL CB C 13 29.477 0.000 A 94 VAL CGy C 13 18.867 0.000 A 94 VAL CGx C 13 15.071 0.000 A 94 VAL N N 15 120.480 0.000 A 95 ASP H H 1 8.342 0.000 A 95 ASP HA H 1 4.155 0.000 A 95 ASP HBy H 1 2.574 0.000 A 95 ASP HBx H 1 2.482 0.000 A 95 ASP CA C 13 55.216 0.000 A 95 ASP CB C 13 38.627 0.000 A 95 ASP N N 15 119.806 0.000 A 96 ALA H H 1 8.162 0.000 A 96 ALA HA H 1 3.926 0.000 A 96 ALA HB% H 1 1.342 0.000 A 96 ALA CA C 13 52.140 0.000 A 96 ALA CB C 13 15.676 0.000 A 96 ALA N N 15 119.946 0.000 A 97 LEU H H 1 7.679 0.000 A 97 LEU HA H 1 3.985 0.000 A 97 LEU HBx H 1 1.307 0.000 A 97 LEU HBy H 1 1.647 0.000 A 97 LEU HDx% H 1 0.726 0.000 A 97 LEU HDy% H 1 0.710 0.000 A 97 LEU HG H 1 1.575 0.000 A 97 LEU CA C 13 54.831 0.000 A 97 LEU CB C 13 39.438 0.000 A 97 LEU CDy C 13 22.864 0.000 A 97 LEU CDx C 13 21.374 0.000 A 97 LEU CG C 13 24.399 0.000 A 97 LEU N N 15 119.391 0.000 A 98 MET H H 1 8.504 0.000 A 98 MET HA H 1 4.128 0.000 A 98 MET HBy H 1 2.082 0.000 A 98 MET HBx H 1 1.860 0.000 A 98 MET HE% H 1 1.737 0.000 A 98 MET HGy H 1 2.532 0.000 A 98 MET HGx H 1 2.437 0.000 A 98 MET CA C 13 54.606 0.000 A 98 MET CB C 13 27.902 0.000 A 98 MET CE C 13 13.700 0.000 A 98 MET CG C 13 29.861 0.000 A 98 MET N N 15 118.055 0.000 A 99 LYS H H 1 7.986 0.000 A 99 LYS HA H 1 3.971 0.000 A 99 LYS HBx H 1 1.760 0.000 A 99 LYS HBy H 1 1.760 0.000 A 99 LYS HDx H 1 1.523 0.000 A 99 LYS HDy H 1 1.606 0.000 A 99 LYS HEx H 1 2.851 0.000 A 99 LYS HEy H 1 2.851 0.000 A 99 LYS HGy H 1 1.469 0.000 A 99 LYS HGx H 1 1.337 0.000 A 99 LYS CA C 13 56.301 0.000 A 99 LYS CB C 13 29.692 0.000 A 99 LYS CD C 13 26.446 0.000 A 99 LYS CE C 13 39.657 0.000 A 99 LYS CG C 13 23.267 0.000 A 99 LYS N N 15 119.351 0.000 A 100 SER H H 1 7.711 0.000 A 100 SER HA H 1 4.268 0.000 A 100 SER HBx H 1 3.924 0.000 A 100 SER HBy H 1 3.924 0.000 A 100 SER CA C 13 57.764 0.000 A 100 SER CB C 13 60.753 0.000 A 100 SER N N 15 114.964 0.000 A 101 LEU H H 1 7.405 0.000 A 101 LEU HA H 1 4.160 0.000 A 101 LEU HBy H 1 1.657 0.000 A 101 LEU HBx H 1 1.300 0.000 A 101 LEU HDx% H 1 0.470 0.000 A 101 LEU HDy% H 1 0.602 0.000 A 101 LEU HG H 1 1.705 0.000 A 101 LEU CA C 13 52.893 0.000 A 101 LEU CB C 13 39.541 0.000 A 101 LEU CDy C 13 22.687 0.000 A 101 LEU CDx C 13 20.186 0.000 A 101 LEU CG C 13 23.495 0.000 A 101 LEU N N 15 120.679 0.000 A 102 GLN H H 1 7.588 0.000 A 102 GLN HA H 1 4.195 0.000 A 102 GLN HBy H 1 2.062 0.000 A 102 GLN HBx H 1 1.975 0.000 A 102 GLN HE2y H 1 7.403 0.000 A 102 GLN HE2x H 1 6.799 0.000 A 102 GLN HGx H 1 2.291 0.000 A 102 GLN HGy H 1 2.351 0.000 A 102 GLN CA C 13 53.360 0.000 A 102 GLN CB C 13 26.480 0.000 A 102 GLN CG C 13 31.394 0.000 A 102 GLN N N 15 117.646 0.000 A 102 GLN NE2 N 15 111.860 0.000 A 103 VAL H H 1 7.839 0.000 A 103 VAL HA H 1 4.015 0.000 A 103 VAL HB H 1 1.993 0.000 A 103 VAL HGx% H 1 0.875 0.000 A 103 VAL HGy% H 1 0.838 0.000 A 103 VAL CA C 13 59.755 0.000 A 103 VAL CB C 13 30.579 0.000 A 103 VAL CGx C 13 18.398 0.000 A 103 VAL CGy C 13 18.701 0.000 A 103 VAL N N 15 120.269 0.000 A 104 LYS H H 1 8.364 0.000 A 104 LYS HA H 1 4.343 0.000 A 104 LYS HBy H 1 1.785 0.000 A 104 LYS HBx H 1 1.680 0.000 A 104 LYS HDx H 1 1.618 0.000 A 104 LYS HDy H 1 1.618 0.000 A 104 LYS HEy H 1 2.930 0.000 A 104 LYS HEx H 1 2.905 0.000 A 104 LYS HGy H 1 1.362 0.000 A 104 LYS CA C 13 53.348 0.000 A 104 LYS CB C 13 30.634 0.000 A 104 LYS CD C 13 26.569 0.000 A 104 LYS CE C 13 39.686 0.000 A 104 LYS CG C 13 22.169 0.000 A 104 LYS N N 15 125.201 0.000 A 105 SER H H 1 8.354 0.000 A 105 SER HA H 1 4.401 0.000 A 105 SER HBy H 1 3.795 0.000 A 105 SER HBx H 1 3.777 0.000 A 105 SER CA C 13 55.611 0.000 A 105 SER CB C 13 61.286 0.000 A 105 SER N N 15 117.664 0.000 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 38 ARG H A 61 GLU HBy 1.0 . 5.50 2 2 A 38 ARG H A 61 GLU HBx 1.0 . 4.78 3 3 A 38 ARG H A 38 ARG HBy 1.0 . 3.58 4 4 A 36 ARG H A 37 ILE H 1.0 . 4.18 5 5 A 37 ILE H A 36 ARG HA 1.0 . 2.83 6 6 A 37 ILE H A 37 ILE HB 1.0 . 3.01 7 7 A 37 ILE H A 62 MET HA 1.0 . 5.21 8 8 A 16 ALA H A 60 ILE HG1x 1.0 . 5.44 9 8 A 16 ALA H A 60 ILE HG1y 1.0 . 5.44 10 9 A 16 ALA H A 15 ARG HGy 1.0 . 4.17 11 10 A 16 ALA H A 59 LEU HDx% 1.0 . 4.40 12 10 A 16 ALA H A 59 LEU HDy% 1.0 . 4.40 13 11 A 16 ALA H A 60 ILE HD1% 1.0 . 5.50 14 12 A 16 ALA H A 17 GLN H 1.0 . 4.87 15 13 A 16 ALA H A 15 ARG HDx 1.0 . 5.50 16 13 A 16 ALA H A 15 ARG HDy 1.0 . 5.50 17 14 A 90 ASN H A 90 ASN HD2x 1.0 . 5.50 18 15 A 90 ASN H A 90 ASN HD2y 1.0 . 5.27 19 16 A 44 ILE HG1y A 61 GLU H 1.0 . 5.21 20 17 A 90 ASN H A 93 ASP H 1.0 . 4.28 21 18 A 90 ASN H A 89 ILE HA 1.0 . 2.88 22 19 A 90 ASN H A 90 ASN HBy 1.0 . 3.23 23 19 A 90 ASN H A 90 ASN HBx 1.0 . 3.23 24 20 A 90 ASN H A 89 ILE HG1x 1.0 . 5.50 25 21 A 61 GLU H A 60 ILE HG1x 1.0 . 4.88 26 21 A 60 ILE HG1y A 61 GLU H 1.0 . 4.88 27 22 A 61 GLU H A 44 ILE H 1.0 . 4.44 28 23 A 61 GLU H A 44 ILE HA 1.0 . 4.47 29 24 A 61 GLU H A 61 GLU HGx 1.0 . 3.52 30 25 A 61 GLU H A 60 ILE HB 1.0 . 4.82 31 26 A 12 PHE H A 12 PHE HD% 1.0 . 3.98 32 27 A 12 PHE H A 12 PHE HBx 1.0 . 3.60 33 27 A 12 PHE H A 12 PHE HBy 1.0 . 3.60 34 28 A 12 PHE H A 13 LEU HBy 1.0 . 5.20 35 29 A 104 LYS H A 104 LYS HBx 1.0 . 3.38 36 30 A 104 LYS H A 103 VAL HGy% 1.0 . 4.42 37 31 A 15 ARG H A 89 ILE H 1.0 . 4.89 38 32 A 89 ILE H A 88 GLU H 1.0 . 4.71 39 33 A 89 ILE H A 14 ILE HA 1.0 . 3.94 40 34 A 13 LEU HBy A 89 ILE H 1.0 . 4.97 41 35 A 89 ILE H A 89 ILE HG1y 1.0 . 3.87 42 36 A 89 ILE H A 89 ILE HG2% 1.0 . 4.55 43 37 A 79 MET H A 82 ARG H 1.0 . 4.40 44 38 A 79 MET H A 31 PHE HE% 1.0 . 5.50 45 39 A 79 MET H A 78 TYR HD% 1.0 . 5.29 46 40 A 79 MET H A 78 TYR HBy 1.0 . 4.19 47 41 A 79 MET H A 82 ARG HBx 1.0 . 5.50 48 42 A 14 ILE HD1% A 71 ALA H 1.0 . 5.50 49 43 A 71 ALA H A 68 VAL HA 1.0 . 4.13 50 44 A 71 ALA H A 68 VAL HGy% 1.0 . 5.48 51 45 A 71 ALA H A 72 LEU HDx% 1.0 . 5.50 52 46 A 44 ILE H A 41 GLU H 1.0 . 5.45 53 47 A 41 GLU H A 43 GLY H 1.0 . 4.66 54 48 A 41 GLU H A 40 GLY HAy 1.0 . 2.85 55 49 A 41 GLU H A 42 ASN HBx 1.0 . 5.03 56 50 A 41 GLU H A 41 GLU HBx 1.0 . 3.15 57 50 A 41 GLU H A 41 GLU HBy 1.0 . 3.15 58 51 A 21 TRP H A 21 TRP HBx 1.0 . 3.68 59 52 A 21 TRP H A 22 SER H 1.0 . 4.21 60 53 A 47 LEU H A 59 LEU H 1.0 . 4.97 61 54 A 47 LEU H A 46 PHE HA 1.0 . 3.26 62 55 A 47 LEU H A 46 PHE HBx 1.0 . 5.39 63 56 A 47 LEU H A 47 LEU HBy 1.0 . 4.04 64 57 A 47 LEU H A 46 PHE HD% 1.0 . 5.21 65 58 A 47 LEU H A 46 PHE HBy 1.0 . 4.61 66 59 A 21 TRP H A 20 PRO HA 1.0 . 3.02 67 60 A 21 TRP H A 20 PRO HGx 1.0 . 4.37 68 60 A 21 TRP H A 20 PRO HGy 1.0 . 4.37 69 61 A 9 ASP H A 9 ASP HBx 1.0 . 3.02 70 62 A 9 ASP H A 8 VAL HGy% 1.0 . 3.80 71 63 A 59 LEU HA A 60 ILE H 1.0 . 3.10 72 64 A 44 ILE HG1y A 45 HIS H 1.0 . 4.86 73 65 A 44 ILE H A 45 HIS H 1.0 . 4.62 74 66 A 44 ILE HA A 45 HIS H 1.0 . 3.05 75 67 A 45 HIS H A 45 HIS HBy 1.0 . 3.81 76 68 A 45 HIS H A 58 ALA HB% 1.0 . 4.40 77 69 A 60 ILE HB A 60 ILE H 1.0 . 3.56 78 70 A 60 ILE H A 59 LEU HDx% 1.0 . 4.23 79 70 A 59 LEU HDy% A 60 ILE H 1.0 . 4.23 80 71 A 60 ILE H A 60 ILE HG1x 1.0 . 5.00 81 71 A 60 ILE HG1y A 60 ILE H 1.0 . 5.00 82 72 A 47 LEU H A 46 PHE H 1.0 . 4.79 83 73 A 46 PHE HD% A 46 PHE H 1.0 . 4.03 84 74 A 46 PHE H A 45 HIS HA 1.0 . 2.92 85 75 A 46 PHE HBy A 46 PHE H 1.0 . 3.87 86 76 A 46 PHE HBx A 46 PHE H 1.0 . 3.33 87 77 A 46 PHE H A 47 LEU HDx% 1.0 . 5.50 88 77 A 46 PHE H A 47 LEU HDy% 1.0 . 5.50 89 78 A 46 PHE H A 44 ILE HG2% 1.0 . 5.25 90 79 A 89 ILE H A 13 LEU H 1.0 . 5.43 91 80 A 12 PHE HD% A 13 LEU H 1.0 . 4.90 92 81 A 13 LEU H A 12 PHE HA 1.0 . 3.02 93 82 A 13 LEU H A 12 PHE HBx 1.0 . 4.13 94 82 A 12 PHE HBy A 13 LEU H 1.0 . 4.13 95 83 A 13 LEU H A 89 ILE HB 1.0 . 5.25 96 84 A 13 LEU HBy A 13 LEU H 1.0 . 3.34 97 85 A 13 LEU H A 11 VAL HGx% 1.0 . 4.01 98 85 A 13 LEU H A 11 VAL HGy% 1.0 . 4.01 99 86 A 36 ARG H A 35 CYS HA 1.0 . 2.94 100 87 A 36 ARG H A 36 ARG HDx 1.0 . 4.58 101 87 A 36 ARG H A 36 ARG HDy 1.0 . 4.58 102 88 A 36 ARG H A 35 CYS HBx 1.0 . 3.59 103 89 A 36 ARG H A 36 ARG HBy 1.0 . 3.45 104 90 A 36 ARG H A 36 ARG HBx 1.0 . 3.49 105 91 A 36 ARG H A 37 ILE HD1% 1.0 . 5.50 106 92 A 30 ASN H A 31 PHE H 1.0 . 3.39 107 93 A 31 PHE H A 33 SER H 1.0 . 5.23 108 94 A 31 PHE H A 31 PHE HD% 1.0 . 4.40 109 95 A 31 PHE H A 27 ASP HA 1.0 . 4.89 110 96 A 31 PHE H A 29 LEU HA 1.0 . 5.03 111 97 A 31 PHE H A 28 VAL HA 1.0 . 3.88 112 98 A 31 PHE H A 31 PHE HBy 1.0 . 3.29 113 99 A 31 PHE H A 31 PHE HBx 1.0 . 3.20 114 100 A 4 LEU H A 2 SER HBx 1.0 . 4.81 115 100 A 2 SER HBy A 4 LEU H 1.0 . 4.81 116 101 A 4 LEU H A 4 LEU HBx 1.0 . 2.79 117 102 A 4 LEU H A 3 LYS H 1.0 . 3.22 118 103 A 4 LEU H A 5 GLU HGx 1.0 . 5.44 119 103 A 4 LEU H A 5 GLU HGy 1.0 . 5.44 120 104 A 3 LYS H A 2 SER H 1.0 . 4.80 121 105 A 3 LYS H A 2 SER HA 1.0 . 2.69 122 106 A 3 LYS H A 2 SER HBx 1.0 . 3.96 123 106 A 2 SER HBy A 3 LYS H 1.0 . 3.96 124 107 A 47 LEU H A 48 LEU H 1.0 . 4.95 125 108 A 48 LEU H A 47 LEU HBx 1.0 . 4.19 126 109 A 15 ARG H A 14 ILE H 1.0 . 5.06 127 110 A 15 ARG H A 15 ARG HDx 1.0 . 5.23 128 110 A 15 ARG HDy A 15 ARG H 1.0 . 5.23 129 111 A 15 ARG H A 14 ILE HB 1.0 . 3.56 130 112 A 57 ASP H A 58 ALA H 1.0 . 4.96 131 113 A 58 ALA H A 57 ASP HA 1.0 . 3.24 132 114 A 58 ALA H A 57 ASP HBy 1.0 . 4.03 133 115 A 58 ALA H A 57 ASP HBx 1.0 . 3.88 134 116 A 15 ARG HGy A 58 ALA H 1.0 . 5.11 135 117 A 88 GLU H A 87 TYR HBy 1.0 . 3.74 136 118 A 88 GLU H A 87 TYR HD% 1.0 . 4.41 137 119 A 88 GLU H A 87 TYR HBx 1.0 . 4.31 138 120 A 48 LEU HDy% A 55 ARG H 1.0 . 5.50 139 121 A 55 ARG H A 54 ARG HA 1.0 . 3.52 140 122 A 55 ARG H A 55 ARG HDy 1.0 . 5.16 141 123 A 55 ARG H A 55 ARG HGx 1.0 . 4.27 142 123 A 55 ARG H A 55 ARG HGy 1.0 . 4.27 143 124 A 55 ARG H A 48 LEU HA 1.0 . 4.28 144 125 A 7 GLU H A 8 VAL H 1.0 . 3.13 145 126 A 7 GLU H A 8 VAL HGx% 1.0 . 4.88 146 127 A 7 GLU H A 7 GLU HBx 1.0 . 2.95 147 128 A 59 LEU H A 58 ALA HA 1.0 . 3.19 148 129 A 59 LEU H A 45 HIS HBy 1.0 . 4.24 149 130 A 59 LEU H A 59 LEU HBy 1.0 . 3.62 150 131 A 59 LEU H A 59 LEU HDx% 1.0 . 3.67 151 131 A 59 LEU HDy% A 59 LEU H 1.0 . 3.67 152 132 A 91 ASN H A 91 ASN HD2x 1.0 . 5.50 153 133 A 65 GLU H A 66 GLN H 1.0 . 3.43 154 134 A 65 GLU H A 64 SER HBy 1.0 . 3.24 155 135 A 65 GLU H A 64 SER HBx 1.0 . 3.63 156 136 A 65 GLU H A 65 GLU HBy 1.0 . 3.67 157 137 A 65 GLU H A 65 GLU HBx 1.0 . 3.29 158 138 A 12 PHE HD% A 65 GLU H 1.0 . 4.88 159 139 A 65 GLU H A 64 SER HA 1.0 . 3.12 160 140 A 91 ASN H A 90 ASN HBy 1.0 . 3.02 161 140 A 90 ASN HBx A 91 ASN H 1.0 . 3.02 162 141 A 13 LEU HA A 62 MET H 1.0 . 4.00 163 142 A 62 MET H A 62 MET HBy 1.0 . 3.73 164 143 A 62 MET H A 62 MET HBx 1.0 . 3.83 165 144 A 54 ARG H A 54 ARG HGx 1.0 . 5.12 166 145 A 17 GLN H A 86 VAL HA 1.0 . 5.26 167 146 A 54 ARG H A 48 LEU HBx 1.0 . 5.19 168 147 A 55 ARG H A 54 ARG H 1.0 . 5.06 169 148 A 54 ARG H A 53 LYS HA 1.0 . 3.07 170 149 A 54 ARG H A 49 ASN HBx 1.0 . 4.82 171 150 A 54 ARG H A 54 ARG HDx 1.0 . 5.18 172 150 A 54 ARG H A 54 ARG HDy 1.0 . 5.18 173 151 A 10 ASP H A 11 VAL H 1.0 . 3.38 174 152 A 10 ASP H A 10 ASP HBy 1.0 . 2.99 175 153 A 10 ASP H A 11 VAL HGx% 1.0 . 4.37 176 153 A 11 VAL HGy% A 10 ASP H 1.0 . 4.37 177 154 A 28 VAL H A 29 LEU H 1.0 . 3.37 178 155 A 30 ASN H A 28 VAL H 1.0 . 5.07 179 156 A 28 VAL H A 27 ASP H 1.0 . 3.50 180 157 A 28 VAL H A 25 MET HA 1.0 . 4.15 181 158 A 28 VAL H A 26 GLU HA 1.0 . 4.59 182 159 A 28 VAL H A 27 ASP HBy 1.0 . 3.75 183 160 A 28 VAL H A 28 VAL HB 1.0 . 3.33 184 161 A 28 VAL H A 28 VAL HGx% 1.0 . 4.50 185 162 A 28 VAL H A 44 ILE HD1% 1.0 . 4.76 186 163 A 8 VAL H A 7 GLU HGx 1.0 . 4.72 187 163 A 8 VAL H A 7 GLU HGy 1.0 . 4.72 188 164 A 8 VAL H A 7 GLU HBx 1.0 . 4.77 189 165 A 8 VAL H A 8 VAL HGx% 1.0 . 3.18 190 166 A 101 LEU H A 101 LEU HBy 1.0 . 2.98 191 167 A 29 LEU H A 27 ASP H 1.0 . 5.08 192 168 A 29 LEU H A 25 MET HA 1.0 . 5.00 193 169 A 101 LEU H A 100 SER H 1.0 . 3.23 194 170 A 101 LEU H A 100 SER HBx 1.0 . 3.77 195 170 A 101 LEU H A 100 SER HBy 1.0 . 3.77 196 171 A 29 LEU H A 28 VAL HB 1.0 . 4.02 197 172 A 29 LEU H A 29 LEU HBy 1.0 . 3.45 198 173 A 29 LEU H A 29 LEU HG 1.0 . 3.41 199 174 A 29 LEU H A 29 LEU HBx 1.0 . 3.71 200 175 A 29 LEU H A 29 LEU HDx% 1.0 . 3.77 201 175 A 29 LEU H A 29 LEU HDy% 1.0 . 3.77 202 176 A 15 ARG HBy A 87 TYR H 1.0 . 4.99 203 177 A 4 LEU HA A 5 GLU H 1.0 . 2.77 204 178 A 5 GLU H A 5 GLU HBy 1.0 . 3.60 205 179 A 4 LEU HBx A 5 GLU H 1.0 . 3.39 206 180 A 93 ASP HBx A 94 VAL H 1.0 . 4.71 207 181 A 94 VAL H A 92 GLU H 1.0 . 4.81 208 182 A 15 ARG H A 87 TYR H 1.0 . 4.10 209 183 A 87 TYR HD% A 87 TYR H 1.0 . 4.38 210 184 A 87 TYR HBx A 87 TYR H 1.0 . 4.05 211 185 A 104 LYS H A 103 VAL H 1.0 . 3.55 212 186 A 103 VAL H A 102 GLN H 1.0 . 3.29 213 187 A 103 VAL H A 102 GLN HA 1.0 . 2.83 214 188 A 103 VAL H A 102 GLN HGx 1.0 . 5.34 215 189 A 103 VAL H A 103 VAL HB 1.0 . 3.34 216 190 A 94 VAL H A 93 ASP HBy 1.0 . 4.42 217 191 A 5 GLU H A 6 GLU H 1.0 . 2.93 218 192 A 6 GLU H A 6 GLU HBy 1.0 . 3.84 219 193 A 6 GLU H A 6 GLU HBx 1.0 . 3.92 220 194 A 4 LEU HBx A 6 GLU H 1.0 . 4.36 221 195 A 8 VAL HGx% A 6 GLU H 1.0 . 5.48 222 196 A 96 ALA H A 97 LEU H 1.0 . 3.34 223 197 A 96 ALA H A 94 VAL HGx% 1.0 . 5.19 224 197 A 96 ALA H A 94 VAL HGy% 1.0 . 5.19 225 198 A 91 ASN HA A 95 ASP H 1.0 . 5.27 226 199 A 96 ALA H A 95 ASP H 1.0 . 3.50 227 200 A 97 LEU H A 95 ASP H 1.0 . 4.97 228 201 A 94 VAL H A 95 ASP H 1.0 . 3.49 229 202 A 95 ASP H A 93 ASP HA 1.0 . 5.01 230 203 A 95 ASP H A 95 ASP HBy 1.0 . 3.55 231 204 A 23 CYS H A 24 THR H 1.0 . 4.70 232 205 A 21 TRP H A 23 CYS H 1.0 . 5.06 233 206 A 23 CYS H A 21 TRP HA 1.0 . 4.49 234 207 A 22 SER H A 23 CYS H 1.0 . 3.45 235 208 A 23 CYS H A 22 SER HBy 1.0 . 5.13 236 209 A 23 CYS H A 23 CYS HBy 1.0 . 3.64 237 210 A 23 CYS H A 23 CYS HBx 1.0 . 3.60 238 211 A 23 CYS H A 20 PRO HGx 1.0 . 4.75 239 211 A 20 PRO HGy A 23 CYS H 1.0 . 4.75 240 212 A 66 GLN H A 68 VAL H 1.0 . 5.11 241 213 A 68 VAL H A 69 GLN H 1.0 . 3.34 242 214 A 68 VAL H A 67 ASP H 1.0 . 3.39 243 215 A 68 VAL H A 67 ASP HBx 1.0 . 3.73 244 215 A 68 VAL H A 67 ASP HBy 1.0 . 3.73 245 216 A 68 VAL H A 68 VAL HB 1.0 . 3.27 246 217 A 68 VAL H A 62 MET HGx 1.0 . 4.67 247 218 A 55 ARG H A 49 ASN H 1.0 . 5.05 248 219 A 49 ASN H A 49 ASN HD2x 1.0 . 5.50 249 220 A 48 LEU HA A 49 ASN H 1.0 . 3.22 250 221 A 49 ASN H A 49 ASN HBy 1.0 . 3.95 251 222 A 49 ASN HBx A 49 ASN H 1.0 . 3.81 252 223 A 49 ASN H A 48 LEU HBy 1.0 . 3.91 253 224 A 49 ASN H A 48 LEU HDx% 1.0 . 4.48 254 225 A 54 ARG HA A 49 ASN H 1.0 . 4.48 255 226 A 48 LEU HDy% A 49 ASN H 1.0 . 5.10 256 227 A 49 ASN HBy A 50 ARG H 1.0 . 3.92 257 228 A 49 ASN HBx A 50 ARG H 1.0 . 4.01 258 229 A 50 ARG H A 50 ARG HBx 1.0 . 3.59 259 229 A 50 ARG H A 50 ARG HBy 1.0 . 3.59 260 230 A 99 LYS H A 99 LYS HGy 1.0 . 3.58 261 231 A 97 LEU H A 93 ASP HA 1.0 . 5.50 262 232 A 97 LEU H A 95 ASP HA 1.0 . 4.63 263 233 A 97 LEU H A 94 VAL HA 1.0 . 4.10 264 234 A 97 LEU H A 95 ASP HBy 1.0 . 5.50 265 235 A 97 LEU H A 97 LEU HBy 1.0 . 3.22 266 236 A 99 LYS H A 98 MET HBy 1.0 . 3.67 267 237 A 99 LYS H A 99 LYS HBx 1.0 . 2.83 268 237 A 99 LYS H A 99 LYS HBy 1.0 . 2.83 269 238 A 12 PHE H A 11 VAL H 1.0 . 4.44 270 239 A 11 VAL H A 9 ASP HA 1.0 . 4.80 271 240 A 11 VAL H A 10 ASP HA 1.0 . 2.75 272 241 A 49 ASN H A 53 LYS H 1.0 . 3.90 273 242 A 54 ARG H A 53 LYS H 1.0 . 4.55 274 243 A 49 ASN HD2x A 53 LYS H 1.0 . 5.41 275 244 A 53 LYS H A 53 LYS HBx 1.0 . 3.33 276 244 A 53 LYS H A 53 LYS HBy 1.0 . 3.33 277 245 A 48 LEU HBx A 53 LYS H 1.0 . 5.00 278 246 A 44 ILE H A 25 MET HGy 1.0 . 5.42 279 247 A 33 SER HBx A 34 ASP H 1.0 . 4.40 280 248 A 34 ASP H A 34 ASP HBx 1.0 . 3.32 281 248 A 34 ASP H A 34 ASP HBy 1.0 . 3.32 282 249 A 66 GLN H A 67 ASP H 1.0 . 3.16 283 250 A 66 GLN H A 64 SER HBx 1.0 . 4.04 284 251 A 66 GLN H A 66 GLN HBy 1.0 . 2.95 285 252 A 44 ILE H A 42 ASN H 1.0 . 4.81 286 253 A 44 ILE H A 44 ILE HB 1.0 . 3.23 287 254 A 44 ILE HG1y A 44 ILE H 1.0 . 3.90 288 255 A 25 MET H A 26 GLU H 1.0 . 3.41 289 256 A 27 ASP H A 26 GLU H 1.0 . 3.33 290 257 A 27 ASP HBy A 26 GLU H 1.0 . 5.18 291 258 A 26 GLU H A 25 MET HBy 1.0 . 3.27 292 259 A 26 GLU H A 26 GLU HBy 1.0 . 3.10 293 260 A 26 GLU H A 26 GLU HBx 1.0 . 3.09 294 261 A 26 GLU H A 29 LEU HDx% 1.0 . 5.02 295 261 A 29 LEU HDy% A 26 GLU H 1.0 . 5.02 296 262 A 19 LEU H A 56 GLY HAx 1.0 . 4.95 297 263 A 2 SER H A 2 SER HA 1.0 . 2.89 298 264 A 2 SER H A 2 SER HBx 1.0 . 3.57 299 264 A 2 SER HBy A 2 SER H 1.0 . 3.57 300 265 A 93 ASP H A 92 GLU H 1.0 . 3.21 301 266 A 93 ASP H A 94 VAL H 1.0 . 3.05 302 267 A 93 ASP H A 91 ASN HA 1.0 . 5.01 303 268 A 19 LEU H A 17 GLN HA 1.0 . 4.57 304 269 A 19 LEU H A 19 LEU HBx 1.0 . 4.16 305 270 A 19 LEU H A 19 LEU HDy% 1.0 . 4.56 306 271 A 57 ASP HA A 19 LEU H 1.0 . 5.11 307 272 A 19 LEU H A 19 LEU HDx% 1.0 . 4.61 308 273 A 93 ASP H A 93 ASP HBx 1.0 . 3.24 309 274 A 28 VAL HA A 27 ASP H 1.0 . 5.42 310 275 A 27 ASP H A 24 THR H 1.0 . 4.00 311 276 A 27 ASP H A 27 ASP HBy 1.0 . 3.36 312 277 A 27 ASP H A 27 ASP HBx 1.0 . 3.85 313 278 A 27 ASP H A 26 GLU HBx 1.0 . 3.63 314 279 A 82 ARG H A 81 GLN H 1.0 . 3.20 315 280 A 82 ARG H A 78 TYR HE% 1.0 . 5.29 316 281 A 82 ARG H A 80 GLY HAy 1.0 . 4.44 317 282 A 82 ARG H A 80 GLY HAx 1.0 . 5.11 318 283 A 82 ARG H A 78 TYR HBy 1.0 . 5.13 319 284 A 82 ARG H A 81 GLN HGx 1.0 . 4.17 320 284 A 82 ARG H A 81 GLN HGy 1.0 . 4.17 321 285 A 82 ARG H A 82 ARG HBy 1.0 . 3.87 322 286 A 82 ARG H A 82 ARG HBx 1.0 . 3.42 323 287 A 82 ARG H A 82 ARG HGy 1.0 . 3.90 324 288 A 82 ARG H A 78 TYR HD% 1.0 . 4.71 325 289 A 27 ASP H A 25 MET H 1.0 . 4.95 326 290 A 25 MET H A 24 THR HA 1.0 . 2.85 327 291 A 26 GLU HA A 25 MET H 1.0 . 5.31 328 292 A 25 MET H A 25 MET HBy 1.0 . 3.49 329 293 A 25 MET H A 25 MET HBx 1.0 . 3.88 330 294 A 65 GLU H A 67 ASP H 1.0 . 4.93 331 295 A 64 SER HBx A 67 ASP H 1.0 . 5.08 332 296 A 67 ASP H A 67 ASP HBx 1.0 . 3.32 333 296 A 67 ASP H A 67 ASP HBy 1.0 . 3.32 334 297 A 67 ASP H A 66 GLN HBy 1.0 . 3.73 335 298 A 67 ASP H A 66 GLN HBx 1.0 . 3.68 336 299 A 67 ASP H A 68 VAL HGx% 1.0 . 5.16 337 300 A 68 VAL HA A 70 LYS H 1.0 . 5.25 338 301 A 68 VAL HGy% A 70 LYS H 1.0 . 5.50 339 302 A 71 ALA H A 70 LYS H 1.0 . 3.27 340 303 A 68 VAL H A 70 LYS H 1.0 . 4.60 341 304 A 70 LYS H A 67 ASP HA 1.0 . 3.87 342 305 A 70 LYS H A 69 GLN HGy 1.0 . 4.22 343 305 A 70 LYS H A 69 GLN HGx 1.0 . 4.22 344 306 A 70 LYS H A 69 GLN HBx 1.0 . 3.41 345 307 A 70 LYS H A 70 LYS HDy 1.0 . 4.47 346 308 A 70 LYS H A 70 LYS HGy 1.0 . 3.55 347 309 A 99 LYS H A 98 MET H 1.0 . 3.32 348 310 A 101 LEU H A 98 MET H 1.0 . 5.38 349 311 A 98 MET H A 98 MET HGx 1.0 . 3.39 350 312 A 98 MET HBy A 98 MET H 1.0 . 3.24 351 313 A 98 MET H A 98 MET HBx 1.0 . 3.56 352 314 A 97 LEU HBy A 98 MET H 1.0 . 3.54 353 315 A 97 LEU H A 98 MET H 1.0 . 3.29 354 316 A 94 VAL HA A 98 MET H 1.0 . 4.51 355 317 A 98 MET H A 97 LEU HBx 1.0 . 3.60 356 318 A 31 PHE HE% A 78 TYR H 1.0 . 5.40 357 319 A 78 TYR HD% A 78 TYR H 1.0 . 4.79 358 320 A 37 ILE HG2% A 39 ASN H 1.0 . 5.50 359 321 A 92 GLU H A 90 ASN HBy 1.0 . 3.70 360 321 A 90 ASN HBx A 92 GLU H 1.0 . 3.70 361 322 A 92 GLU H A 90 ASN HA 1.0 . 5.50 362 323 A 92 GLU H A 94 VAL HGx% 1.0 . 5.50 363 323 A 92 GLU H A 94 VAL HGy% 1.0 . 5.50 364 324 A 72 LEU H A 73 GLU H 1.0 . 3.51 365 325 A 73 GLU H A 74 LYS H 1.0 . 3.27 366 326 A 73 GLU H A 73 GLU HBx 1.0 . 3.10 367 326 A 73 GLU H A 73 GLU HBy 1.0 . 3.10 368 327 A 73 GLU H A 72 LEU HBy 1.0 . 4.06 369 328 A 73 GLU H A 72 LEU HBx 1.0 . 4.12 370 329 A 73 GLU H A 72 LEU HDy% 1.0 . 5.06 371 330 A 38 ARG H A 39 ASN H 1.0 . 4.83 372 331 A 39 ASN H A 40 GLY H 1.0 . 3.59 373 332 A 39 ASN H A 38 ARG HBx 1.0 . 4.79 374 333 A 103 VAL HGy% A 105 SER H 1.0 . 5.36 375 334 A 105 SER H A 105 SER HBy 1.0 . 3.68 376 335 A 105 SER H A 104 LYS HBy 1.0 . 4.52 377 336 A 104 LYS HBx A 105 SER H 1.0 . 4.93 378 337 A 101 LEU H A 102 GLN H 1.0 . 3.11 379 338 A 102 GLN H A 102 GLN HA 1.0 . 2.92 380 339 A 102 GLN H A 102 GLN HGy 1.0 . 3.61 381 340 A 102 GLN H A 102 GLN HBx 1.0 . 3.09 382 341 A 101 LEU HBy A 102 GLN H 1.0 . 4.18 383 342 A 102 GLN H A 101 LEU HBx 1.0 . 4.55 384 343 A 73 GLU H A 74 LYS HGx 1.0 . 5.50 385 344 A 62 MET H A 63 GLU H 1.0 . 4.98 386 345 A 38 ARG H A 63 GLU H 1.0 . 4.12 387 346 A 63 GLU H A 64 SER H 1.0 . 3.73 388 347 A 62 MET HA A 63 GLU H 1.0 . 3.14 389 348 A 63 GLU H A 37 ILE HA 1.0 . 4.32 390 349 A 63 GLU H A 67 ASP HBx 1.0 . 4.08 391 349 A 67 ASP HBy A 63 GLU H 1.0 . 4.08 392 350 A 63 GLU H A 63 GLU HBy 1.0 . 3.43 393 351 A 57 ASP H A 17 GLN HA 1.0 . 5.43 394 352 A 34 ASP H A 35 CYS H 1.0 . 2.94 395 353 A 35 CYS H A 33 SER HA 1.0 . 4.10 396 354 A 35 CYS H A 32 PHE HBy 1.0 . 4.44 397 355 A 35 CYS H A 35 CYS HBy 1.0 . 3.49 398 356 A 35 CYS H A 34 ASP HBx 1.0 . 3.95 399 356 A 34 ASP HBy A 35 CYS H 1.0 . 3.95 400 357 A 37 ILE HD1% A 35 CYS H 1.0 . 5.50 401 358 A 76 ARG H A 77 MET H 1.0 . 4.20 402 359 A 77 MET H A 77 MET HGx 1.0 . 4.26 403 359 A 77 MET H A 77 MET HGy 1.0 . 4.26 404 360 A 58 ALA HB% A 57 ASP H 1.0 . 5.50 405 361 A 74 LYS H A 75 HIS H 1.0 . 3.64 406 362 A 74 LYS H A 74 LYS HBy 1.0 . 3.66 407 363 A 74 LYS H A 74 LYS HBx 1.0 . 3.91 408 364 A 74 LYS H A 86 VAL HGx% 1.0 . 5.50 409 365 A 74 LYS H A 73 GLU HGy 1.0 . 5.12 410 366 A 49 ASN HD2x A 51 ASP H 1.0 . 5.46 411 367 A 74 LYS H A 74 LYS HGx 1.0 . 4.11 412 368 A 50 ARG H A 51 ASP H 1.0 . 3.87 413 369 A 51 ASP H A 52 GLY HAx 1.0 . 4.93 414 370 A 51 ASP H A 51 ASP HBx 1.0 . 3.36 415 371 A 49 ASN H A 51 ASP H 1.0 . 4.96 416 372 A 49 ASN HBy A 51 ASP H 1.0 . 4.38 417 373 A 51 ASP H A 50 ARG HBx 1.0 . 3.87 418 373 A 50 ARG HBy A 51 ASP H 1.0 . 3.87 419 374 A 72 LEU H A 72 LEU HBy 1.0 . 3.08 420 375 A 72 LEU H A 71 ALA HB% 1.0 . 3.75 421 376 A 72 LEU H A 72 LEU HDy% 1.0 . 4.05 422 377 A 71 ALA H A 69 GLN H 1.0 . 5.28 423 378 A 69 GLN H A 66 GLN HA 1.0 . 3.78 424 379 A 69 GLN H A 69 GLN HGy 1.0 . 3.13 425 379 A 69 GLN H A 69 GLN HGx 1.0 . 3.13 426 380 A 69 GLN H A 69 GLN HBx 1.0 . 3.24 427 381 A 68 VAL HGy% A 69 GLN H 1.0 . 4.05 428 382 A 69 GLN H A 67 ASP HA 1.0 . 5.30 429 383 A 30 ASN H A 32 PHE H 1.0 . 4.50 430 384 A 31 PHE HD% A 32 PHE H 1.0 . 4.61 431 385 A 28 VAL HGx% A 32 PHE H 1.0 . 5.50 432 386 A 31 PHE H A 32 PHE H 1.0 . 3.22 433 387 A 32 PHE H A 32 PHE HD% 1.0 . 3.89 434 388 A 33 SER H A 32 PHE H 1.0 . 3.65 435 389 A 29 LEU HA A 32 PHE H 1.0 . 4.33 436 390 A 32 PHE HBy A 32 PHE H 1.0 . 3.74 437 391 A 31 PHE HBy A 32 PHE H 1.0 . 4.05 438 392 A 32 PHE H A 32 PHE HBx 1.0 . 3.20 439 393 A 32 PHE H A 79 MET HE% 1.0 . 5.50 440 394 A 24 THR H A 23 CYS HBy 1.0 . 3.57 441 395 A 24 THR H A 24 THR HG2% 1.0 . 3.99 442 396 A 39 ASN HBx A 39 ASN HD2y 1.0 . 3.39 443 397 A 39 ASN HA A 39 ASN HD2x 1.0 . 5.15 444 398 A 39 ASN HD2x A 38 ARG HDx 1.0 . 5.35 445 398 A 39 ASN HD2x A 38 ARG HDy 1.0 . 5.35 446 399 A 39 ASN HBx A 39 ASN HD2x 1.0 . 3.74 447 400 A 39 ASN HD2x A 38 ARG HGx 1.0 . 4.59 448 400 A 39 ASN HD2x A 38 ARG HGy 1.0 . 4.59 449 401 A 39 ASN HD2y A 38 ARG HGx 1.0 . 4.60 450 401 A 39 ASN HD2y A 38 ARG HGy 1.0 . 4.60 451 402 A 100 SER H A 98 MET H 1.0 . 4.68 452 403 A 100 SER H A 99 LYS H 1.0 . 3.23 453 404 A 100 SER H A 98 MET HA 1.0 . 4.14 454 405 A 100 SER H A 100 SER HBx 1.0 . 2.87 455 405 A 100 SER H A 100 SER HBy 1.0 . 2.87 456 406 A 100 SER H A 99 LYS HGx 1.0 . 5.50 457 407 A 60 ILE H A 14 ILE H 1.0 . 3.90 458 408 A 14 ILE H A 13 LEU HBx 1.0 . 4.11 459 409 A 13 LEU H A 14 ILE H 1.0 . 5.05 460 410 A 14 ILE H A 61 GLU HA 1.0 . 5.10 461 411 A 13 LEU HBy A 14 ILE H 1.0 . 4.18 462 412 A 30 ASN H A 28 VAL HA 1.0 . 4.90 463 413 A 30 ASN H A 26 GLU HGy 1.0 . 5.47 464 414 A 30 ASN H A 29 LEU H 1.0 . 3.47 465 415 A 30 ASN H A 30 ASN HD2y 1.0 . 4.39 466 416 A 30 ASN H A 31 PHE HA 1.0 . 5.46 467 417 A 30 ASN H A 30 ASN HBy 1.0 . 3.18 468 418 A 30 ASN H A 29 LEU HBy 1.0 . 3.63 469 419 A 30 ASN H A 29 LEU HG 1.0 . 5.50 470 420 A 30 ASN H A 29 LEU HBx 1.0 . 3.93 471 421 A 30 ASN H A 29 LEU HDx% 1.0 . 4.59 472 421 A 30 ASN H A 29 LEU HDy% 1.0 . 4.59 473 422 A 43 GLY H A 42 ASN HD2y 1.0 . 5.50 474 423 A 42 ASN HD2y A 42 ASN HA 1.0 . 4.83 475 424 A 42 ASN HD2y A 42 ASN HBy 1.0 . 3.62 476 425 A 42 ASN HBx A 42 ASN HD2y 1.0 . 3.56 477 426 A 42 ASN HD2y A 41 GLU HGx 1.0 . 5.20 478 426 A 42 ASN HD2y A 41 GLU HGy 1.0 . 5.20 479 427 A 42 ASN HD2x A 41 GLU HGx 1.0 . 5.32 480 427 A 41 GLU HGy A 42 ASN HD2x 1.0 . 5.32 481 428 A 33 SER H A 34 ASP H 1.0 . 3.53 482 429 A 33 SER H A 35 CYS H 1.0 . 4.90 483 430 A 33 SER H A 30 ASN HA 1.0 . 4.27 484 431 A 33 SER H A 33 SER HA 1.0 . 2.93 485 432 A 33 SER H A 33 SER HBx 1.0 . 3.49 486 433 A 33 SER H A 32 PHE HBy 1.0 . 5.18 487 434 A 33 SER H A 32 PHE HBx 1.0 . 4.28 488 435 A 69 GLN H A 69 GLN HE2y 1.0 . 5.06 489 436 A 69 GLN HE2y A 69 GLN HA 1.0 . 4.80 490 437 A 69 GLN HE2y A 69 GLN HGy 1.0 . 3.46 491 437 A 69 GLN HGx A 69 GLN HE2y 1.0 . 3.46 492 438 A 69 GLN HE2y A 65 GLU HGx 1.0 . 4.41 493 438 A 69 GLN HE2y A 65 GLU HGy 1.0 . 4.41 494 439 A 68 VAL HGy% A 69 GLN HE2y 1.0 . 4.17 495 440 A 69 GLN HA A 69 GLN HE2x 1.0 . 5.50 496 441 A 69 GLN HE2x A 65 GLU HGx 1.0 . 5.50 497 441 A 65 GLU HGy A 69 GLN HE2x 1.0 . 5.50 498 442 A 72 LEU HDy% A 69 GLN HE2x 1.0 . 4.28 499 443 A 42 ASN H A 40 GLY H 1.0 . 5.28 500 444 A 42 ASN H A 42 ASN HD2x 1.0 . 5.21 501 445 A 42 ASN H A 40 GLY HAx 1.0 . 4.71 502 446 A 41 GLU H A 42 ASN H 1.0 . 3.33 503 447 A 43 GLY H A 42 ASN H 1.0 . 3.11 504 448 A 42 ASN H A 43 GLY HAy 1.0 . 5.27 505 449 A 42 ASN H A 43 GLY HAx 1.0 . 4.85 506 450 A 42 ASN H A 42 ASN HBy 1.0 . 3.27 507 451 A 42 ASN HBx A 42 ASN H 1.0 . 3.15 508 452 A 42 ASN H A 41 GLU HBx 1.0 . 3.78 509 452 A 41 GLU HBy A 42 ASN H 1.0 . 3.78 510 453 A 44 ILE HD1% A 42 ASN H 1.0 . 4.83 511 454 A 91 ASN H A 91 ASN HD2y 1.0 . 4.11 512 455 A 90 ASN HD2y A 90 ASN HA 1.0 . 5.13 513 456 A 90 ASN HD2y A 90 ASN HBy 1.0 . 3.32 514 456 A 90 ASN HD2y A 90 ASN HBx 1.0 . 3.32 515 457 A 90 ASN HD2y A 92 GLU HGy 1.0 . 5.50 516 458 A 91 ASN HA A 91 ASN HD2y 1.0 . 4.34 517 459 A 26 GLU HBy A 30 ASN HD2y 1.0 . 5.50 518 460 A 91 ASN HD2x A 91 ASN HA 1.0 . 5.18 519 461 A 90 ASN HD2x A 90 ASN HA 1.0 . 5.48 520 462 A 90 ASN HD2x A 90 ASN HBy 1.0 . 4.03 521 462 A 90 ASN HD2x A 90 ASN HBx 1.0 . 4.03 522 463 A 26 GLU HA A 30 ASN HD2y 1.0 . 5.50 523 464 A 30 ASN HD2y A 30 ASN HA 1.0 . 4.54 524 465 A 30 ASN HD2y A 30 ASN HBy 1.0 . 3.45 525 466 A 26 GLU HGy A 30 ASN HD2y 1.0 . 4.20 526 467 A 30 ASN H A 30 ASN HD2x 1.0 . 5.07 527 468 A 30 ASN HA A 30 ASN HD2x 1.0 . 5.50 528 469 A 30 ASN HBy A 30 ASN HD2x 1.0 . 3.92 529 470 A 26 GLU HGy A 30 ASN HD2x 1.0 . 4.15 530 471 A 29 LEU H A 30 ASN HD2x 1.0 . 5.50 531 472 A 81 GLN HE2y A 82 ARG HGx 1.0 . 5.50 532 473 A 50 ARG H A 49 ASN HD2y 1.0 . 5.50 533 474 A 66 GLN HA A 66 GLN HE2y 1.0 . 5.06 534 475 A 66 GLN HE2y A 70 LYS HEy 1.0 . 5.50 535 476 A 66 GLN HE2y A 70 LYS HEx 1.0 . 5.50 536 477 A 66 GLN HE2y A 66 GLN HGx 1.0 . 3.76 537 477 A 66 GLN HE2y A 66 GLN HGy 1.0 . 3.76 538 478 A 81 GLN H A 81 GLN HE2y 1.0 . 5.44 539 479 A 82 ARG H A 81 GLN HE2y 1.0 . 4.71 540 480 A 81 GLN HE2y A 81 GLN HA 1.0 . 5.10 541 481 A 81 GLN HE2y A 81 GLN HGx 1.0 . 3.81 542 481 A 81 GLN HGy A 81 GLN HE2y 1.0 . 3.81 543 482 A 81 GLN HE2y A 81 GLN HBx 1.0 . 5.21 544 483 A 49 ASN HD2x A 51 ASP HBx 1.0 . 5.50 545 484 A 49 ASN HBx A 49 ASN HD2y 1.0 . 3.89 546 485 A 49 ASN HD2y A 49 ASN HA 1.0 . 5.21 547 486 A 49 ASN HD2y A 50 ARG HGx 1.0 . 5.46 548 486 A 49 ASN HD2y A 50 ARG HGy 1.0 . 5.46 549 487 A 49 ASN HD2x A 50 ARG HA 1.0 . 5.44 550 488 A 102 GLN H A 102 GLN HE2y 1.0 . 4.49 551 489 A 102 GLN HA A 102 GLN HE2y 1.0 . 5.50 552 490 A 102 GLN HE2y A 99 LYS HA 1.0 . 4.83 553 491 A 102 GLN HGx A 102 GLN HE2y 1.0 . 3.76 554 492 A 17 GLN HBy A 17 GLN HE2y 1.0 . 4.49 555 493 A 17 GLN HE2y A 17 GLN HBx 1.0 . 4.83 556 494 A 17 GLN HBy A 18 GLY H 1.0 . 4.74 557 495 A 17 GLN HBx A 18 GLY H 1.0 . 4.83 558 496 A 18 GLY H A 19 LEU HG 1.0 . 5.00 559 497 A 44 ILE H A 43 GLY H 1.0 . 3.16 560 498 A 43 GLY H A 41 GLU HA 1.0 . 4.08 561 499 A 43 GLY H A 42 ASN HBy 1.0 . 3.92 562 500 A 43 GLY H A 42 ASN HBx 1.0 . 4.19 563 501 A 43 GLY H A 25 MET HE% 1.0 . 5.28 564 502 A 44 ILE HG1y A 43 GLY H 1.0 . 4.87 565 503 A 43 GLY H A 37 ILE HG2% 1.0 . 3.99 566 504 A 65 GLU H A 64 SER H 1.0 . 5.02 567 505 A 67 ASP H A 64 SER H 1.0 . 4.07 568 506 A 68 VAL H A 64 SER H 1.0 . 4.91 569 507 A 64 SER H A 63 GLU HBx 1.0 . 3.54 570 508 A 68 VAL HGx% A 64 SER H 1.0 . 5.50 571 509 A 12 PHE HD% A 64 SER H 1.0 . 5.50 572 510 A 67 ASP HA A 64 SER H 1.0 . 5.48 573 511 A 64 SER HBx A 64 SER H 1.0 . 4.21 574 512 A 64 SER H A 67 ASP HBx 1.0 . 3.30 575 512 A 67 ASP HBy A 64 SER H 1.0 . 3.30 576 513 A 21 TRP HBx A 22 SER H 1.0 . 4.11 577 514 A 55 ARG H A 56 GLY H 1.0 . 4.36 578 515 A 57 ASP H A 56 GLY H 1.0 . 3.96 579 516 A 56 GLY H A 55 ARG HBy 1.0 . 4.36 580 517 A 41 GLU H A 40 GLY H 1.0 . 3.95 581 518 A 40 GLY H A 39 ASN HA 1.0 . 3.47 582 519 A 40 GLY H A 39 ASN HBx 1.0 . 4.52 583 520 A 40 GLY H A 41 GLU HGx 1.0 . 5.50 584 520 A 40 GLY H A 41 GLU HGy 1.0 . 5.50 585 521 A 37 ILE HB A 40 GLY H 1.0 . 4.27 586 522 A 49 ASN H A 52 GLY H 1.0 . 4.61 587 523 A 50 ARG H A 52 GLY H 1.0 . 5.17 588 524 A 53 LYS H A 52 GLY H 1.0 . 3.26 589 525 A 51 ASP H A 52 GLY H 1.0 . 3.17 590 526 A 51 ASP HBx A 52 GLY H 1.0 . 4.53 591 527 A 48 LEU HBx A 52 GLY H 1.0 . 4.43 592 528 A 13 LEU HBy A 12 PHE HA 1.0 . 5.42 593 529 A 13 LEU HBy A 89 ILE HD1% 1.0 . 4.89 594 530 A 13 LEU HBy A 89 ILE HB 1.0 . 4.37 595 531 A 13 LEU H A 13 LEU HBx 1.0 . 3.86 596 532 A 13 LEU HBx A 61 GLU HA 1.0 . 4.91 597 533 A 13 LEU HBx A 13 LEU HDx% 1.0 . 3.39 598 533 A 13 LEU HBx A 13 LEU HDy% 1.0 . 3.39 599 534 A 80 GLY HAy A 81 GLN HGx 1.0 . 5.33 600 534 A 80 GLY HAy A 81 GLN HGy 1.0 . 5.33 601 535 A 80 GLY HAy A 81 GLN HBx 1.0 . 4.75 602 536 A 80 GLY HAx A 79 MET HA 1.0 . 4.83 603 537 A 80 GLY HAx A 81 GLN HBx 1.0 . 5.04 604 538 A 80 GLY HAx A 81 GLN HGx 1.0 . 4.70 605 538 A 80 GLY HAx A 81 GLN HGy 1.0 . 4.70 606 539 A 40 GLY HAy A 42 ASN H 1.0 . 5.01 607 540 A 40 GLY HAy A 29 LEU HDx% 1.0 . 4.35 608 540 A 40 GLY HAy A 29 LEU HDy% 1.0 . 4.35 609 541 A 40 GLY HAy A 41 GLU HGx 1.0 . 5.01 610 541 A 40 GLY HAy A 41 GLU HGy 1.0 . 5.01 611 542 A 39 ASN HA A 40 GLY HAx 1.0 . 5.21 612 543 A 39 ASN H A 40 GLY HAx 1.0 . 4.95 613 544 A 40 GLY HAy A 41 GLU HBx 1.0 . 4.79 614 544 A 40 GLY HAy A 41 GLU HBy 1.0 . 4.79 615 545 A 19 LEU HBy A 56 GLY HAy 1.0 . 5.22 616 546 A 56 GLY HAx A 19 LEU HBy 1.0 . 4.52 617 547 A 56 GLY HAx A 19 LEU HBx 1.0 . 4.98 618 548 A 48 LEU HBx A 52 GLY HAy 1.0 . 4.32 619 549 A 51 ASP H A 52 GLY HAy 1.0 . 4.90 620 550 A 48 LEU HBy A 52 GLY HAx 1.0 . 4.53 621 551 A 48 LEU HBx A 52 GLY HAx 1.0 . 4.29 622 552 A 48 LEU HBy A 52 GLY HAy 1.0 . 4.96 623 553 A 17 GLN HA A 18 GLY HAx 1.0 . 4.95 624 554 A 61 GLU H A 43 GLY HAy 1.0 . 4.80 625 555 A 61 GLU HGx A 43 GLY HAy 1.0 . 4.66 626 556 A 61 GLU H A 43 GLY HAx 1.0 . 4.96 627 557 A 37 ILE HG2% A 43 GLY HAy 1.0 . 4.32 628 558 A 61 GLU HGx A 43 GLY HAx 1.0 . 5.32 629 559 A 42 ASN HBy A 43 GLY HAx 1.0 . 5.21 630 560 A 58 ALA HA A 59 LEU HBy 1.0 . 5.04 631 561 A 59 LEU HBy A 59 LEU HDx% 1.0 . 3.60 632 561 A 59 LEU HDy% A 59 LEU HBy 1.0 . 3.60 633 562 A 45 HIS HBy A 59 LEU HBy 1.0 . 4.23 634 563 A 59 LEU H A 59 LEU HBx 1.0 . 4.04 635 564 A 45 HIS HBy A 59 LEU HBx 1.0 . 4.33 636 565 A 59 LEU HBx A 45 HIS HBx 1.0 . 4.72 637 566 A 59 LEU HBx A 59 LEU HDx% 1.0 . 3.52 638 566 A 59 LEU HDy% A 59 LEU HBx 1.0 . 3.52 639 567 A 60 ILE H A 59 LEU HBx 1.0 . 4.49 640 568 A 59 LEU HBy A 45 HIS HD2 1.0 . 5.31 641 569 A 59 LEU HBx A 45 HIS HD2 1.0 . 5.24 642 570 A 48 LEU HBy A 52 GLY H 1.0 . 5.14 643 571 A 48 LEU H A 48 LEU HBy 1.0 . 3.67 644 572 A 48 LEU HDy% A 48 LEU HBy 1.0 . 3.85 645 573 A 48 LEU HBx A 49 ASN H 1.0 . 3.77 646 574 A 48 LEU HDy% A 48 LEU HBx 1.0 . 3.93 647 575 A 48 LEU HBx A 48 LEU HDx% 1.0 . 4.22 648 576 A 57 ASP HBy A 17 GLN HA 1.0 . 4.22 649 577 A 63 GLU H A 38 ARG HDx 1.0 . 5.45 650 577 A 63 GLU H A 38 ARG HDy 1.0 . 5.45 651 578 A 54 ARG HA A 55 ARG HDy 1.0 . 5.27 652 579 A 57 ASP HBx A 17 GLN HA 1.0 . 4.25 653 580 A 57 ASP HBx A 59 LEU HDx% 1.0 . 4.33 654 580 A 59 LEU HDy% A 57 ASP HBx 1.0 . 4.33 655 581 A 39 ASN H A 38 ARG HDx 1.0 . 4.50 656 581 A 39 ASN H A 38 ARG HDy 1.0 . 4.50 657 582 A 39 ASN HD2y A 38 ARG HDx 1.0 . 4.84 658 582 A 39 ASN HD2y A 38 ARG HDy 1.0 . 4.84 659 583 A 38 ARG H A 38 ARG HDx 1.0 . 4.62 660 583 A 38 ARG H A 38 ARG HDy 1.0 . 4.62 661 584 A 63 GLU HA A 38 ARG HDx 1.0 . 3.99 662 584 A 38 ARG HDy A 63 GLU HA 1.0 . 3.99 663 585 A 63 GLU HGx A 38 ARG HDx 1.0 . 4.37 664 585 A 38 ARG HDy A 63 GLU HGx 1.0 . 4.37 665 586 A 38 ARG HBx A 38 ARG HDx 1.0 . 3.42 666 586 A 38 ARG HBx A 38 ARG HDy 1.0 . 3.42 667 587 A 17 GLN HE2x A 15 ARG HDx 1.0 . 4.56 668 587 A 15 ARG HDy A 17 GLN HE2x 1.0 . 4.56 669 588 A 15 ARG HBy A 15 ARG HDx 1.0 . 3.91 670 588 A 15 ARG HDy A 15 ARG HBy 1.0 . 3.91 671 589 A 15 ARG HDx A 59 LEU HDx% 1.0 . 4.01 672 589 A 59 LEU HDy% A 15 ARG HDx 1.0 . 4.01 673 589 A 59 LEU HDy% A 15 ARG HDy 1.0 . 4.01 674 589 A 15 ARG HDy A 59 LEU HDx% 1.0 . 4.01 675 590 A 55 ARG HDy A 54 ARG HGy 1.0 . 3.58 676 591 A 54 ARG HA A 54 ARG HDx 1.0 . 4.70 677 591 A 54 ARG HA A 54 ARG HDy 1.0 . 4.70 678 592 A 50 ARG HA A 50 ARG HDx 1.0 . 3.98 679 592 A 50 ARG HA A 50 ARG HDy 1.0 . 3.98 680 593 A 50 ARG HBx A 50 ARG HDx 1.0 . 2.96 681 593 A 50 ARG HBy A 50 ARG HDx 1.0 . 2.96 682 593 A 50 ARG HDy A 50 ARG HBx 1.0 . 2.96 683 593 A 50 ARG HBy A 50 ARG HDy 1.0 . 2.96 684 594 A 50 ARG HDx A 50 ARG HGx 1.0 . 2.63 685 594 A 50 ARG HDy A 50 ARG HGx 1.0 . 2.63 686 594 A 50 ARG HGy A 50 ARG HDx 1.0 . 2.63 687 594 A 50 ARG HGy A 50 ARG HDy 1.0 . 2.63 688 595 A 37 ILE HG2% A 36 ARG HDx 1.0 . 5.16 689 595 A 36 ARG HDy A 37 ILE HG2% 1.0 . 5.16 690 596 A 37 ILE H A 36 ARG HDx 1.0 . 4.36 691 596 A 37 ILE H A 36 ARG HDy 1.0 . 4.36 692 597 A 36 ARG HA A 36 ARG HDx 1.0 . 3.88 693 597 A 36 ARG HA A 36 ARG HDy 1.0 . 3.88 694 598 A 36 ARG HBx A 36 ARG HDx 1.0 . 2.70 695 598 A 36 ARG HDy A 36 ARG HBx 1.0 . 2.70 696 599 A 55 ARG HDy A 48 LEU HDx% 1.0 . 4.02 697 600 A 82 ARG HBy A 82 ARG HDx 1.0 . 4.19 698 600 A 82 ARG HBy A 82 ARG HDy 1.0 . 4.19 699 601 A 82 ARG H A 82 ARG HDx 1.0 . 5.37 700 601 A 82 ARG H A 82 ARG HDy 1.0 . 5.37 701 602 A 15 ARG H A 87 TYR HBy 1.0 . 4.97 702 603 A 87 TYR HBx A 86 VAL HGx% 1.0 . 5.50 703 604 A 87 TYR HBx A 15 ARG HBy 1.0 . 4.95 704 605 A 15 ARG H A 87 TYR HBx 1.0 . 4.84 705 606 A 53 LYS H A 53 LYS HEy 1.0 . 4.92 706 607 A 53 LYS HEy A 53 LYS HGx 1.0 . 3.49 707 608 A 104 LYS HGy A 104 LYS HEy 1.0 . 3.66 708 608 A 104 LYS HGy A 104 LYS HEx 1.0 . 3.66 709 609 A 99 LYS H A 99 LYS HEx 1.0 . 4.69 710 609 A 99 LYS H A 99 LYS HEy 1.0 . 4.69 711 610 A 99 LYS HBx A 99 LYS HEx 1.0 . 3.64 712 610 A 99 LYS HBy A 99 LYS HEx 1.0 . 3.64 713 610 A 99 LYS HEy A 99 LYS HBx 1.0 . 3.64 714 610 A 99 LYS HBy A 99 LYS HEy 1.0 . 3.64 715 611 A 53 LYS HEy A 53 LYS HDx 1.0 . 2.59 716 612 A 99 LYS HGx A 99 LYS HEx 1.0 . 3.18 717 612 A 99 LYS HGx A 99 LYS HEy 1.0 . 3.18 718 613 A 67 ASP HA A 70 LYS HEy 1.0 . 4.66 719 614 A 67 ASP HA A 70 LYS HEx 1.0 . 4.52 720 615 A 31 PHE HZ A 74 LYS HEx 1.0 . 5.50 721 615 A 31 PHE HZ A 74 LYS HEy 1.0 . 5.50 722 616 A 74 LYS HA A 74 LYS HEx 1.0 . 4.42 723 616 A 74 LYS HEy A 74 LYS HA 1.0 . 4.42 724 617 A 101 LEU HBy A 101 LEU HDx% 1.0 . 4.18 725 618 A 101 LEU H A 101 LEU HBx 1.0 . 3.78 726 619 A 93 ASP H A 93 ASP HBy 1.0 . 4.02 727 620 A 90 ASN H A 93 ASP HBy 1.0 . 5.20 728 621 A 89 ILE HG2% A 93 ASP HBy 1.0 . 4.06 729 622 A 90 ASN H A 93 ASP HBx 1.0 . 4.99 730 623 A 89 ILE H A 14 ILE HB 1.0 . 5.04 731 624 A 94 VAL HA A 97 LEU HBy 1.0 . 4.00 732 625 A 97 LEU HBy A 97 LEU HDx% 1.0 . 3.46 733 626 A 14 ILE H A 14 ILE HB 1.0 . 4.17 734 627 A 97 LEU HBx A 97 LEU HDx% 1.0 . 3.37 735 628 A 97 LEU H A 97 LEU HBx 1.0 . 3.64 736 629 A 94 VAL HA A 97 LEU HBx 1.0 . 4.02 737 630 A 10 ASP HBy A 11 VAL HGx% 1.0 . 5.02 738 630 A 11 VAL HGy% A 10 ASP HBy 1.0 . 5.02 739 631 A 10 ASP H A 10 ASP HBx 1.0 . 3.37 740 632 A 9 ASP HA A 10 ASP HBx 1.0 . 5.07 741 633 A 10 ASP HBx A 11 VAL HGx% 1.0 . 5.32 742 633 A 11 VAL HGy% A 10 ASP HBx 1.0 . 5.32 743 634 A 29 LEU HBy A 29 LEU HDx% 1.0 . 3.45 744 634 A 29 LEU HBy A 29 LEU HDy% 1.0 . 3.45 745 635 A 26 GLU HA A 29 LEU HBy 1.0 . 3.38 746 636 A 28 VAL H A 29 LEU HBy 1.0 . 5.13 747 637 A 14 ILE HB A 88 GLU HA 1.0 . 5.22 748 638 A 47 LEU HBx A 47 LEU HDx% 1.0 . 3.18 749 638 A 47 LEU HDy% A 47 LEU HBx 1.0 . 3.18 750 639 A 94 VAL H A 95 ASP HBy 1.0 . 5.44 751 640 A 9 ASP HBx A 8 VAL HGy% 1.0 . 5.12 752 641 A 9 ASP HBx A 11 VAL H 1.0 . 5.50 753 642 A 27 ASP HBy A 24 THR H 1.0 . 4.12 754 643 A 27 ASP HBy A 79 MET HE% 1.0 . 5.18 755 644 A 52 GLY H A 51 ASP HBy 1.0 . 4.64 756 645 A 53 LYS H A 51 ASP HBy 1.0 . 5.29 757 646 A 53 LYS H A 51 ASP HBx 1.0 . 5.08 758 647 A 51 ASP HBx A 50 ARG HGx 1.0 . 4.97 759 647 A 51 ASP HBx A 50 ARG HGy 1.0 . 4.97 760 648 A 9 ASP H A 9 ASP HBy 1.0 . 3.18 761 649 A 96 ALA H A 95 ASP HBy 1.0 . 3.23 762 650 A 28 VAL H A 27 ASP HBx 1.0 . 4.27 763 651 A 24 THR H A 27 ASP HBx 1.0 . 4.13 764 652 A 27 ASP HBx A 28 VAL HGy% 1.0 . 5.50 765 653 A 95 ASP H A 95 ASP HBx 1.0 . 2.94 766 654 A 96 ALA H A 95 ASP HBx 1.0 . 3.30 767 655 A 94 VAL H A 95 ASP HBx 1.0 . 4.89 768 656 A 72 LEU H A 72 LEU HBx 1.0 . 3.81 769 657 A 51 ASP H A 51 ASP HBy 1.0 . 3.59 770 658 A 49 ASN HD2x A 51 ASP HBy 1.0 . 5.08 771 659 A 95 ASP HBy A 96 ALA HA 1.0 . 4.57 772 660 A 95 ASP HBy A 96 ALA HB% 1.0 . 4.48 773 661 A 97 LEU H A 95 ASP HBx 1.0 . 5.03 774 662 A 95 ASP HBx A 96 ALA HA 1.0 . 4.62 775 663 A 60 ILE HB A 14 ILE HB 1.0 . 4.79 776 664 A 60 ILE HB A 59 LEU HA 1.0 . 4.84 777 665 A 60 ILE HB A 14 ILE H 1.0 . 4.74 778 666 A 60 ILE HB A 14 ILE HG1y 1.0 . 3.64 779 667 A 60 ILE HB A 14 ILE HG1x 1.0 . 4.09 780 668 A 60 ILE HB A 14 ILE HD1% 1.0 . 4.36 781 669 A 12 PHE HA A 12 PHE HBx 1.0 . 2.82 782 669 A 12 PHE HBy A 12 PHE HA 1.0 . 2.82 783 670 A 65 GLU HBy A 12 PHE HBx 1.0 . 4.64 784 670 A 12 PHE HBy A 65 GLU HBy 1.0 . 4.64 785 671 A 19 LEU H A 19 LEU HBy 1.0 . 4.00 786 672 A 19 LEU HDx% A 19 LEU HBy 1.0 . 4.16 787 673 A 78 TYR HBy A 78 TYR H 1.0 . 3.67 788 674 A 28 VAL HA A 31 PHE HBy 1.0 . 4.85 789 675 A 49 ASN HBy A 49 ASN HD2y 1.0 . 3.93 790 676 A 49 ASN HBy A 53 LYS H 1.0 . 5.01 791 677 A 89 ILE HG2% A 90 ASN HBy 1.0 . 4.71 792 678 A 90 ASN H A 90 ASN HBy 1.0 . 4.10 793 679 A 90 ASN HD2y A 90 ASN HBy 1.0 . 3.33 794 680 A 92 GLU HGx A 90 ASN HBy 1.0 . 4.86 795 681 A 93 ASP H A 90 ASN HBy 1.0 . 4.23 796 682 A 93 ASP H A 90 ASN HBx 1.0 . 5.19 797 683 A 90 ASN H A 90 ASN HBx 1.0 . 4.09 798 684 A 90 ASN HD2y A 90 ASN HBx 1.0 . 3.41 799 685 A 46 PHE HBy A 48 LEU HDx% 1.0 . 5.50 800 686 A 91 ASN HBy A 94 VAL HB 1.0 . 4.69 801 687 A 94 VAL H A 91 ASN HBy 1.0 . 4.99 802 688 A 91 ASN HBy A 94 VAL HGx% 1.0 . 4.61 803 688 A 94 VAL HGy% A 91 ASN HBy 1.0 . 4.61 804 689 A 91 ASN HD2y A 91 ASN HBy 1.0 . 3.42 805 690 A 91 ASN H A 91 ASN HBx 1.0 . 3.03 806 691 A 93 ASP H A 91 ASN HBx 1.0 . 5.46 807 692 A 91 ASN HD2y A 91 ASN HBx 1.0 . 3.51 808 693 A 94 VAL HB A 91 ASN HBx 1.0 . 4.50 809 694 A 91 ASN HBx A 94 VAL HGx% 1.0 . 4.65 810 694 A 94 VAL HGy% A 91 ASN HBx 1.0 . 4.65 811 695 A 43 GLY H A 44 ILE HB 1.0 . 4.96 812 696 A 45 HIS H A 44 ILE HB 1.0 . 4.89 813 697 A 25 MET HGy A 44 ILE HB 1.0 . 4.94 814 698 A 37 ILE HB A 40 GLY HAy 1.0 . 4.81 815 699 A 37 ILE HB A 40 GLY HAx 1.0 . 4.51 816 700 A 38 ARG H A 37 ILE HB 1.0 . 4.93 817 701 A 46 PHE HBx A 58 ALA HB% 1.0 . 5.50 818 702 A 29 LEU HBx A 30 ASN HBy 1.0 . 5.31 819 703 A 39 ASN HA A 42 ASN HBy 1.0 . 5.50 820 704 A 31 PHE H A 30 ASN HBy 1.0 . 3.85 821 705 A 31 PHE HA A 30 ASN HBx 1.0 . 5.08 822 706 A 30 ASN H A 30 ASN HBx 1.0 . 3.58 823 707 A 31 PHE H A 30 ASN HBx 1.0 . 3.78 824 708 A 30 ASN HD2x A 30 ASN HBx 1.0 . 3.99 825 709 A 34 ASP H A 32 PHE HBy 1.0 . 5.35 826 710 A 35 CYS HBy A 32 PHE HBx 1.0 . 4.91 827 711 A 32 PHE HBx A 62 MET HE% 1.0 . 5.01 828 712 A 90 ASN H A 89 ILE HB 1.0 . 4.37 829 713 A 89 ILE H A 89 ILE HB 1.0 . 3.43 830 714 A 42 ASN H A 39 ASN HBy 1.0 . 5.22 831 715 A 39 ASN HD2x A 39 ASN HBy 1.0 . 4.01 832 716 A 39 ASN HD2y A 39 ASN HBy 1.0 . 3.56 833 717 A 42 ASN HBy A 39 ASN HBy 1.0 . 2.41 834 718 A 39 ASN HBy A 38 ARG HGx 1.0 . 5.22 835 718 A 38 ARG HGy A 39 ASN HBy 1.0 . 5.22 836 719 A 43 GLY H A 39 ASN HBx 1.0 . 5.10 837 720 A 39 ASN HBx A 42 ASN HBy 1.0 . 2.40 838 721 A 38 ARG HBy A 39 ASN HBx 1.0 . 5.27 839 722 A 61 GLU H A 61 GLU HGy 1.0 . 4.11 840 723 A 61 GLU HGy A 13 LEU HDx% 1.0 . 4.41 841 723 A 13 LEU HDy% A 61 GLU HGy 1.0 . 4.41 842 724 A 61 GLU HGx A 60 ILE HA 1.0 . 5.42 843 725 A 38 ARG H A 63 GLU HGy 1.0 . 4.67 844 726 A 64 SER H A 63 GLU HGy 1.0 . 5.29 845 727 A 39 ASN H A 63 GLU HGy 1.0 . 4.85 846 728 A 63 GLU H A 63 GLU HGy 1.0 . 3.78 847 729 A 62 MET HA A 63 GLU HGy 1.0 . 4.90 848 730 A 63 GLU HA A 63 GLU HGy 1.0 . 3.71 849 731 A 63 GLU HGy A 38 ARG HA 1.0 . 4.03 850 732 A 63 GLU HGy A 36 ARG HDx 1.0 . 4.70 851 732 A 36 ARG HDy A 63 GLU HGy 1.0 . 4.70 852 733 A 38 ARG HBx A 63 GLU HGy 1.0 . 4.67 853 734 A 62 MET HA A 63 GLU HGx 1.0 . 4.80 854 735 A 39 ASN H A 63 GLU HGx 1.0 . 4.96 855 736 A 38 ARG H A 63 GLU HGx 1.0 . 4.72 856 737 A 63 GLU H A 63 GLU HGx 1.0 . 3.72 857 738 A 63 GLU HA A 63 GLU HGx 1.0 . 3.65 858 739 A 63 GLU HGx A 38 ARG HA 1.0 . 3.94 859 740 A 63 GLU HGx A 36 ARG HDx 1.0 . 4.76 860 740 A 36 ARG HDy A 63 GLU HGx 1.0 . 4.76 861 741 A 38 ARG HBx A 63 GLU HGx 1.0 . 4.59 862 742 A 74 LYS H A 73 GLU HGx 1.0 . 4.97 863 743 A 72 LEU H A 73 GLU HGy 1.0 . 5.45 864 744 A 73 GLU H A 73 GLU HGy 1.0 . 3.36 865 745 A 73 GLU HGy A 70 LYS HA 1.0 . 3.75 866 746 A 73 GLU HGy A 73 GLU HBx 1.0 . 3.01 867 746 A 73 GLU HBy A 73 GLU HGy 1.0 . 3.01 868 747 A 73 GLU H A 73 GLU HGx 1.0 . 3.53 869 748 A 73 GLU HGx A 70 LYS HA 1.0 . 4.21 870 749 A 26 GLU HA A 26 GLU HGy 1.0 . 3.47 871 750 A 93 ASP H A 92 GLU HGy 1.0 . 3.80 872 751 A 5 GLU H A 5 GLU HGx 1.0 . 3.62 873 751 A 5 GLU HGy A 5 GLU H 1.0 . 3.62 874 752 A 5 GLU HA A 5 GLU HGx 1.0 . 3.72 875 752 A 5 GLU HGy A 5 GLU HA 1.0 . 3.72 876 753 A 26 GLU HA A 26 GLU HGx 1.0 . 4.19 877 754 A 93 ASP H A 92 GLU HGx 1.0 . 3.88 878 755 A 92 GLU H A 92 GLU HGy 1.0 . 3.45 879 756 A 92 GLU H A 92 GLU HGx 1.0 . 3.56 880 757 A 41 GLU H A 41 GLU HGx 1.0 . 3.29 881 757 A 41 GLU H A 41 GLU HGy 1.0 . 3.29 882 758 A 42 ASN H A 41 GLU HGx 1.0 . 3.73 883 758 A 42 ASN H A 41 GLU HGy 1.0 . 3.73 884 759 A 14 ILE HD1% A 86 VAL HB 1.0 . 5.38 885 760 A 75 HIS H A 76 ARG HBx 1.0 . 4.91 886 760 A 75 HIS H A 76 ARG HBy 1.0 . 4.91 887 761 A 72 LEU HDx% A 86 VAL HB 1.0 . 4.60 888 762 A 65 GLU H A 65 GLU HGx 1.0 . 3.83 889 762 A 65 GLU H A 65 GLU HGy 1.0 . 3.83 890 763 A 69 GLN H A 65 GLU HGx 1.0 . 4.99 891 763 A 69 GLN H A 65 GLU HGy 1.0 . 4.99 892 764 A 66 GLN HA A 65 GLU HGx 1.0 . 4.46 893 764 A 66 GLN HA A 65 GLU HGy 1.0 . 4.46 894 765 A 65 GLU HA A 65 GLU HGx 1.0 . 3.47 895 765 A 65 GLU HGy A 65 GLU HA 1.0 . 3.47 896 766 A 66 GLN H A 65 GLU HGx 1.0 . 4.36 897 766 A 66 GLN H A 65 GLU HGy 1.0 . 4.36 898 767 A 17 GLN HGy A 15 ARG HDx 1.0 . 5.09 899 767 A 15 ARG HDy A 17 GLN HGy 1.0 . 5.09 900 768 A 18 GLY H A 17 GLN HGy 1.0 . 5.01 901 769 A 17 GLN H A 17 GLN HGy 1.0 . 4.38 902 770 A 17 GLN HGy A 15 ARG HGx 1.0 . 4.92 903 771 A 17 GLN HA A 17 GLN HGy 1.0 . 4.25 904 772 A 15 ARG HGy A 17 GLN HGy 1.0 . 5.50 905 773 A 17 GLN H A 17 GLN HGx 1.0 . 4.60 906 774 A 18 GLY H A 17 GLN HGx 1.0 . 4.91 907 775 A 79 MET HBy A 84 VAL HGx% 1.0 . 4.30 908 776 A 79 MET HBx A 84 VAL HGy% 1.0 . 5.19 909 777 A 66 GLN HA A 66 GLN HGy 1.0 . 3.42 910 778 A 66 GLN H A 66 GLN HGy 1.0 . 3.82 911 779 A 81 GLN H A 81 GLN HGx 1.0 . 3.75 912 779 A 81 GLN H A 81 GLN HGy 1.0 . 3.75 913 780 A 67 ASP H A 66 GLN HGx 1.0 . 4.92 914 781 A 66 GLN HA A 66 GLN HGx 1.0 . 3.48 915 782 A 81 GLN HBx A 81 GLN HGx 1.0 . 2.63 916 782 A 81 GLN HGy A 81 GLN HBx 1.0 . 2.63 917 783 A 66 GLN H A 66 GLN HGx 1.0 . 3.93 918 784 A 79 MET H A 79 MET HBy 1.0 . 4.17 919 785 A 79 MET HBy A 84 VAL HGy% 1.0 . 5.26 920 786 A 16 ALA H A 15 ARG HBx 1.0 . 5.18 921 787 A 15 ARG HBx A 59 LEU HDx% 1.0 . 4.44 922 787 A 59 LEU HDy% A 15 ARG HBx 1.0 . 4.44 923 788 A 14 ILE HA A 15 ARG HBx 1.0 . 5.22 924 789 A 74 LYS HA A 77 MET HBy 1.0 . 3.53 925 790 A 77 MET HBy A 74 LYS HDx 1.0 . 4.85 926 790 A 77 MET HBy A 74 LYS HDy 1.0 . 4.85 927 791 A 77 MET H A 77 MET HBy 1.0 . 3.83 928 792 A 102 GLN HA A 102 GLN HGx 1.0 . 3.54 929 793 A 102 GLN H A 102 GLN HGx 1.0 . 3.76 930 794 A 62 MET HGx A 63 GLU H 1.0 . 4.74 931 795 A 62 MET HGx A 64 SER H 1.0 . 5.26 932 796 A 68 VAL HA A 62 MET HGx 1.0 . 5.39 933 797 A 11 VAL H A 11 VAL HB 1.0 . 3.09 934 798 A 78 TYR H A 77 MET HBy 1.0 . 4.44 935 799 A 78 TYR H A 77 MET HBx 1.0 . 4.42 936 800 A 77 MET H A 77 MET HBx 1.0 . 3.88 937 801 A 69 GLN HBy A 69 GLN HGy 1.0 . 2.84 938 801 A 69 GLN HGx A 69 GLN HBy 1.0 . 2.84 939 802 A 68 VAL HGy% A 69 GLN HGy 1.0 . 4.49 940 802 A 68 VAL HGy% A 69 GLN HGx 1.0 . 4.49 941 803 A 66 GLN HA A 69 GLN HGy 1.0 . 3.98 942 803 A 69 GLN HGx A 66 GLN HA 1.0 . 3.98 943 804 A 62 MET HGx A 67 ASP HBx 1.0 . 3.84 944 804 A 67 ASP HBy A 62 MET HGx 1.0 . 3.84 945 805 A 12 PHE H A 11 VAL HB 1.0 . 4.13 946 806 A 84 VAL H A 84 VAL HB 1.0 . 3.44 947 807 A 31 PHE HZ A 84 VAL HB 1.0 . 3.98 948 808 A 49 ASN HBx A 53 LYS HBx 1.0 . 5.12 949 808 A 49 ASN HBx A 53 LYS HBy 1.0 . 5.12 950 809 A 54 ARG H A 53 LYS HBx 1.0 . 4.21 951 809 A 54 ARG H A 53 LYS HBy 1.0 . 4.21 952 810 A 49 ASN HD2y A 53 LYS HBx 1.0 . 5.48 953 810 A 53 LYS HBy A 49 ASN HD2y 1.0 . 5.48 954 811 A 49 ASN HD2x A 53 LYS HBx 1.0 . 4.70 955 811 A 49 ASN HD2x A 53 LYS HBy 1.0 . 4.70 956 812 A 53 LYS HEy A 53 LYS HBx 1.0 . 5.01 957 812 A 53 LYS HBy A 53 LYS HEy 1.0 . 5.01 958 813 A 68 VAL HA A 62 MET HBy 1.0 . 4.51 959 814 A 62 MET HBy A 68 VAL HGx% 1.0 . 4.86 960 815 A 62 MET HBy A 63 GLU H 1.0 . 5.40 961 816 A 68 VAL HA A 62 MET HBx 1.0 . 4.08 962 817 A 62 MET HBx A 68 VAL HGx% 1.0 . 4.25 963 818 A 104 LYS H A 104 LYS HBy 1.0 . 3.56 964 819 A 25 MET HGy A 41 GLU HA 1.0 . 4.48 965 820 A 17 GLN H A 17 GLN HBy 1.0 . 4.13 966 821 A 14 ILE H A 62 MET HBx 1.0 . 4.58 967 822 A 17 GLN HBy A 17 GLN HE2x 1.0 . 4.88 968 823 A 17 GLN H A 17 GLN HBx 1.0 . 4.04 969 824 A 9 ASP H A 8 VAL HB 1.0 . 3.34 970 825 A 17 GLN HBx A 17 GLN HE2x 1.0 . 4.82 971 826 A 97 LEU H A 98 MET HGx 1.0 . 5.42 972 827 A 98 MET H A 98 MET HGy 1.0 . 3.58 973 828 A 98 MET HA A 98 MET HGy 1.0 . 3.90 974 829 A 97 LEU HBx A 98 MET HGy 1.0 . 5.23 975 830 A 99 LYS H A 98 MET HGy 1.0 . 4.93 976 831 A 98 MET HGy A 97 LEU HA 1.0 . 5.41 977 832 A 101 LEU HDx% A 98 MET HGy 1.0 . 5.50 978 833 A 98 MET HGx A 97 LEU HBx 1.0 . 5.30 979 834 A 98 MET HGx A 98 MET HA 1.0 . 3.89 980 835 A 99 LYS H A 98 MET HGx 1.0 . 5.12 981 836 A 71 ALA H A 70 LYS HBx 1.0 . 4.44 982 836 A 71 ALA H A 70 LYS HBy 1.0 . 4.44 983 837 A 70 LYS H A 70 LYS HBx 1.0 . 3.34 984 837 A 70 LYS H A 70 LYS HBy 1.0 . 3.34 985 838 A 99 LYS HA A 99 LYS HBx 1.0 . 2.79 986 838 A 99 LYS HBy A 99 LYS HA 1.0 . 2.79 987 839 A 97 LEU H A 98 MET HGy 1.0 . 5.32 988 840 A 61 GLU HBy A 13 LEU HDx% 1.0 . 5.15 989 840 A 61 GLU HBy A 13 LEU HDy% 1.0 . 5.15 990 841 A 61 GLU HBx A 38 ARG HDx 1.0 . 5.42 991 841 A 61 GLU HBx A 38 ARG HDy 1.0 . 5.42 992 842 A 61 GLU HBx A 61 GLU H 1.0 . 3.97 993 843 A 98 MET H A 99 LYS HBx 1.0 . 5.04 994 843 A 99 LYS HBy A 98 MET H 1.0 . 5.04 995 844 A 56 GLY H A 55 ARG HBx 1.0 . 4.81 996 845 A 55 ARG H A 55 ARG HBx 1.0 . 4.10 997 846 A 57 ASP H A 55 ARG HBx 1.0 . 4.82 998 847 A 72 LEU HA A 75 HIS HBy 1.0 . 4.81 999 848 A 86 VAL HB A 75 HIS HBy 1.0 . 4.75 1000 849 A 75 HIS H A 75 HIS HBy 1.0 . 3.96 1001 850 A 75 HIS HBx A 86 VAL HGy% 1.0 . 5.50 1002 851 A 75 HIS H A 75 HIS HBx 1.0 . 3.94 1003 852 A 26 GLU HA A 25 MET HBy 1.0 . 5.15 1004 853 A 44 ILE HD1% A 25 MET HBy 1.0 . 4.96 1005 854 A 61 GLU HBy A 61 GLU H 1.0 . 4.00 1006 855 A 61 GLU HBy A 38 ARG HDx 1.0 . 5.33 1007 855 A 61 GLU HBy A 38 ARG HDy 1.0 . 5.33 1008 856 A 61 GLU HBy A 60 ILE HG2% 1.0 . 5.50 1009 857 A 95 ASP H A 94 VAL HB 1.0 . 3.36 1010 858 A 94 VAL H A 94 VAL HB 1.0 . 3.13 1011 859 A 93 ASP HA A 94 VAL HB 1.0 . 5.43 1012 860 A 93 ASP H A 94 VAL HB 1.0 . 4.61 1013 861 A 44 ILE HD1% A 25 MET HBx 1.0 . 4.18 1014 862 A 26 GLU H A 25 MET HBx 1.0 . 4.07 1015 863 A 26 GLU HA A 25 MET HBx 1.0 . 5.30 1016 864 A 25 MET HBy A 24 THR HA 1.0 . 4.51 1017 865 A 79 MET HGy A 80 GLY H 1.0 . 5.14 1018 866 A 91 ASN HA A 94 VAL HB 1.0 . 3.72 1019 867 A 25 MET HA A 28 VAL HB 1.0 . 3.97 1020 868 A 31 PHE HD% A 79 MET HGy 1.0 . 4.91 1021 869 A 79 MET HA A 79 MET HGy 1.0 . 3.77 1022 870 A 80 GLY H A 79 MET HGx 1.0 . 5.23 1023 871 A 84 VAL HGx% A 79 MET HGx 1.0 . 5.50 1024 872 A 69 GLN H A 68 VAL HB 1.0 . 3.88 1025 873 A 88 GLU H A 88 GLU HBy 1.0 . 3.32 1026 874 A 89 ILE H A 88 GLU HBy 1.0 . 4.00 1027 875 A 72 LEU HDy% A 88 GLU HBy 1.0 . 3.80 1028 876 A 72 LEU HDx% A 88 GLU HBy 1.0 . 4.11 1029 877 A 72 LEU HDy% A 88 GLU HBx 1.0 . 3.69 1030 878 A 72 LEU HDx% A 88 GLU HBx 1.0 . 4.03 1031 879 A 74 LYS HBy A 32 PHE HE% 1.0 . 5.35 1032 880 A 31 PHE HE% A 74 LYS HBy 1.0 . 4.91 1033 881 A 31 PHE HE% A 74 LYS HBx 1.0 . 5.37 1034 882 A 74 LYS HBx A 31 PHE HZ 1.0 . 4.94 1035 883 A 63 GLU HBy A 36 ARG HDx 1.0 . 5.27 1036 883 A 36 ARG HDy A 63 GLU HBy 1.0 . 5.27 1037 884 A 99 LYS H A 98 MET HBx 1.0 . 4.04 1038 885 A 54 ARG H A 54 ARG HBx 1.0 . 3.88 1039 885 A 54 ARG H A 54 ARG HBy 1.0 . 3.88 1040 886 A 55 ARG HDy A 54 ARG HBx 1.0 . 5.26 1041 886 A 55 ARG HDy A 54 ARG HBy 1.0 . 5.26 1042 887 A 36 ARG H A 35 CYS HBy 1.0 . 4.32 1043 888 A 32 PHE HBy A 35 CYS HBy 1.0 . 4.09 1044 889 A 35 CYS HBx A 32 PHE HBy 1.0 . 4.85 1045 890 A 71 ALA H A 35 CYS HBx 1.0 . 5.19 1046 891 A 35 CYS HBx A 35 CYS H 1.0 . 4.06 1047 892 A 98 MET HBy A 94 VAL HGx% 1.0 . 5.02 1048 892 A 94 VAL HGy% A 98 MET HBy 1.0 . 5.02 1049 893 A 63 GLU HBy A 38 ARG HA 1.0 . 5.11 1050 894 A 64 SER H A 63 GLU HBy 1.0 . 4.41 1051 895 A 37 ILE HD1% A 35 CYS HBy 1.0 . 4.92 1052 896 A 35 CYS HBy A 32 PHE HA 1.0 . 5.13 1053 897 A 35 CYS HBx A 37 ILE HD1% 1.0 . 5.31 1054 898 A 35 CYS HBx A 32 PHE HD% 1.0 . 5.46 1055 899 A 5 GLU HA A 5 GLU HBx 1.0 . 2.92 1056 900 A 61 GLU HBy A 38 ARG HBy 1.0 . 4.20 1057 901 A 61 GLU HBx A 38 ARG HBy 1.0 . 4.56 1058 902 A 38 ARG HBy A 39 ASN H 1.0 . 5.08 1059 903 A 38 ARG HBy A 61 GLU H 1.0 . 5.50 1060 904 A 38 ARG HBy A 38 ARG HDx 1.0 . 3.98 1061 904 A 38 ARG HBy A 38 ARG HDy 1.0 . 3.98 1062 905 A 38 ARG H A 38 ARG HBx 1.0 . 3.69 1063 906 A 38 ARG HBx A 37 ILE HA 1.0 . 4.48 1064 907 A 7 GLU HA A 7 GLU HBy 1.0 . 3.02 1065 908 A 7 GLU H A 6 GLU HBy 1.0 . 3.14 1066 909 A 8 VAL H A 7 GLU HBy 1.0 . 4.67 1067 910 A 38 ARG HBy A 62 MET HA 1.0 . 5.15 1068 911 A 62 MET HA A 38 ARG HBx 1.0 . 4.79 1069 912 A 5 GLU H A 5 GLU HBx 1.0 . 3.48 1070 913 A 49 ASN HBy A 50 ARG HBx 1.0 . 5.26 1071 913 A 49 ASN HBy A 50 ARG HBy 1.0 . 5.26 1072 914 A 81 GLN H A 81 GLN HBx 1.0 . 3.87 1073 915 A 82 ARG H A 81 GLN HBy 1.0 . 4.94 1074 916 A 70 LYS HA A 73 GLU HBx 1.0 . 4.09 1075 916 A 73 GLU HBy A 70 LYS HA 1.0 . 4.09 1076 917 A 25 MET HGy A 41 GLU HBx 1.0 . 3.98 1077 917 A 41 GLU HBy A 25 MET HGy 1.0 . 3.98 1078 918 A 41 GLU HA A 41 GLU HBx 1.0 . 3.00 1079 918 A 41 GLU HBy A 41 GLU HA 1.0 . 3.00 1080 919 A 41 GLU HBx A 41 GLU HGx 1.0 . 2.49 1081 919 A 41 GLU HBy A 41 GLU HGx 1.0 . 2.49 1082 919 A 41 GLU HGy A 41 GLU HBx 1.0 . 2.49 1083 919 A 41 GLU HBy A 41 GLU HGy 1.0 . 2.49 1084 920 A 29 LEU HDy% A 41 GLU HBx 1.0 . 3.78 1085 920 A 29 LEU HDx% A 41 GLU HBx 1.0 . 3.78 1086 920 A 41 GLU HBy A 29 LEU HDx% 1.0 . 3.78 1087 920 A 41 GLU HBy A 29 LEU HDy% 1.0 . 3.78 1088 921 A 90 ASN HBx A 92 GLU HBy 1.0 . 5.17 1089 922 A 92 GLU H A 92 GLU HBy 1.0 . 3.38 1090 923 A 93 ASP H A 92 GLU HBy 1.0 . 3.97 1091 924 A 74 LYS H A 73 GLU HBx 1.0 . 3.95 1092 924 A 74 LYS H A 73 GLU HBy 1.0 . 3.95 1093 925 A 99 LYS HA A 102 GLN HBy 1.0 . 4.28 1094 926 A 27 ASP H A 26 GLU HBy 1.0 . 3.68 1095 927 A 102 GLN HBx A 99 LYS HA 1.0 . 4.48 1096 928 A 102 GLN HBx A 102 GLN HE2y 1.0 . 5.22 1097 929 A 66 GLN H A 65 GLU HBy 1.0 . 4.29 1098 930 A 26 GLU HBx A 29 LEU HDx% 1.0 . 4.91 1099 930 A 29 LEU HDy% A 26 GLU HBx 1.0 . 4.91 1100 931 A 104 LYS HGy A 104 LYS HDx 1.0 . 2.46 1101 931 A 104 LYS HGy A 104 LYS HDy 1.0 . 2.46 1102 932 A 60 ILE HG2% A 37 ILE HG1y 1.0 . 4.42 1103 933 A 37 ILE H A 37 ILE HG1y 1.0 . 3.83 1104 934 A 37 ILE HA A 37 ILE HG1y 1.0 . 4.02 1105 935 A 38 ARG H A 37 ILE HG1x 1.0 . 4.65 1106 936 A 62 MET HA A 37 ILE HG1x 1.0 . 5.12 1107 937 A 102 GLN H A 102 GLN HBy 1.0 . 3.79 1108 938 A 104 LYS HA A 104 LYS HDx 1.0 . 4.30 1109 938 A 104 LYS HDy A 104 LYS HA 1.0 . 4.30 1110 939 A 70 LYS HA A 70 LYS HDx 1.0 . 3.55 1111 940 A 99 LYS H A 99 LYS HDx 1.0 . 4.73 1112 941 A 37 ILE H A 36 ARG HBx 1.0 . 4.24 1113 942 A 36 ARG H A 37 ILE HG1y 1.0 . 4.77 1114 943 A 37 ILE H A 37 ILE HG1x 1.0 . 4.09 1115 944 A 60 ILE HG2% A 37 ILE HG1x 1.0 . 4.30 1116 945 A 36 ARG HBy A 36 ARG HDx 1.0 . 4.19 1117 945 A 36 ARG HDy A 36 ARG HBy 1.0 . 4.19 1118 946 A 37 ILE H A 36 ARG HBy 1.0 . 4.85 1119 947 A 66 GLN H A 65 GLU HBx 1.0 . 3.86 1120 948 A 12 PHE HD% A 65 GLU HBx 1.0 . 4.93 1121 949 A 65 GLU HBx A 64 SER HA 1.0 . 5.02 1122 950 A 64 SER HBy A 65 GLU HBx 1.0 . 4.81 1123 951 A 53 LYS H A 53 LYS HDx 1.0 . 4.07 1124 952 A 53 LYS HA A 53 LYS HDx 1.0 . 3.80 1125 953 A 54 ARG H A 53 LYS HDx 1.0 . 4.70 1126 954 A 45 HIS HBy A 59 LEU HDx% 1.0 . 4.67 1127 954 A 59 LEU HDy% A 45 HIS HBy 1.0 . 4.67 1128 955 A 45 HIS HBy A 46 PHE H 1.0 . 5.23 1129 956 A 59 LEU H A 45 HIS HBx 1.0 . 4.69 1130 957 A 59 LEU HBy A 45 HIS HBx 1.0 . 4.52 1131 958 A 45 HIS H A 44 ILE HG1x 1.0 . 5.50 1132 959 A 23 CYS HBy A 24 THR HA 1.0 . 4.47 1133 960 A 23 CYS HBy A 19 LEU HBy 1.0 . 4.83 1134 961 A 24 THR H A 23 CYS HBx 1.0 . 4.09 1135 962 A 23 CYS HBx A 20 PRO HDx 1.0 . 4.52 1136 963 A 65 GLU H A 66 GLN HBy 1.0 . 5.32 1137 964 A 68 VAL H A 66 GLN HBx 1.0 . 4.88 1138 965 A 15 ARG HGy A 15 ARG HA 1.0 . 4.21 1139 966 A 15 ARG HGy A 15 ARG H 1.0 . 5.37 1140 967 A 15 ARG HGx A 59 LEU HDx% 1.0 . 4.66 1141 967 A 59 LEU HDy% A 15 ARG HGx 1.0 . 4.66 1142 968 A 16 ALA H A 15 ARG HGx 1.0 . 4.80 1143 969 A 45 HIS H A 60 ILE HG1x 1.0 . 4.92 1144 969 A 60 ILE HG1y A 45 HIS H 1.0 . 4.92 1145 970 A 44 ILE HA A 60 ILE HG1x 1.0 . 4.21 1146 970 A 60 ILE HG1y A 44 ILE HA 1.0 . 4.21 1147 971 A 44 ILE HG2% A 60 ILE HG1x 1.0 . 4.70 1148 971 A 60 ILE HG1y A 44 ILE HG2% 1.0 . 4.70 1149 972 A 44 ILE HA A 44 ILE HG1x 1.0 . 4.11 1150 973 A 44 ILE H A 44 ILE HG1x 1.0 . 4.53 1151 974 A 28 VAL HGx% A 44 ILE HG1x 1.0 . 5.17 1152 975 A 23 CYS HBy A 20 PRO HGx 1.0 . 4.94 1153 975 A 20 PRO HGy A 23 CYS HBy 1.0 . 4.94 1154 976 A 23 CYS HBx A 20 PRO HGx 1.0 . 4.29 1155 976 A 20 PRO HGy A 23 CYS HBx 1.0 . 4.29 1156 977 A 23 CYS HBx A 19 LEU HBy 1.0 . 4.59 1157 978 A 66 GLN HBx A 70 LYS HEx 1.0 . 5.09 1158 979 A 66 GLN H A 66 GLN HBx 1.0 . 3.16 1159 980 A 69 GLN H A 69 GLN HBy 1.0 . 3.64 1160 981 A 69 GLN HBx A 66 GLN HA 1.0 . 3.61 1161 982 A 19 LEU HDy% A 20 PRO HGx 1.0 . 5.40 1162 982 A 20 PRO HGy A 19 LEU HDy% 1.0 . 5.40 1163 983 A 72 LEU HDy% A 69 GLN HBy 1.0 . 5.44 1164 984 A 48 LEU HDx% A 54 ARG HGy 1.0 . 4.48 1165 985 A 47 LEU HA A 47 LEU HG 1.0 . 3.99 1166 986 A 47 LEU H A 47 LEU HG 1.0 . 3.61 1167 987 A 54 ARG HA A 54 ARG HGx 1.0 . 3.99 1168 988 A 55 ARG HDy A 54 ARG HGx 1.0 . 4.06 1169 989 A 54 ARG HGx A 48 LEU HDx% 1.0 . 4.19 1170 990 A 74 LYS HDx A 77 MET HGx 1.0 . 4.16 1171 990 A 74 LYS HDy A 77 MET HGx 1.0 . 4.16 1172 990 A 77 MET HGy A 74 LYS HDx 1.0 . 4.16 1173 990 A 77 MET HGy A 74 LYS HDy 1.0 . 4.16 1174 991 A 74 LYS H A 74 LYS HDx 1.0 . 4.40 1175 991 A 74 LYS H A 74 LYS HDy 1.0 . 4.40 1176 992 A 71 ALA HA A 74 LYS HDx 1.0 . 4.57 1177 992 A 74 LYS HDy A 71 ALA HA 1.0 . 4.57 1178 993 A 31 PHE HE% A 74 LYS HDx 1.0 . 5.30 1179 993 A 31 PHE HE% A 74 LYS HDy 1.0 . 5.30 1180 994 A 19 LEU H A 19 LEU HG 1.0 . 3.53 1181 995 A 50 ARG H A 50 ARG HGx 1.0 . 3.73 1182 995 A 50 ARG H A 50 ARG HGy 1.0 . 3.73 1183 996 A 19 LEU HG A 19 LEU HA 1.0 . 4.23 1184 997 A 49 ASN HBy A 50 ARG HGx 1.0 . 5.08 1185 997 A 49 ASN HBy A 50 ARG HGy 1.0 . 5.08 1186 998 A 51 ASP H A 50 ARG HGx 1.0 . 4.06 1187 998 A 51 ASP H A 50 ARG HGy 1.0 . 4.06 1188 999 A 50 ARG HA A 50 ARG HGx 1.0 . 3.40 1189 999 A 50 ARG HGy A 50 ARG HA 1.0 . 3.40 1190 1000 A 50 ARG HBx A 50 ARG HGx 1.0 . 2.41 1191 1000 A 50 ARG HBy A 50 ARG HGx 1.0 . 2.41 1192 1000 A 50 ARG HGy A 50 ARG HBx 1.0 . 2.41 1193 1000 A 50 ARG HBy A 50 ARG HGy 1.0 . 2.41 1194 1001 A 97 LEU H A 97 LEU HG 1.0 . 3.61 1195 1002 A 29 LEU HA A 29 LEU HG 1.0 . 3.59 1196 1003 A 39 ASN H A 38 ARG HGx 1.0 . 4.34 1197 1003 A 39 ASN H A 38 ARG HGy 1.0 . 4.34 1198 1004 A 38 ARG HA A 38 ARG HGx 1.0 . 3.98 1199 1004 A 38 ARG HGy A 38 ARG HA 1.0 . 3.98 1200 1005 A 63 GLU HA A 38 ARG HGx 1.0 . 4.61 1201 1005 A 38 ARG HGy A 63 GLU HA 1.0 . 4.61 1202 1006 A 90 ASN H A 89 ILE HG1x 1.0 . 4.92 1203 1006 A 90 ASN H A 89 ILE HG1y 1.0 . 4.92 1204 1007 A 89 ILE H A 89 ILE HG1x 1.0 . 3.95 1205 1007 A 89 ILE H A 89 ILE HG1y 1.0 . 3.95 1206 1008 A 75 HIS HBy A 72 LEU HG 1.0 . 5.11 1207 1009 A 15 ARG H A 14 ILE HG1y 1.0 . 4.47 1208 1010 A 14 ILE HA A 89 ILE HG1x 1.0 . 4.12 1209 1010 A 14 ILE HA A 89 ILE HG1y 1.0 . 4.12 1210 1011 A 62 MET HBx A 14 ILE HG1y 1.0 . 5.11 1211 1012 A 14 ILE H A 14 ILE HG1x 1.0 . 3.74 1212 1013 A 62 MET HBx A 14 ILE HG1x 1.0 . 4.98 1213 1014 A 23 CYS HBx A 19 LEU HDx% 1.0 . 5.50 1214 1015 A 73 GLU H A 72 LEU HG 1.0 . 5.24 1215 1016 A 14 ILE HD1% A 72 LEU HG 1.0 . 5.29 1216 1017 A 82 ARG HGy A 82 ARG HA 1.0 . 4.25 1217 1018 A 82 ARG H A 82 ARG HGx 1.0 . 4.29 1218 1019 A 60 ILE H A 14 ILE HG1y 1.0 . 4.48 1219 1020 A 14 ILE H A 14 ILE HG1y 1.0 . 3.97 1220 1021 A 60 ILE H A 14 ILE HG1x 1.0 . 4.27 1221 1022 A 57 ASP HA A 19 LEU HDx% 1.0 . 4.31 1222 1023 A 58 ALA H A 19 LEU HDx% 1.0 . 4.30 1223 1024 A 19 LEU HDx% A 19 LEU HA 1.0 . 4.45 1224 1025 A 19 LEU HDx% A 20 PRO HDx 1.0 . 5.50 1225 1026 A 13 LEU HA A 14 ILE HG1x 1.0 . 3.69 1226 1027 A 100 SER H A 101 LEU HG 1.0 . 5.09 1227 1028 A 101 LEU HG A 101 LEU HA 1.0 . 3.65 1228 1029 A 101 LEU H A 101 LEU HG 1.0 . 3.38 1229 1030 A 102 GLN H A 101 LEU HG 1.0 . 4.82 1230 1031 A 72 LEU HBy A 72 LEU HDy% 1.0 . 2.73 1231 1032 A 13 LEU H A 13 LEU HDx% 1.0 . 4.09 1232 1032 A 13 LEU H A 13 LEU HDy% 1.0 . 4.09 1233 1033 A 98 MET HGx A 13 LEU HDx% 1.0 . 5.38 1234 1033 A 98 MET HGx A 13 LEU HDy% 1.0 . 5.38 1235 1034 A 13 LEU HBy A 13 LEU HDx% 1.0 . 3.21 1236 1034 A 13 LEU HBy A 13 LEU HDy% 1.0 . 3.21 1237 1035 A 88 GLU H A 72 LEU HDy% 1.0 . 4.33 1238 1036 A 72 LEU HDy% A 87 TYR HA 1.0 . 5.48 1239 1037 A 72 LEU HDy% A 69 GLN HA 1.0 . 3.21 1240 1038 A 72 LEU HBx A 72 LEU HDy% 1.0 . 3.13 1241 1039 A 98 MET HGy A 13 LEU HDx% 1.0 . 5.50 1242 1039 A 13 LEU HDy% A 98 MET HGy 1.0 . 5.50 1243 1040 A 99 LYS HGy A 98 MET H 1.0 . 5.35 1244 1041 A 99 LYS HGy A 99 LYS HEx 1.0 . 3.77 1245 1041 A 99 LYS HGy A 99 LYS HEy 1.0 . 3.77 1246 1042 A 99 LYS H A 99 LYS HGx 1.0 . 3.83 1247 1043 A 89 ILE HB A 13 LEU HDx% 1.0 . 3.01 1248 1043 A 89 ILE HB A 13 LEU HDy% 1.0 . 3.01 1249 1044 A 66 GLN H A 64 SER HBy 1.0 . 5.00 1250 1045 A 71 ALA H A 70 LYS HGx 1.0 . 5.36 1251 1046 A 97 LEU H A 97 LEU HDx% 1.0 . 4.06 1252 1047 A 94 VAL HA A 97 LEU HDx% 1.0 . 3.68 1253 1048 A 48 LEU HDy% A 53 LYS H 1.0 . 4.73 1254 1049 A 48 LEU HDy% A 52 GLY HAx 1.0 . 3.61 1255 1050 A 48 LEU HDy% A 52 GLY H 1.0 . 4.83 1256 1051 A 48 LEU HDy% A 48 LEU HA 1.0 . 4.21 1257 1052 A 48 LEU HDy% A 52 GLY HAy 1.0 . 4.27 1258 1053 A 98 MET HA A 101 LEU HDx% 1.0 . 3.50 1259 1054 A 45 HIS HBy A 101 LEU HDx% 1.0 . 4.76 1260 1055 A 45 HIS HBx A 101 LEU HDx% 1.0 . 4.88 1261 1056 A 101 LEU HBx A 101 LEU HDx% 1.0 . 3.33 1262 1057 A 101 LEU HDx% A 97 LEU HDy% 1.0 . 3.54 1263 1058 A 98 MET H A 101 LEU HDx% 1.0 . 5.50 1264 1059 A 101 LEU H A 101 LEU HDx% 1.0 . 4.12 1265 1060 A 101 LEU HDx% A 97 LEU HA 1.0 . 5.50 1266 1061 A 51 ASP HBy A 53 LYS HGy 1.0 . 4.80 1267 1062 A 53 LYS H A 53 LYS HGy 1.0 . 3.92 1268 1063 A 53 LYS HA A 53 LYS HGy 1.0 . 3.93 1269 1064 A 53 LYS HEy A 53 LYS HGy 1.0 . 4.02 1270 1065 A 54 ARG H A 53 LYS HGy 1.0 . 4.81 1271 1066 A 51 ASP HBx A 53 LYS HGy 1.0 . 5.33 1272 1067 A 45 HIS HD2 A 101 LEU HDx% 1.0 . 5.50 1273 1068 A 28 VAL HA A 31 PHE HBx 1.0 . 4.44 1274 1069 A 105 SER H A 104 LYS HGy 1.0 . 4.34 1275 1070 A 74 LYS H A 74 LYS HGy 1.0 . 3.87 1276 1071 A 74 LYS HA A 74 LYS HGy 1.0 . 4.08 1277 1072 A 71 ALA HA A 74 LYS HGy 1.0 . 4.30 1278 1073 A 74 LYS HGy A 77 MET HGx 1.0 . 5.36 1279 1073 A 77 MET HGy A 74 LYS HGy 1.0 . 5.36 1280 1074 A 32 PHE HD% A 74 LYS HGy 1.0 . 4.84 1281 1075 A 74 LYS HGx A 32 PHE HE% 1.0 . 5.50 1282 1076 A 74 LYS HGx A 71 ALA HA 1.0 . 4.73 1283 1077 A 74 LYS HGx A 32 PHE HD% 1.0 . 4.76 1284 1078 A 31 PHE HE% A 74 LYS HGy 1.0 . 5.50 1285 1079 A 29 LEU H A 28 VAL HGy% 1.0 . 4.08 1286 1080 A 28 VAL H A 28 VAL HGy% 1.0 . 3.17 1287 1081 A 25 MET HA A 28 VAL HGy% 1.0 . 3.85 1288 1082 A 28 VAL HA A 28 VAL HGy% 1.0 . 3.19 1289 1083 A 27 ASP HBy A 28 VAL HGy% 1.0 . 4.09 1290 1084 A 25 MET HGy A 28 VAL HGy% 1.0 . 5.35 1291 1085 A 28 VAL HGy% A 29 LEU HDx% 1.0 . 3.65 1292 1085 A 29 LEU HDy% A 28 VAL HGy% 1.0 . 3.65 1293 1086 A 44 ILE HG2% A 28 VAL HGy% 1.0 . 3.95 1294 1087 A 27 ASP H A 28 VAL HGy% 1.0 . 4.54 1295 1088 A 29 LEU HA A 28 VAL HGy% 1.0 . 5.20 1296 1089 A 97 LEU H A 97 LEU HDy% 1.0 . 4.06 1297 1090 A 97 LEU HA A 97 LEU HDy% 1.0 . 3.08 1298 1091 A 41 GLU H A 29 LEU HDx% 1.0 . 4.20 1299 1091 A 41 GLU H A 29 LEU HDy% 1.0 . 4.20 1300 1092 A 29 LEU HA A 29 LEU HDx% 1.0 . 2.77 1301 1092 A 29 LEU HA A 29 LEU HDy% 1.0 . 2.77 1302 1093 A 40 GLY HAx A 29 LEU HDx% 1.0 . 4.11 1303 1093 A 29 LEU HDy% A 40 GLY HAx 1.0 . 4.11 1304 1094 A 29 LEU HBx A 29 LEU HDx% 1.0 . 2.99 1305 1094 A 29 LEU HBx A 29 LEU HDy% 1.0 . 2.99 1306 1095 A 29 LEU HDy% A 41 GLU HGx 1.0 . 4.77 1307 1095 A 29 LEU HDx% A 41 GLU HGx 1.0 . 4.77 1308 1095 A 41 GLU HGy A 29 LEU HDx% 1.0 . 4.77 1309 1095 A 29 LEU HDy% A 41 GLU HGy 1.0 . 4.77 1310 1096 A 69 GLN H A 68 VAL HGx% 1.0 . 3.90 1311 1097 A 12 PHE HA A 68 VAL HGx% 1.0 . 4.16 1312 1098 A 68 VAL HA A 68 VAL HGx% 1.0 . 3.21 1313 1099 A 68 VAL HGx% A 71 ALA HB% 1.0 . 4.69 1314 1100 A 13 LEU H A 68 VAL HGx% 1.0 . 4.18 1315 1101 A 12 PHE H A 68 VAL HGx% 1.0 . 5.21 1316 1102 A 68 VAL H A 68 VAL HGx% 1.0 . 3.16 1317 1103 A 68 VAL HGx% A 65 GLU HA 1.0 . 3.52 1318 1104 A 68 VAL HGx% A 12 PHE HBx 1.0 . 3.10 1319 1104 A 12 PHE HBy A 68 VAL HGx% 1.0 . 3.10 1320 1105 A 68 VAL HGx% A 65 GLU HGx 1.0 . 3.73 1321 1105 A 68 VAL HGx% A 65 GLU HGy 1.0 . 3.73 1322 1106 A 62 MET HGx A 68 VAL HGx% 1.0 . 3.57 1323 1107 A 14 ILE HD1% A 68 VAL HGx% 1.0 . 4.99 1324 1108 A 19 LEU HDy% A 19 LEU HA 1.0 . 3.29 1325 1109 A 19 LEU HDy% A 20 PRO HDy 1.0 . 4.20 1326 1110 A 19 LEU HDy% A 20 PRO HDx 1.0 . 4.11 1327 1111 A 19 LEU HBx A 19 LEU HDy% 1.0 . 3.75 1328 1112 A 19 LEU HDy% A 16 ALA HB% 1.0 . 4.03 1329 1113 A 65 GLU H A 68 VAL HGx% 1.0 . 4.81 1330 1114 A 66 GLN H A 68 VAL HGx% 1.0 . 5.50 1331 1115 A 20 PRO HA A 19 LEU HDy% 1.0 . 5.50 1332 1116 A 23 CYS HBx A 19 LEU HDy% 1.0 . 5.19 1333 1117 A 25 MET HA A 28 VAL HGx% 1.0 . 4.52 1334 1118 A 29 LEU H A 28 VAL HGx% 1.0 . 4.19 1335 1119 A 31 PHE H A 28 VAL HGx% 1.0 . 5.50 1336 1120 A 28 VAL HGx% A 32 PHE HE% 1.0 . 3.84 1337 1121 A 29 LEU HA A 28 VAL HGx% 1.0 . 4.11 1338 1122 A 28 VAL HA A 28 VAL HGx% 1.0 . 3.30 1339 1123 A 44 ILE HG1y A 28 VAL HGx% 1.0 . 4.11 1340 1124 A 44 ILE HG2% A 28 VAL HGx% 1.0 . 3.87 1341 1125 A 45 HIS HBx A 47 LEU HDx% 1.0 . 4.89 1342 1125 A 47 LEU HDy% A 45 HIS HBx 1.0 . 4.89 1343 1126 A 48 LEU H A 47 LEU HDx% 1.0 . 3.80 1344 1126 A 47 LEU HDy% A 48 LEU H 1.0 . 3.80 1345 1127 A 47 LEU H A 47 LEU HDx% 1.0 . 3.96 1346 1127 A 47 LEU H A 47 LEU HDy% 1.0 . 3.96 1347 1128 A 47 LEU HA A 47 LEU HDx% 1.0 . 3.03 1348 1128 A 47 LEU HDy% A 47 LEU HA 1.0 . 3.03 1349 1129 A 45 HIS HBy A 47 LEU HDx% 1.0 . 4.62 1350 1129 A 45 HIS HBy A 47 LEU HDy% 1.0 . 4.62 1351 1130 A 47 LEU HBy A 47 LEU HDx% 1.0 . 3.92 1352 1130 A 47 LEU HBy A 47 LEU HDy% 1.0 . 3.92 1353 1131 A 102 GLN H A 101 LEU HDy% 1.0 . 5.07 1354 1132 A 101 LEU H A 101 LEU HDy% 1.0 . 3.79 1355 1133 A 45 HIS HBy A 101 LEU HDy% 1.0 . 4.27 1356 1134 A 101 LEU HBx A 101 LEU HDy% 1.0 . 3.58 1357 1135 A 86 VAL HGx% A 88 GLU HA 1.0 . 4.66 1358 1136 A 86 VAL HGx% A 71 ALA HA 1.0 . 4.98 1359 1137 A 15 ARG H A 86 VAL HGx% 1.0 . 4.46 1360 1138 A 88 GLU H A 86 VAL HGx% 1.0 . 5.50 1361 1139 A 87 TYR H A 86 VAL HGx% 1.0 . 3.58 1362 1140 A 72 LEU H A 86 VAL HGx% 1.0 . 5.03 1363 1141 A 86 VAL HGx% A 32 PHE HE% 1.0 . 3.98 1364 1142 A 86 VAL HGx% A 16 ALA HA 1.0 . 4.34 1365 1143 A 86 VAL HA A 86 VAL HGx% 1.0 . 3.37 1366 1144 A 86 VAL HGx% A 72 LEU HA 1.0 . 3.52 1367 1145 A 86 VAL HGx% A 75 HIS HBy 1.0 . 5.33 1368 1146 A 14 ILE HD1% A 86 VAL HGx% 1.0 . 3.48 1369 1147 A 72 LEU HDx% A 87 TYR HD% 1.0 . 5.50 1370 1148 A 88 GLU H A 72 LEU HDx% 1.0 . 3.39 1371 1149 A 72 LEU HDx% A 87 TYR H 1.0 . 4.60 1372 1150 A 72 LEU HDx% A 72 LEU H 1.0 . 3.69 1373 1151 A 72 LEU HDx% A 73 GLU H 1.0 . 4.89 1374 1152 A 72 LEU HDx% A 87 TYR HA 1.0 . 3.66 1375 1153 A 72 LEU HDx% A 88 GLU HA 1.0 . 4.43 1376 1154 A 72 LEU HDx% A 72 LEU HA 1.0 . 2.88 1377 1155 A 72 LEU HDx% A 72 LEU HBx 1.0 . 3.20 1378 1156 A 72 LEU HDx% A 86 VAL HGy% 1.0 . 4.43 1379 1157 A 14 ILE HD1% A 72 LEU HDx% 1.0 . 4.31 1380 1158 A 55 ARG H A 48 LEU HDx% 1.0 . 4.29 1381 1159 A 101 LEU HA A 101 LEU HDy% 1.0 . 2.64 1382 1160 A 45 HIS HBx A 101 LEU HDy% 1.0 . 3.97 1383 1161 A 48 LEU HDx% A 54 ARG HBx 1.0 . 2.64 1384 1161 A 48 LEU HDx% A 54 ARG HBy 1.0 . 2.64 1385 1162 A 48 LEU H A 48 LEU HDx% 1.0 . 4.43 1386 1163 A 54 ARG H A 48 LEU HDx% 1.0 . 4.00 1387 1164 A 48 LEU HDx% A 53 LYS H 1.0 . 5.19 1388 1165 A 48 LEU HA A 48 LEU HDx% 1.0 . 3.15 1389 1166 A 48 LEU HDx% A 52 GLY HAx 1.0 . 4.78 1390 1167 A 78 TYR HBy A 84 VAL HGx% 1.0 . 5.23 1391 1168 A 44 ILE HA A 58 ALA HB% 1.0 . 5.07 1392 1169 A 79 MET H A 84 VAL HGx% 1.0 . 4.26 1393 1170 A 84 VAL HGx% A 84 VAL H 1.0 . 3.67 1394 1171 A 31 PHE HZ A 84 VAL HGx% 1.0 . 4.65 1395 1172 A 31 PHE HE% A 84 VAL HGx% 1.0 . 4.42 1396 1173 A 31 PHE HD% A 84 VAL HGx% 1.0 . 5.50 1397 1174 A 84 VAL HGx% A 84 VAL HA 1.0 . 3.55 1398 1175 A 84 VAL HGx% A 79 MET HGy 1.0 . 5.12 1399 1176 A 84 VAL HGx% A 79 MET HBx 1.0 . 3.77 1400 1177 A 84 VAL HGx% A 86 VAL HGy% 1.0 . 5.40 1401 1178 A 58 ALA HB% A 58 ALA H 1.0 . 3.58 1402 1179 A 59 LEU H A 58 ALA HB% 1.0 . 3.59 1403 1180 A 46 PHE HD% A 58 ALA HB% 1.0 . 4.21 1404 1181 A 58 ALA HB% A 16 ALA HB% 1.0 . 3.85 1405 1182 A 58 ALA HB% A 44 ILE HG2% 1.0 . 4.31 1406 1183 A 25 MET H A 24 THR HG2% 1.0 . 3.63 1407 1184 A 26 GLU H A 24 THR HG2% 1.0 . 4.12 1408 1185 A 27 ASP H A 24 THR HG2% 1.0 . 4.47 1409 1186 A 24 THR HA A 24 THR HG2% 1.0 . 2.47 1410 1187 A 25 MET HGy A 24 THR HG2% 1.0 . 5.09 1411 1188 A 26 GLU HBx A 24 THR HG2% 1.0 . 5.10 1412 1189 A 25 MET HBy A 24 THR HG2% 1.0 . 5.24 1413 1190 A 26 GLU HBy A 24 THR HG2% 1.0 . 5.50 1414 1191 A 105 SER H A 105 SER HBx 1.0 . 3.87 1415 1191 A 105 SER H A 105 SER HBy 1.0 . 3.87 1416 1192 A 17 GLN H A 86 VAL HGy% 1.0 . 5.16 1417 1193 A 76 ARG H A 86 VAL HGy% 1.0 . 4.52 1418 1194 A 87 TYR H A 86 VAL HGy% 1.0 . 4.40 1419 1195 A 86 VAL HGy% A 32 PHE HE% 1.0 . 3.79 1420 1196 A 31 PHE HZ A 86 VAL HGy% 1.0 . 3.53 1421 1197 A 31 PHE HE% A 86 VAL HGy% 1.0 . 4.69 1422 1198 A 86 VAL HGy% A 16 ALA HA 1.0 . 4.23 1423 1199 A 86 VAL HA A 86 VAL HGy% 1.0 . 3.47 1424 1200 A 86 VAL HGy% A 75 HIS HA 1.0 . 3.56 1425 1201 A 75 HIS HBy A 86 VAL HGy% 1.0 . 4.32 1426 1202 A 84 VAL HGy% A 86 VAL HGy% 1.0 . 3.68 1427 1203 A 14 ILE HD1% A 86 VAL HGy% 1.0 . 5.04 1428 1204 A 74 LYS H A 86 VAL HGy% 1.0 . 4.49 1429 1205 A 72 LEU HA A 86 VAL HGy% 1.0 . 4.38 1430 1206 A 95 ASP H A 94 VAL HGx% 1.0 . 3.72 1431 1206 A 94 VAL HGy% A 95 ASP H 1.0 . 3.72 1432 1207 A 94 VAL H A 94 VAL HGx% 1.0 . 3.86 1433 1207 A 94 VAL H A 94 VAL HGy% 1.0 . 3.86 1434 1208 A 94 VAL HA A 94 VAL HGx% 1.0 . 3.19 1435 1208 A 94 VAL HGy% A 94 VAL HA 1.0 . 3.19 1436 1209 A 98 MET HGy A 94 VAL HGx% 1.0 . 3.71 1437 1209 A 94 VAL HGy% A 98 MET HGy 1.0 . 3.71 1438 1210 A 98 MET HGx A 94 VAL HGx% 1.0 . 3.65 1439 1210 A 94 VAL HGy% A 98 MET HGx 1.0 . 3.65 1440 1211 A 97 LEU H A 94 VAL HGx% 1.0 . 4.95 1441 1211 A 97 LEU H A 94 VAL HGy% 1.0 . 4.95 1442 1212 A 11 VAL HB A 94 VAL HGx% 1.0 . 3.75 1443 1212 A 94 VAL HGy% A 11 VAL HB 1.0 . 3.75 1444 1213 A 13 LEU HA A 11 VAL HGx% 1.0 . 5.04 1445 1213 A 11 VAL HGy% A 13 LEU HA 1.0 . 5.04 1446 1214 A 11 VAL H A 94 VAL HGx% 1.0 . 4.97 1447 1214 A 11 VAL H A 94 VAL HGy% 1.0 . 4.97 1448 1215 A 9 ASP H A 11 VAL HGx% 1.0 . 5.15 1449 1215 A 9 ASP H A 11 VAL HGy% 1.0 . 5.15 1450 1216 A 12 PHE H A 11 VAL HGx% 1.0 . 3.35 1451 1216 A 12 PHE H A 11 VAL HGy% 1.0 . 3.35 1452 1217 A 12 PHE HA A 11 VAL HGx% 1.0 . 3.97 1453 1217 A 12 PHE HA A 11 VAL HGy% 1.0 . 3.97 1454 1218 A 13 LEU HBy A 11 VAL HGx% 1.0 . 3.28 1455 1218 A 13 LEU HBy A 11 VAL HGy% 1.0 . 3.28 1456 1219 A 17 GLN H A 84 VAL HGy% 1.0 . 4.04 1457 1220 A 84 VAL HGy% A 84 VAL H 1.0 . 4.23 1458 1221 A 31 PHE HD% A 84 VAL HGy% 1.0 . 5.14 1459 1222 A 84 VAL HGy% A 16 ALA HA 1.0 . 4.31 1460 1223 A 84 VAL HGy% A 84 VAL HA 1.0 . 3.36 1461 1224 A 97 LEU HDy% A 100 SER HBx 1.0 . 4.44 1462 1224 A 100 SER HBy A 97 LEU HDy% 1.0 . 4.44 1463 1225 A 17 GLN H A 16 ALA HB% 1.0 . 3.63 1464 1226 A 58 ALA H A 16 ALA HB% 1.0 . 4.02 1465 1227 A 16 ALA H A 16 ALA HB% 1.0 . 3.35 1466 1228 A 15 ARG HA A 16 ALA HB% 1.0 . 4.87 1467 1229 A 86 VAL HA A 16 ALA HB% 1.0 . 4.39 1468 1230 A 86 VAL HGy% A 16 ALA HB% 1.0 . 4.05 1469 1231 A 16 ALA HB% A 60 ILE HG1x 1.0 . 3.15 1470 1231 A 60 ILE HG1y A 16 ALA HB% 1.0 . 3.15 1471 1232 A 60 ILE HD1% A 16 ALA HB% 1.0 . 3.58 1472 1233 A 11 VAL H A 11 VAL HGx% 1.0 . 3.13 1473 1233 A 11 VAL HGy% A 11 VAL H 1.0 . 3.13 1474 1234 A 11 VAL HA A 11 VAL HGx% 1.0 . 2.98 1475 1234 A 11 VAL HGy% A 11 VAL HA 1.0 . 2.98 1476 1235 A 101 LEU HG A 100 SER HBx 1.0 . 5.16 1477 1235 A 100 SER HBy A 101 LEU HG 1.0 . 5.16 1478 1236 A 101 LEU HDy% A 100 SER HBx 1.0 . 5.50 1479 1236 A 100 SER HBy A 101 LEU HDy% 1.0 . 5.50 1480 1237 A 104 LYS H A 103 VAL HGx% 1.0 . 4.60 1481 1238 A 103 VAL H A 103 VAL HGx% 1.0 . 3.08 1482 1239 A 102 GLN H A 103 VAL HGx% 1.0 . 5.01 1483 1240 A 103 VAL HGx% A 103 VAL HA 1.0 . 3.19 1484 1241 A 68 VAL HGy% A 68 VAL H 1.0 . 3.84 1485 1242 A 12 PHE HD% A 68 VAL HGy% 1.0 . 5.50 1486 1243 A 68 VAL HA A 68 VAL HGy% 1.0 . 3.21 1487 1244 A 14 ILE HD1% A 68 VAL HGy% 1.0 . 4.07 1488 1245 A 68 VAL HGy% A 69 GLN HA 1.0 . 4.01 1489 1246 A 68 VAL HGy% A 71 ALA HB% 1.0 . 4.37 1490 1247 A 33 SER H A 33 SER HBy 1.0 . 3.74 1491 1248 A 33 SER HBx A 30 ASN HA 1.0 . 4.28 1492 1249 A 8 VAL HGy% A 10 ASP HA 1.0 . 4.83 1493 1250 A 68 VAL HGy% A 69 GLN HE2x 1.0 . 5.06 1494 1251 A 68 VAL HGy% A 88 GLU HA 1.0 . 4.15 1495 1252 A 68 VAL HGy% A 65 GLU HA 1.0 . 4.25 1496 1253 A 8 VAL HGy% A 8 VAL H 1.0 . 3.09 1497 1254 A 8 VAL HGy% A 8 VAL HA 1.0 . 3.35 1498 1255 A 8 VAL HGy% A 11 VAL HGx% 1.0 . 2.67 1499 1255 A 8 VAL HGy% A 11 VAL HGy% 1.0 . 2.67 1500 1256 A 104 LYS H A 103 VAL HA 1.0 . 2.76 1501 1257 A 102 GLN H A 103 VAL HA 1.0 . 5.18 1502 1258 A 103 VAL HGy% A 103 VAL HA 1.0 . 3.15 1503 1259 A 15 ARG H A 14 ILE HG2% 1.0 . 3.83 1504 1260 A 60 ILE H A 14 ILE HG2% 1.0 . 5.50 1505 1261 A 88 GLU H A 14 ILE HG2% 1.0 . 4.90 1506 1262 A 87 TYR H A 14 ILE HG2% 1.0 . 5.02 1507 1263 A 14 ILE H A 14 ILE HG2% 1.0 . 4.02 1508 1264 A 89 ILE H A 14 ILE HG2% 1.0 . 4.37 1509 1265 A 14 ILE HA A 14 ILE HG2% 1.0 . 3.30 1510 1266 A 88 GLU HA A 14 ILE HG2% 1.0 . 3.49 1511 1267 A 68 VAL HA A 14 ILE HG2% 1.0 . 3.75 1512 1268 A 62 MET HBy A 14 ILE HG2% 1.0 . 4.62 1513 1269 A 62 MET HBx A 14 ILE HG2% 1.0 . 4.38 1514 1270 A 68 VAL HGy% A 14 ILE HG2% 1.0 . 3.05 1515 1271 A 14 ILE HD1% A 14 ILE HG2% 1.0 . 3.42 1516 1272 A 60 ILE H A 60 ILE HG2% 1.0 . 4.58 1517 1273 A 61 GLU H A 60 ILE HG2% 1.0 . 3.54 1518 1274 A 38 ARG H A 60 ILE HG2% 1.0 . 5.50 1519 1275 A 45 HIS H A 60 ILE HG2% 1.0 . 5.50 1520 1276 A 14 ILE H A 60 ILE HG2% 1.0 . 5.50 1521 1277 A 60 ILE HG2% A 32 PHE HE% 1.0 . 5.50 1522 1278 A 44 ILE H A 60 ILE HG2% 1.0 . 4.98 1523 1279 A 60 ILE HA A 60 ILE HG2% 1.0 . 3.40 1524 1280 A 37 ILE HA A 60 ILE HG2% 1.0 . 4.37 1525 1281 A 44 ILE HA A 60 ILE HG2% 1.0 . 3.98 1526 1282 A 62 MET HBx A 60 ILE HG2% 1.0 . 4.53 1527 1283 A 32 PHE HD% A 60 ILE HG2% 1.0 . 5.36 1528 1284 A 34 ASP H A 33 SER HA 1.0 . 3.46 1529 1285 A 9 ASP H A 8 VAL HA 1.0 . 2.49 1530 1286 A 9 ASP HA A 8 VAL HA 1.0 . 4.29 1531 1287 A 9 ASP HBy A 8 VAL HA 1.0 . 5.50 1532 1288 A 8 VAL HGx% A 8 VAL HA 1.0 . 3.10 1533 1289 A 86 VAL HA A 87 TYR H 1.0 . 3.26 1534 1290 A 12 PHE H A 11 VAL HA 1.0 . 2.77 1535 1291 A 12 PHE HD% A 11 VAL HA 1.0 . 4.54 1536 1292 A 12 PHE HA A 11 VAL HA 1.0 . 4.79 1537 1293 A 10 ASP HA A 11 VAL HA 1.0 . 4.82 1538 1294 A 11 VAL HA A 12 PHE HBx 1.0 . 4.53 1539 1294 A 12 PHE HBy A 11 VAL HA 1.0 . 4.53 1540 1295 A 17 GLN H A 84 VAL HA 1.0 . 4.79 1541 1296 A 38 ARG H A 37 ILE HA 1.0 . 3.17 1542 1297 A 37 ILE HA A 37 ILE HG1x 1.0 . 3.54 1543 1298 A 31 PHE HE% A 31 PHE HA 1.0 . 4.77 1544 1299 A 71 ALA HB% A 32 PHE HD% 1.0 . 3.83 1545 1300 A 68 VAL HA A 71 ALA HB% 1.0 . 3.41 1546 1301 A 86 VAL HGx% A 71 ALA HB% 1.0 . 3.38 1547 1302 A 72 LEU HDx% A 71 ALA HB% 1.0 . 3.61 1548 1303 A 71 ALA H A 71 ALA HB% 1.0 . 2.95 1549 1304 A 71 ALA HB% A 72 LEU HA 1.0 . 5.21 1550 1305 A 35 CYS HBx A 71 ALA HB% 1.0 . 4.99 1551 1306 A 44 ILE HA A 60 ILE HB 1.0 . 5.50 1552 1307 A 44 ILE HG1y A 44 ILE HA 1.0 . 4.04 1553 1308 A 44 ILE HA A 44 ILE HD1% 1.0 . 4.52 1554 1309 A 44 ILE HA A 43 GLY HAy 1.0 . 4.91 1555 1310 A 98 MET H A 96 ALA HB% 1.0 . 4.84 1556 1311 A 99 LYS H A 96 ALA HB% 1.0 . 4.23 1557 1312 A 94 VAL H A 96 ALA HB% 1.0 . 5.50 1558 1313 A 95 ASP H A 96 ALA HB% 1.0 . 4.35 1559 1314 A 96 ALA H A 96 ALA HB% 1.0 . 2.79 1560 1315 A 97 LEU H A 96 ALA HB% 1.0 . 3.25 1561 1316 A 94 VAL HA A 96 ALA HB% 1.0 . 5.50 1562 1317 A 95 ASP HBx A 96 ALA HB% 1.0 . 4.39 1563 1318 A 102 GLN H A 100 SER HA 1.0 . 4.56 1564 1319 A 100 SER HA A 100 SER HBx 1.0 . 2.80 1565 1319 A 100 SER HBy A 100 SER HA 1.0 . 2.80 1566 1320 A 25 MET H A 25 MET HE% 1.0 . 4.20 1567 1321 A 46 PHE HD% A 25 MET HE% 1.0 . 3.56 1568 1322 A 44 ILE H A 25 MET HE% 1.0 . 4.31 1569 1323 A 45 HIS HA A 25 MET HE% 1.0 . 4.53 1570 1324 A 42 ASN HA A 25 MET HE% 1.0 . 4.22 1571 1325 A 25 MET HA A 25 MET HE% 1.0 . 3.98 1572 1326 A 25 MET HGy A 25 MET HE% 1.0 . 2.94 1573 1327 A 44 ILE HB A 25 MET HE% 1.0 . 3.30 1574 1328 A 44 ILE HD1% A 25 MET HE% 1.0 . 3.66 1575 1329 A 44 ILE HG2% A 25 MET HE% 1.0 . 3.38 1576 1330 A 62 MET H A 62 MET HE% 1.0 . 4.13 1577 1331 A 14 ILE H A 62 MET HE% 1.0 . 5.01 1578 1332 A 32 PHE HD% A 62 MET HE% 1.0 . 3.74 1579 1333 A 62 MET HE% A 32 PHE HE% 1.0 . 4.29 1580 1334 A 62 MET HA A 62 MET HE% 1.0 . 3.75 1581 1335 A 62 MET HE% A 60 ILE HA 1.0 . 5.50 1582 1336 A 37 ILE HA A 62 MET HE% 1.0 . 4.30 1583 1337 A 32 PHE HBy A 62 MET HE% 1.0 . 4.25 1584 1338 A 35 CYS HBy A 62 MET HE% 1.0 . 3.61 1585 1339 A 35 CYS HBx A 62 MET HE% 1.0 . 3.04 1586 1340 A 62 MET HBy A 62 MET HE% 1.0 . 3.39 1587 1341 A 62 MET HBx A 62 MET HE% 1.0 . 3.51 1588 1342 A 62 MET HE% A 60 ILE HG2% 1.0 . 3.36 1589 1343 A 14 ILE HD1% A 62 MET HE% 1.0 . 3.34 1590 1344 A 61 GLU H A 60 ILE HA 1.0 . 3.15 1591 1345 A 60 ILE HA A 60 ILE HG1x 1.0 . 4.08 1592 1345 A 60 ILE HG1y A 60 ILE HA 1.0 . 4.08 1593 1346 A 30 ASN H A 26 GLU HA 1.0 . 4.50 1594 1347 A 26 GLU HA A 29 LEU HBx 1.0 . 4.02 1595 1348 A 78 TYR H A 77 MET HE% 1.0 . 4.50 1596 1349 A 77 MET H A 77 MET HE% 1.0 . 4.55 1597 1350 A 31 PHE HZ A 77 MET HE% 1.0 . 5.50 1598 1351 A 31 PHE HE% A 77 MET HE% 1.0 . 4.59 1599 1352 A 77 MET HE% A 77 MET HA 1.0 . 4.11 1600 1353 A 74 LYS HA A 77 MET HE% 1.0 . 3.84 1601 1354 A 90 ASN H A 89 ILE HG2% 1.0 . 3.37 1602 1355 A 93 ASP H A 89 ILE HG2% 1.0 . 3.64 1603 1356 A 89 ILE HG2% A 94 VAL H 1.0 . 4.41 1604 1357 A 89 ILE HA A 89 ILE HG2% 1.0 . 3.28 1605 1358 A 89 ILE HG2% A 94 VAL HA 1.0 . 3.82 1606 1359 A 89 ILE HG2% A 93 ASP HBx 1.0 . 3.48 1607 1360 A 89 ILE HG2% A 89 ILE HG1x 1.0 . 3.71 1608 1360 A 89 ILE HG2% A 89 ILE HG1y 1.0 . 3.71 1609 1361 A 14 ILE HA A 89 ILE HG2% 1.0 . 5.18 1610 1362 A 44 ILE HA A 60 ILE HA 1.0 . 3.68 1611 1363 A 26 GLU HA A 29 LEU HG 1.0 . 4.88 1612 1364 A 46 PHE HA A 58 ALA HA 1.0 . 3.56 1613 1365 A 46 PHE HA A 47 LEU HG 1.0 . 4.84 1614 1366 A 46 PHE HA A 58 ALA HB% 1.0 . 4.13 1615 1367 A 38 ARG H A 63 GLU HA 1.0 . 5.02 1616 1368 A 63 GLU HA A 38 ARG HA 1.0 . 4.71 1617 1369 A 62 MET HA A 63 GLU HA 1.0 . 4.46 1618 1370 A 38 ARG HBy A 63 GLU HA 1.0 . 4.60 1619 1371 A 38 ARG HBx A 63 GLU HA 1.0 . 3.72 1620 1372 A 45 HIS H A 44 ILE HG2% 1.0 . 3.81 1621 1373 A 44 ILE H A 44 ILE HG2% 1.0 . 4.50 1622 1374 A 44 ILE HG2% A 60 ILE HA 1.0 . 4.40 1623 1375 A 44 ILE HA A 44 ILE HG2% 1.0 . 3.40 1624 1376 A 44 ILE HG2% A 25 MET HGy 1.0 . 4.46 1625 1377 A 44 ILE HG2% A 28 VAL HB 1.0 . 4.27 1626 1378 A 44 ILE HG1y A 44 ILE HG2% 1.0 . 3.85 1627 1379 A 44 ILE HG2% A 44 ILE HD1% 1.0 . 3.34 1628 1380 A 59 LEU H A 46 PHE HA 1.0 . 4.41 1629 1381 A 27 ASP H A 25 MET HA 1.0 . 5.21 1630 1382 A 25 MET HA A 25 MET HGy 1.0 . 3.64 1631 1383 A 44 ILE HG2% A 25 MET HA 1.0 . 4.68 1632 1384 A 25 MET HA A 24 THR HA 1.0 . 4.38 1633 1385 A 41 GLU HA A 41 GLU HGx 1.0 . 3.47 1634 1385 A 41 GLU HGy A 41 GLU HA 1.0 . 3.47 1635 1386 A 44 ILE H A 41 GLU HA 1.0 . 4.46 1636 1387 A 44 ILE HG2% A 41 GLU HA 1.0 . 5.03 1637 1388 A 44 ILE HG1y A 41 GLU HA 1.0 . 4.34 1638 1389 A 31 PHE H A 79 MET HE% 1.0 . 4.21 1639 1390 A 28 VAL H A 79 MET HE% 1.0 . 4.96 1640 1391 A 31 PHE HE% A 79 MET HE% 1.0 . 5.01 1641 1392 A 31 PHE HD% A 79 MET HE% 1.0 . 3.88 1642 1393 A 79 MET HE% A 31 PHE HA 1.0 . 4.27 1643 1394 A 28 VAL HA A 79 MET HE% 1.0 . 3.20 1644 1395 A 31 PHE HBy A 79 MET HE% 1.0 . 3.22 1645 1396 A 31 PHE HBx A 79 MET HE% 1.0 . 3.37 1646 1397 A 27 ASP HBx A 79 MET HE% 1.0 . 3.52 1647 1398 A 79 MET HE% A 84 VAL HGy% 1.0 . 3.54 1648 1399 A 79 MET HE% A 84 VAL HGx% 1.0 . 4.27 1649 1400 A 37 ILE HG2% A 40 GLY H 1.0 . 3.79 1650 1401 A 44 ILE H A 37 ILE HG2% 1.0 . 4.33 1651 1402 A 61 GLU HBx A 37 ILE HG2% 1.0 . 5.18 1652 1403 A 61 GLU H A 37 ILE HG2% 1.0 . 4.18 1653 1404 A 38 ARG H A 37 ILE HG2% 1.0 . 3.49 1654 1405 A 37 ILE H A 37 ILE HG2% 1.0 . 3.82 1655 1406 A 62 MET HA A 37 ILE HG2% 1.0 . 4.66 1656 1407 A 37 ILE HG2% A 37 ILE HA 1.0 . 3.23 1657 1408 A 37 ILE HG2% A 43 GLY HAx 1.0 . 3.71 1658 1409 A 37 ILE HG2% A 40 GLY HAx 1.0 . 4.46 1659 1410 A 61 GLU HBy A 37 ILE HG2% 1.0 . 4.84 1660 1411 A 37 ILE HG2% A 60 ILE HG2% 1.0 . 3.40 1661 1412 A 68 VAL H A 66 GLN HA 1.0 . 4.51 1662 1413 A 72 LEU H A 69 GLN HA 1.0 . 4.33 1663 1414 A 72 LEU HBy A 69 GLN HA 1.0 . 3.43 1664 1415 A 68 VAL H A 69 GLN HA 1.0 . 5.12 1665 1416 A 69 GLN HA A 69 GLN HGy 1.0 . 3.56 1666 1416 A 69 GLN HGx A 69 GLN HA 1.0 . 3.56 1667 1417 A 102 GLN H A 99 LYS HA 1.0 . 4.00 1668 1418 A 101 LEU H A 99 LYS HA 1.0 . 4.04 1669 1419 A 99 LYS HA A 99 LYS HEx 1.0 . 5.50 1670 1419 A 99 LYS HA A 99 LYS HEy 1.0 . 5.50 1671 1420 A 99 LYS HGx A 99 LYS HA 1.0 . 4.21 1672 1421 A 29 LEU HA A 28 VAL H 1.0 . 5.28 1673 1422 A 44 ILE HG2% A 37 ILE HG2% 1.0 . 5.50 1674 1423 A 24 THR H A 23 CYS HA 1.0 . 3.00 1675 1424 A 50 ARG HA A 52 GLY H 1.0 . 4.19 1676 1425 A 50 ARG HA A 50 ARG HBx 1.0 . 2.83 1677 1425 A 50 ARG HBy A 50 ARG HA 1.0 . 2.83 1678 1426 A 70 LYS HGy A 70 LYS HA 1.0 . 3.62 1679 1427 A 73 GLU H A 70 LYS HA 1.0 . 3.98 1680 1428 A 70 LYS HDy A 70 LYS HA 1.0 . 4.01 1681 1429 A 70 LYS HA A 70 LYS HGx 1.0 . 3.38 1682 1430 A 69 GLN H A 65 GLU HA 1.0 . 4.37 1683 1431 A 68 VAL H A 65 GLU HA 1.0 . 3.84 1684 1432 A 68 VAL HB A 65 GLU HA 1.0 . 3.40 1685 1433 A 98 MET H A 98 MET HE% 1.0 . 4.13 1686 1434 A 22 SER H A 23 CYS HA 1.0 . 5.03 1687 1435 A 67 ASP HA A 70 LYS HDx 1.0 . 5.12 1688 1436 A 89 ILE HA A 89 ILE HG1x 1.0 . 3.90 1689 1436 A 89 ILE HA A 89 ILE HG1y 1.0 . 3.90 1690 1437 A 64 SER HBy A 65 GLU HA 1.0 . 4.88 1691 1438 A 98 MET HA A 98 MET HE% 1.0 . 3.48 1692 1439 A 98 MET HBx A 98 MET HE% 1.0 . 2.59 1693 1440 A 98 MET HE% A 13 LEU HDx% 1.0 . 3.03 1694 1440 A 13 LEU HDy% A 98 MET HE% 1.0 . 3.03 1695 1441 A 99 LYS H A 98 MET HE% 1.0 . 5.16 1696 1442 A 101 LEU H A 98 MET HE% 1.0 . 4.73 1697 1443 A 98 MET HGy A 98 MET HE% 1.0 . 3.37 1698 1444 A 101 LEU HDx% A 98 MET HE% 1.0 . 3.63 1699 1445 A 66 GLN HBx A 67 ASP HA 1.0 . 3.99 1700 1446 A 67 ASP HA A 70 LYS HBx 1.0 . 3.54 1701 1446 A 67 ASP HA A 70 LYS HBy 1.0 . 3.54 1702 1447 A 105 SER HA A 105 SER HBx 1.0 . 2.96 1703 1447 A 105 SER HBy A 105 SER HA 1.0 . 2.96 1704 1448 A 93 ASP H A 92 GLU HA 1.0 . 3.56 1705 1449 A 73 GLU HGy A 73 GLU HA 1.0 . 3.62 1706 1450 A 73 GLU HGx A 73 GLU HA 1.0 . 3.08 1707 1451 A 73 GLU HA A 73 GLU HBx 1.0 . 2.92 1708 1451 A 73 GLU HBy A 73 GLU HA 1.0 . 2.92 1709 1452 A 92 GLU HBy A 92 GLU HA 1.0 . 2.99 1710 1453 A 15 ARG H A 14 ILE HA 1.0 . 3.24 1711 1454 A 71 ALA H A 67 ASP HA 1.0 . 4.78 1712 1455 A 75 HIS H A 73 GLU HA 1.0 . 5.35 1713 1456 A 14 ILE HA A 14 ILE HD1% 1.0 . 4.71 1714 1457 A 14 ILE HA A 68 VAL HGy% 1.0 . 4.48 1715 1458 A 95 ASP HBy A 95 ASP HA 1.0 . 3.00 1716 1459 A 95 ASP HA A 94 VAL HGx% 1.0 . 3.97 1717 1459 A 94 VAL HGy% A 95 ASP HA 1.0 . 3.97 1718 1460 A 95 ASP HA A 98 MET HBy 1.0 . 3.67 1719 1461 A 13 LEU HBy A 14 ILE HA 1.0 . 4.62 1720 1462 A 60 ILE HD1% A 60 ILE H 1.0 . 4.44 1721 1463 A 60 ILE HD1% A 61 GLU H 1.0 . 5.33 1722 1464 A 60 ILE HD1% A 45 HIS H 1.0 . 4.93 1723 1465 A 60 ILE HD1% A 32 PHE HD% 1.0 . 4.25 1724 1466 A 60 ILE HD1% A 32 PHE HE% 1.0 . 3.59 1725 1467 A 60 ILE HD1% A 60 ILE HA 1.0 . 4.06 1726 1468 A 60 ILE HD1% A 44 ILE HA 1.0 . 4.30 1727 1469 A 60 ILE HD1% A 28 VAL HB 1.0 . 5.00 1728 1470 A 60 ILE HD1% A 61 GLU HGx 1.0 . 5.50 1729 1471 A 60 ILE HD1% A 28 VAL HGx% 1.0 . 3.52 1730 1472 A 60 ILE HD1% A 44 ILE HD1% 1.0 . 3.52 1731 1473 A 60 ILE HD1% A 44 ILE HG2% 1.0 . 4.08 1732 1474 A 35 CYS HA A 62 MET HE% 1.0 . 5.04 1733 1475 A 30 ASN H A 27 ASP HA 1.0 . 4.55 1734 1476 A 27 ASP HA A 30 ASN HD2y 1.0 . 4.66 1735 1477 A 27 ASP HA A 30 ASN HD2x 1.0 . 4.69 1736 1478 A 99 LYS H A 97 LEU HA 1.0 . 5.07 1737 1479 A 28 VAL HA A 44 ILE HD1% 1.0 . 5.10 1738 1480 A 43 GLY H A 44 ILE HD1% 1.0 . 5.32 1739 1481 A 44 ILE HD1% A 25 MET HGy 1.0 . 4.29 1740 1482 A 44 ILE HD1% A 28 VAL HGy% 1.0 . 4.64 1741 1483 A 44 ILE H A 44 ILE HD1% 1.0 . 3.97 1742 1484 A 44 ILE HD1% A 60 ILE HA 1.0 . 4.75 1743 1485 A 27 ASP HA A 79 MET HE% 1.0 . 5.50 1744 1486 A 54 ARG HA A 54 ARG HGy 1.0 . 3.79 1745 1487 A 39 ASN H A 38 ARG HA 1.0 . 2.95 1746 1488 A 40 GLY H A 38 ARG HA 1.0 . 4.20 1747 1489 A 37 ILE HA A 38 ARG HA 1.0 . 4.33 1748 1490 A 38 ARG HA A 38 ARG HDx 1.0 . 4.36 1749 1490 A 38 ARG HDy A 38 ARG HA 1.0 . 4.36 1750 1491 A 74 LYS H A 72 LEU HA 1.0 . 4.47 1751 1492 A 72 LEU HA A 72 LEU HG 1.0 . 3.80 1752 1493 A 25 MET HA A 44 ILE HD1% 1.0 . 3.95 1753 1494 A 44 ILE HD1% A 41 GLU HA 1.0 . 3.15 1754 1495 A 44 ILE HD1% A 44 ILE HB 1.0 . 3.44 1755 1496 A 29 LEU H A 44 ILE HD1% 1.0 . 4.01 1756 1497 A 41 GLU H A 44 ILE HD1% 1.0 . 5.50 1757 1498 A 98 MET HA A 97 LEU HDy% 1.0 . 5.50 1758 1499 A 97 LEU HBx A 98 MET HA 1.0 . 5.50 1759 1500 A 12 PHE HD% A 64 SER HA 1.0 . 4.75 1760 1501 A 75 HIS H A 72 LEU HA 1.0 . 4.32 1761 1502 A 6 GLU H A 5 GLU HA 1.0 . 2.83 1762 1503 A 14 ILE HD1% A 72 LEU H 1.0 . 5.38 1763 1504 A 14 ILE HD1% A 71 ALA HA 1.0 . 4.92 1764 1505 A 14 ILE HD1% A 62 MET HBy 1.0 . 5.32 1765 1506 A 15 ARG H A 14 ILE HD1% 1.0 . 4.34 1766 1507 A 14 ILE HD1% A 60 ILE H 1.0 . 5.18 1767 1508 A 14 ILE HD1% A 87 TYR H 1.0 . 5.31 1768 1509 A 14 ILE HD1% A 14 ILE H 1.0 . 4.39 1769 1510 A 14 ILE HD1% A 32 PHE HD% 1.0 . 4.94 1770 1511 A 14 ILE HD1% A 32 PHE HE% 1.0 . 4.10 1771 1512 A 14 ILE HD1% A 13 LEU HA 1.0 . 5.24 1772 1513 A 14 ILE HD1% A 68 VAL HA 1.0 . 4.18 1773 1514 A 14 ILE HD1% A 14 ILE HB 1.0 . 3.83 1774 1515 A 14 ILE HD1% A 71 ALA HB% 1.0 . 3.35 1775 1516 A 91 ASN HA A 94 VAL HGx% 1.0 . 4.04 1776 1516 A 94 VAL HGy% A 91 ASN HA 1.0 . 4.04 1777 1517 A 94 VAL H A 91 ASN HA 1.0 . 4.25 1778 1518 A 15 ARG H A 88 GLU HA 1.0 . 4.52 1779 1519 A 72 LEU HDy% A 88 GLU HA 1.0 . 4.43 1780 1520 A 7 GLU HA A 7 GLU HGx 1.0 . 3.39 1781 1520 A 7 GLU HGy A 7 GLU HA 1.0 . 3.39 1782 1521 A 37 ILE H A 37 ILE HD1% 1.0 . 3.81 1783 1522 A 37 ILE HD1% A 32 PHE H 1.0 . 4.79 1784 1523 A 37 ILE HD1% A 32 PHE HD% 1.0 . 4.15 1785 1524 A 62 MET HA A 37 ILE HD1% 1.0 . 5.20 1786 1525 A 37 ILE HD1% A 37 ILE HA 1.0 . 3.75 1787 1526 A 37 ILE HD1% A 32 PHE HBy 1.0 . 3.90 1788 1527 A 37 ILE HD1% A 32 PHE HBx 1.0 . 3.63 1789 1528 A 37 ILE HD1% A 60 ILE HG2% 1.0 . 3.21 1790 1529 A 61 GLU H A 37 ILE HD1% 1.0 . 5.50 1791 1530 A 89 ILE H A 88 GLU HA 1.0 . 2.97 1792 1531 A 14 ILE HA A 88 GLU HA 1.0 . 3.66 1793 1532 A 88 GLU HA A 89 ILE HG1x 1.0 . 4.96 1794 1532 A 88 GLU HA A 89 ILE HG1y 1.0 . 4.96 1795 1533 A 14 ILE HD1% A 88 GLU HA 1.0 . 4.87 1796 1534 A 81 GLN HA A 81 GLN HBy 1.0 . 2.99 1797 1535 A 105 SER H A 104 LYS HA 1.0 . 2.92 1798 1536 A 104 LYS HGy A 104 LYS HA 1.0 . 3.76 1799 1537 A 102 GLN HA A 102 GLN HBy 1.0 . 2.98 1800 1538 A 88 GLU H A 87 TYR HA 1.0 . 3.15 1801 1539 A 55 ARG HDy A 55 ARG HA 1.0 . 5.01 1802 1540 A 55 ARG HA A 55 ARG HDx 1.0 . 4.60 1803 1541 A 4 LEU HBx A 4 LEU HA 1.0 . 2.96 1804 1542 A 101 LEU HDx% A 101 LEU HA 1.0 . 4.33 1805 1543 A 74 LYS H A 71 ALA HA 1.0 . 4.63 1806 1544 A 78 TYR H A 77 MET HA 1.0 . 3.31 1807 1545 A 78 TYR HD% A 77 MET HA 1.0 . 4.74 1808 1546 A 61 GLU HA A 13 LEU HDx% 1.0 . 3.60 1809 1546 A 61 GLU HA A 13 LEU HDy% 1.0 . 3.60 1810 1547 A 30 ASN HA A 33 SER HBy 1.0 . 3.47 1811 1548 A 32 PHE H A 30 ASN HA 1.0 . 4.65 1812 1549 A 36 ARG HA A 37 ILE HD1% 1.0 . 5.50 1813 1550 A 62 MET H A 61 GLU HA 1.0 . 3.09 1814 1551 A 93 ASP HA A 96 ALA HB% 1.0 . 3.56 1815 1552 A 79 MET HA A 80 GLY H 1.0 . 3.20 1816 1553 A 94 VAL H A 93 ASP HA 1.0 . 3.53 1817 1554 A 99 LYS H A 96 ALA HA 1.0 . 3.98 1818 1555 A 96 ALA HA A 99 LYS HBx 1.0 . 3.34 1819 1555 A 99 LYS HBy A 96 ALA HA 1.0 . 3.34 1820 1556 A 99 LYS HGy A 96 ALA HA 1.0 . 3.86 1821 1557 A 44 ILE H A 42 ASN HA 1.0 . 3.97 1822 1558 A 42 ASN HA A 41 GLU HGx 1.0 . 4.72 1823 1558 A 42 ASN HA A 41 GLU HGy 1.0 . 4.72 1824 1559 A 74 LYS HA A 74 LYS HDx 1.0 . 3.68 1825 1559 A 74 LYS HA A 74 LYS HDy 1.0 . 3.68 1826 1560 A 74 LYS HGx A 74 LYS HA 1.0 . 4.15 1827 1561 A 39 ASN HA A 38 ARG HGx 1.0 . 5.13 1828 1561 A 39 ASN HA A 38 ARG HGy 1.0 . 5.13 1829 1562 A 58 ALA H A 17 GLN HA 1.0 . 4.26 1830 1563 A 17 GLN HA A 19 LEU HG 1.0 . 5.07 1831 1564 A 17 GLN HA A 18 GLY H 1.0 . 3.18 1832 1565 A 57 ASP HA A 17 GLN HA 1.0 . 3.53 1833 1566 A 48 LEU H A 47 LEU HA 1.0 . 3.15 1834 1567 A 53 LYS HA A 48 LEU HDx% 1.0 . 4.98 1835 1568 A 39 ASN H A 39 ASN HA 1.0 . 2.88 1836 1569 A 51 ASP HA A 50 ARG HGx 1.0 . 5.27 1837 1569 A 50 ARG HGy A 51 ASP HA 1.0 . 5.27 1838 1570 A 48 LEU HDx% A 47 LEU HA 1.0 . 5.07 1839 1571 A 39 ASN HD2y A 39 ASN HA 1.0 . 5.07 1840 1572 A 10 ASP H A 9 ASP HA 1.0 . 2.59 1841 1573 A 9 ASP HA A 9 ASP HBy 1.0 . 2.89 1842 1574 A 82 ARG HA A 82 ARG HDx 1.0 . 3.75 1843 1574 A 82 ARG HDy A 82 ARG HA 1.0 . 3.75 1844 1575 A 78 TYR HE% A 82 ARG HA 1.0 . 4.29 1845 1576 A 10 ASP HA A 11 VAL HGx% 1.0 . 4.06 1846 1576 A 11 VAL HGy% A 10 ASP HA 1.0 . 4.06 1847 1577 A 10 ASP HA A 10 ASP HBx 1.0 . 3.02 1848 1578 A 16 ALA H A 15 ARG HA 1.0 . 3.14 1849 1579 A 15 ARG HA A 59 LEU HDx% 1.0 . 3.93 1850 1579 A 59 LEU HDy% A 15 ARG HA 1.0 . 3.93 1851 1580 A 15 ARG HA A 15 ARG HDx 1.0 . 4.85 1852 1580 A 15 ARG HDy A 15 ARG HA 1.0 . 4.85 1853 1581 A 15 ARG HA A 60 ILE HG1x 1.0 . 4.98 1854 1581 A 60 ILE HG1y A 15 ARG HA 1.0 . 4.98 1855 1582 A 13 LEU HA A 62 MET HBx 1.0 . 5.14 1856 1583 A 14 ILE H A 13 LEU HA 1.0 . 3.00 1857 1584 A 13 LEU HA A 61 GLU HA 1.0 . 3.86 1858 1585 A 34 ASP HA A 34 ASP HBx 1.0 . 2.71 1859 1585 A 34 ASP HBy A 34 ASP HA 1.0 . 2.71 1860 1586 A 82 ARG HA A 81 GLN HGx 1.0 . 5.30 1861 1586 A 81 GLN HGy A 82 ARG HA 1.0 . 5.30 1862 1587 A 87 TYR HBx A 89 ILE HD1% 1.0 . 5.26 1863 1588 A 15 ARG H A 89 ILE HD1% 1.0 . 4.49 1864 1589 A 90 ASN H A 89 ILE HD1% 1.0 . 3.99 1865 1590 A 14 ILE H A 89 ILE HD1% 1.0 . 5.30 1866 1591 A 89 ILE H A 89 ILE HD1% 1.0 . 3.95 1867 1592 A 89 ILE HD1% A 15 ARG HA 1.0 . 5.02 1868 1593 A 14 ILE HA A 89 ILE HD1% 1.0 . 4.68 1869 1594 A 89 ILE HA A 89 ILE HD1% 1.0 . 3.14 1870 1595 A 89 ILE HD1% A 15 ARG HDx 1.0 . 3.84 1871 1595 A 15 ARG HDy A 89 ILE HD1% 1.0 . 3.84 1872 1596 A 93 ASP HBy A 89 ILE HD1% 1.0 . 4.74 1873 1597 A 89 ILE HB A 89 ILE HD1% 1.0 . 3.49 1874 1598 A 89 ILE HD1% A 15 ARG HBx 1.0 . 3.44 1875 1599 A 89 ILE HG2% A 89 ILE HD1% 1.0 . 2.88 1876 1600 A 13 LEU HA A 13 LEU HDx% 1.0 . 3.50 1877 1600 A 13 LEU HA A 13 LEU HDy% 1.0 . 3.50 1878 1601 A 48 LEU HA A 54 ARG HBx 1.0 . 3.85 1879 1601 A 48 LEU HA A 54 ARG HBy 1.0 . 3.85 1880 1602 A 48 LEU HA A 54 ARG HGy 1.0 . 4.02 1881 1603 A 89 ILE HA A 90 ASN HA 1.0 . 4.33 1882 1604 A 20 PRO HDx A 19 LEU HA 1.0 . 3.87 1883 1605 A 19 LEU HA A 20 PRO HDy 1.0 . 3.71 1884 1606 A 59 LEU HA A 59 LEU HDx% 1.0 . 3.54 1885 1606 A 59 LEU HDy% A 59 LEU HA 1.0 . 3.54 1886 1607 A 90 ASN HA A 11 VAL HGx% 1.0 . 5.22 1887 1607 A 11 VAL HGy% A 90 ASN HA 1.0 . 5.22 1888 1608 A 91 ASN H A 90 ASN HA 1.0 . 2.80 1889 1609 A 89 ILE HG2% A 90 ASN HA 1.0 . 4.60 1890 1610 A 59 LEU HA A 60 ILE HG1x 1.0 . 5.09 1891 1610 A 60 ILE HG1y A 59 LEU HA 1.0 . 5.09 1892 1611 A 62 MET HA A 67 ASP HBx 1.0 . 4.59 1893 1611 A 62 MET HA A 67 ASP HBy 1.0 . 4.59 1894 1612 A 38 ARG H A 62 MET HA 1.0 . 3.67 1895 1613 A 62 MET HA A 37 ILE HA 1.0 . 3.43 1896 1614 A 62 MET HA A 62 MET HGx 1.0 . 3.63 1897 1615 A 62 MET HA A 60 ILE HG2% 1.0 . 5.49 1898 1616 A 45 HIS HA A 44 ILE HG2% 1.0 . 5.02 1899 1617 A 45 HIS HA A 101 LEU HDy% 1.0 . 4.61 1900 1618 A 57 ASP HA A 19 LEU HDy% 1.0 . 5.50 1901 1619 A 57 ASP HA A 18 GLY H 1.0 . 4.37 1902 1620 A 57 ASP HA A 17 GLN HGy 1.0 . 5.37 1903 1621 A 58 ALA HB% A 57 ASP HA 1.0 . 4.49 1904 1622 A 45 HIS HBy A 58 ALA HA 1.0 . 5.47 1905 1623 A 47 LEU H A 58 ALA HA 1.0 . 3.80 1906 1624 A 58 ALA HA A 16 ALA HB% 1.0 . 5.50 1907 1625 A 46 PHE H A 58 ALA HA 1.0 . 5.11 1908 1626 A 19 LEU HBy A 20 PRO HDy 1.0 . 4.83 1909 1627 A 19 LEU HBy A 20 PRO HDx 1.0 . 4.80 1910 1628 A 17 GLN H A 16 ALA HA 1.0 . 3.12 1911 1629 A 87 TYR H A 16 ALA HA 1.0 . 4.44 1912 1630 A 86 VAL HA A 16 ALA HA 1.0 . 3.62 1913 1631 A 87 TYR HD% A 87 TYR HA 1.0 . 3.00 1914 1632 A 78 TYR HD% A 78 TYR HA 1.0 . 3.62 1915 1633 A 78 TYR HD% A 81 GLN HA 1.0 . 3.87 1916 1634 A 32 PHE HD% A 71 ALA HA 1.0 . 3.07 1917 1635 A 31 PHE HD% A 32 PHE HD% 1.0 . 4.18 1918 1636 A 32 PHE HD% A 32 PHE HA 1.0 . 3.09 1919 1637 A 28 VAL HGx% A 32 PHE HD% 1.0 . 3.10 1920 1638 A 12 PHE HD% A 12 PHE HA 1.0 . 3.14 1921 1639 A 12 PHE HD% A 65 GLU HA 1.0 . 3.95 1922 1640 A 12 PHE HD% A 65 GLU HBy 1.0 . 4.18 1923 1641 A 12 PHE HD% A 68 VAL HGx% 1.0 . 3.25 1924 1642 A 46 PHE HD% A 46 PHE HEx 1.0 . 2.40 1925 1643 A 46 PHE HA A 46 PHE HD% 1.0 . 3.89 1926 1644 A 46 PHE HD% A 44 ILE HG2% 1.0 . 3.79 1927 1645 A 31 PHE HD% A 31 PHE HA 1.0 . 3.50 1928 1646 A 31 PHE HE% A 84 VAL HGy% 1.0 . 3.88 1929 1647 A 31 PHE HD% A 79 MET HBy 1.0 . 4.14 1930 1648 A 31 PHE HE% A 84 VAL HB 1.0 . 4.07 1931 1649 A 32 PHE HE% A 71 ALA HA 1.0 . 3.44 1932 1650 A 71 ALA HB% A 32 PHE HE% 1.0 . 3.24 1933 1651 A 31 PHE HZ A 84 VAL HGy% 1.0 . 4.17 1934 1652 A 21 TRP HA A 21 TRP HD1 1.0 . 3.94 1935 1653 A 21 TRP HBx A 21 TRP HD1 1.0 . 3.66 1936 1654 A 45 HIS HD2 A 47 LEU HDx% 1.0 . 3.65 1937 1654 A 47 LEU HDy% A 45 HIS HD2 1.0 . 3.65 1938 1655 A 45 HIS HBy A 45 HIS HD2 1.0 . 3.59 1939 1656 A 75 HIS HBx A 75 HIS HD2 1.0 . 3.80 stop_ save_