data_nef_c15349_2js0 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 LEU middle . . 4 A 4 ASN middle . . 5 A 5 MET middle . . 6 A 6 PRO middle . false 7 A 7 ALA middle . . 8 A 8 TYR middle . . 9 A 9 VAL middle . . 10 A 10 LYS middle . . 11 A 11 PHE middle . . 12 A 12 ASN middle . . 13 A 13 TYR middle . . 14 A 14 MET middle . . 15 A 15 ALA middle . . 16 A 16 GLU middle . . 17 A 17 ARG middle . . 18 A 18 GLU middle . . 19 A 19 ASP middle . . 20 A 20 GLU middle . . 21 A 21 LEU middle . . 22 A 22 SER middle . . 23 A 23 LEU middle . . 24 A 24 ILE middle . . 25 A 25 LYS middle . . 26 A 26 GLY middle . false 27 A 27 THR middle . . 28 A 28 LYS middle . . 29 A 29 VAL middle . . 30 A 30 ILE middle . . 31 A 31 VAL middle . . 32 A 32 MET middle . . 33 A 33 GLU middle . . 34 A 34 LYS middle . . 35 A 35 CYS middle . . 36 A 36 SER middle . . 37 A 37 ASP middle . . 38 A 38 GLY middle . false 39 A 39 TRP middle . . 40 A 40 TRP middle . . 41 A 41 ARG middle . . 42 A 42 GLY middle . false 43 A 43 SER middle . . 44 A 44 TYR middle . . 45 A 45 ASN middle . . 46 A 46 GLY middle . false 47 A 47 GLN middle . . 48 A 48 VAL middle . . 49 A 49 GLY middle . false 50 A 50 TRP middle . . 51 A 51 PHE middle . . 52 A 52 PRO middle . false 53 A 53 SER middle . . 54 A 54 ASN middle . . 55 A 55 TYR middle . . 56 A 56 VAL middle . . 57 A 57 THR middle . . 58 A 58 GLU middle . . 59 A 59 GLU middle . . 60 A 60 GLY middle . false 61 A 61 ASP end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 2 SER HA H 1 4.614 0.020 A 2 SER HBx H 1 3.827 0.020 A 2 SER HBy H 1 3.827 0.020 A 2 SER C C 13 174.614 0.400 A 2 SER CA C 13 57.795 0.400 A 2 SER CB C 13 64.138 0.400 A 3 LEU H H 1 8.492 0.020 A 3 LEU HA H 1 4.213 0.020 A 3 LEU HBy H 1 1.550 0.020 A 3 LEU HBx H 1 1.404 0.020 A 3 LEU HDx% H 1 0.727 0.020 A 3 LEU HDy% H 1 0.727 0.020 A 3 LEU HG H 1 1.580 0.020 A 3 LEU C C 13 176.367 0.400 A 3 LEU CA C 13 55.834 0.400 A 3 LEU CB C 13 42.486 0.400 A 3 LEU CD1 C 13 22.918 0.400 A 3 LEU CD2 C 13 22.947 0.400 A 3 LEU CG C 13 27.006 0.400 A 3 LEU N N 15 124.425 0.400 A 4 ASN H H 1 8.173 0.020 A 4 ASN HA H 1 4.295 0.020 A 4 ASN HBy H 1 2.831 0.020 A 4 ASN HBx H 1 2.562 0.020 A 4 ASN HD2y H 1 7.390 0.020 A 4 ASN HD2x H 1 6.685 0.020 A 4 ASN C C 13 174.075 0.400 A 4 ASN CA C 13 53.579 0.400 A 4 ASN CB C 13 38.185 0.400 A 4 ASN CG C 13 177.660 0.400 A 4 ASN N N 15 117.396 0.400 A 4 ASN ND2 N 15 111.920 0.400 A 5 MET H H 1 7.973 0.020 A 5 MET HA H 1 5.020 0.020 A 5 MET HBy H 1 2.071 0.020 A 5 MET HBx H 1 1.839 0.020 A 5 MET HGy H 1 2.554 0.020 A 5 MET HGx H 1 2.489 0.020 A 5 MET CA C 13 52.665 0.400 A 5 MET CB C 13 34.910 0.400 A 5 MET CG C 13 31.572 0.400 A 5 MET N N 15 120.327 0.400 A 6 PRO HA H 1 5.030 0.020 A 6 PRO HBx H 1 1.804 0.020 A 6 PRO HBy H 1 2.087 0.020 A 6 PRO HDy H 1 3.986 0.020 A 6 PRO HDx H 1 3.836 0.020 A 6 PRO HGy H 1 2.192 0.020 A 6 PRO HGx H 1 1.975 0.020 A 6 PRO C C 13 175.984 0.400 A 6 PRO CA C 13 62.732 0.400 A 6 PRO CB C 13 32.740 0.400 A 6 PRO CD C 13 50.802 0.400 A 6 PRO CG C 13 27.483 0.400 A 7 ALA H H 1 8.962 0.020 A 7 ALA HA H 1 4.811 0.020 A 7 ALA HB% H 1 1.254 0.020 A 7 ALA C C 13 174.633 0.400 A 7 ALA CA C 13 51.202 0.400 A 7 ALA CB C 13 22.025 0.400 A 7 ALA N N 15 122.515 0.400 A 8 TYR H H 1 8.720 0.020 A 8 TYR HA H 1 4.963 0.020 A 8 TYR HBx H 1 2.823 0.020 A 8 TYR HBy H 1 2.823 0.020 A 8 TYR HD1 H 1 6.884 0.020 A 8 TYR HD2 H 1 6.884 0.020 A 8 TYR HE1 H 1 6.712 0.020 A 8 TYR HE2 H 1 6.712 0.020 A 8 TYR C C 13 175.957 0.400 A 8 TYR CA C 13 57.236 0.400 A 8 TYR CB C 13 40.331 0.400 A 8 TYR CD1 C 13 133.280 0.400 A 8 TYR CD2 C 13 133.279 0.400 A 8 TYR CE1 C 13 117.900 0.400 A 8 TYR CE2 C 13 117.901 0.400 A 8 TYR N N 15 120.352 0.400 A 9 VAL H H 1 8.536 0.020 A 9 VAL HA H 1 3.847 0.020 A 9 VAL HB H 1 1.910 0.020 A 9 VAL HGx% H 1 0.645 0.020 A 9 VAL HGy% H 1 0.604 0.020 A 9 VAL C C 13 176.821 0.400 A 9 VAL CA C 13 63.701 0.400 A 9 VAL CB C 13 32.129 0.400 A 9 VAL CG1 C 13 24.866 0.400 A 9 VAL CG2 C 13 22.250 0.400 A 9 VAL N N 15 124.068 0.400 A 10 LYS H H 1 8.967 0.020 A 10 LYS HA H 1 3.938 0.020 A 10 LYS HBx H 1 0.967 0.020 A 10 LYS HBy H 1 0.994 0.020 A 10 LYS HDx H 1 1.383 0.020 A 10 LYS HDy H 1 1.383 0.020 A 10 LYS HEy H 1 2.688 0.020 A 10 LYS HEx H 1 2.628 0.020 A 10 LYS HGy H 1 1.057 0.020 A 10 LYS HGx H 1 0.992 0.020 A 10 LYS C C 13 175.091 0.400 A 10 LYS CA C 13 57.839 0.400 A 10 LYS CB C 13 33.742 0.400 A 10 LYS CD C 13 28.934 0.400 A 10 LYS CE C 13 41.571 0.400 A 10 LYS CG C 13 24.739 0.400 A 10 LYS N N 15 129.334 0.400 A 11 PHE H H 1 7.041 0.020 A 11 PHE HA H 1 4.840 0.020 A 11 PHE HBy H 1 3.226 0.020 A 11 PHE HBx H 1 2.599 0.020 A 11 PHE HD1 H 1 6.920 0.020 A 11 PHE HD2 H 1 6.920 0.020 A 11 PHE C C 13 173.043 0.400 A 11 PHE CA C 13 54.487 0.400 A 11 PHE CB C 13 42.672 0.400 A 11 PHE CD1 C 13 132.750 0.400 A 11 PHE CD2 C 13 132.749 0.400 A 11 PHE N N 15 113.819 0.400 A 12 ASN H H 1 8.423 0.020 A 12 ASN HA H 1 4.606 0.020 A 12 ASN HBy H 1 2.789 0.020 A 12 ASN HBx H 1 2.649 0.020 A 12 ASN C C 13 175.343 0.400 A 12 ASN CA C 13 53.757 0.400 A 12 ASN CB C 13 39.218 0.400 A 12 ASN N N 15 116.457 0.400 A 13 TYR H H 1 8.681 0.020 A 13 TYR HA H 1 4.726 0.020 A 13 TYR HBy H 1 2.774 0.020 A 13 TYR HBx H 1 2.431 0.020 A 13 TYR HD1 H 1 7.047 0.020 A 13 TYR HD2 H 1 7.047 0.020 A 13 TYR HE1 H 1 6.879 0.020 A 13 TYR HE2 H 1 6.879 0.020 A 13 TYR C C 13 174.193 0.400 A 13 TYR CA C 13 57.775 0.400 A 13 TYR CB C 13 42.124 0.400 A 13 TYR CD1 C 13 133.150 0.400 A 13 TYR CD2 C 13 133.149 0.400 A 13 TYR CE1 C 13 118.180 0.400 A 13 TYR CE2 C 13 118.179 0.400 A 13 TYR N N 15 120.929 0.400 A 14 MET H H 1 7.767 0.020 A 14 MET HA H 1 4.503 0.020 A 14 MET HBy H 1 1.783 0.020 A 14 MET HBx H 1 1.731 0.020 A 14 MET HGy H 1 2.453 0.020 A 14 MET HGx H 1 2.385 0.020 A 14 MET C C 13 173.211 0.400 A 14 MET CA C 13 53.108 0.400 A 14 MET CB C 13 32.075 0.400 A 14 MET CG C 13 31.694 0.400 A 14 MET N N 15 128.379 0.400 A 15 ALA H H 1 8.098 0.020 A 15 ALA HA H 1 4.107 0.020 A 15 ALA HB% H 1 1.371 0.020 A 15 ALA C C 13 178.675 0.400 A 15 ALA CA C 13 53.279 0.400 A 15 ALA CB C 13 20.288 0.400 A 15 ALA N N 15 126.765 0.400 A 16 GLU H H 1 8.861 0.020 A 16 GLU HA H 1 4.368 0.020 A 16 GLU HBy H 1 2.200 0.020 A 16 GLU HBx H 1 2.120 0.020 A 16 GLU HGy H 1 2.497 0.020 A 16 GLU HGx H 1 2.241 0.020 A 16 GLU C C 13 176.031 0.400 A 16 GLU CA C 13 56.290 0.400 A 16 GLU CB C 13 31.608 0.400 A 16 GLU CG C 13 36.263 0.400 A 16 GLU N N 15 121.086 0.400 A 17 ARG H H 1 7.310 0.020 A 17 ARG HA H 1 4.621 0.020 A 17 ARG HBy H 1 2.059 0.020 A 17 ARG HBx H 1 1.667 0.020 A 17 ARG HDx H 1 3.137 0.020 A 17 ARG HDy H 1 3.137 0.020 A 17 ARG HGy H 1 1.657 0.020 A 17 ARG HGx H 1 1.521 0.020 A 17 ARG C C 13 177.291 0.400 A 17 ARG CA C 13 54.402 0.400 A 17 ARG CB C 13 34.605 0.400 A 17 ARG CD C 13 43.223 0.400 A 17 ARG CG C 13 27.020 0.400 A 17 ARG N N 15 115.708 0.400 A 18 GLU H H 1 8.958 0.020 A 18 GLU HA H 1 4.167 0.020 A 18 GLU HBx H 1 2.104 0.020 A 18 GLU HBy H 1 2.104 0.020 A 18 GLU HGx H 1 2.363 0.020 A 18 GLU HGy H 1 2.363 0.020 A 18 GLU C C 13 176.229 0.400 A 18 GLU CA C 13 59.121 0.400 A 18 GLU CB C 13 29.596 0.400 A 18 GLU CG C 13 36.247 0.400 A 18 GLU N N 15 120.435 0.400 A 19 ASP H H 1 8.362 0.020 A 19 ASP HA H 1 4.884 0.020 A 19 ASP HBy H 1 3.037 0.020 A 19 ASP HBx H 1 2.872 0.020 A 19 ASP C C 13 176.279 0.400 A 19 ASP CA C 13 53.800 0.400 A 19 ASP CB C 13 40.165 0.400 A 19 ASP N N 15 114.666 0.400 A 20 GLU H H 1 7.546 0.020 A 20 GLU HA H 1 5.509 0.020 A 20 GLU HBy H 1 2.615 0.020 A 20 GLU HBx H 1 2.337 0.020 A 20 GLU HGy H 1 2.534 0.020 A 20 GLU HGx H 1 2.324 0.020 A 20 GLU C C 13 175.590 0.400 A 20 GLU CA C 13 55.346 0.400 A 20 GLU CB C 13 33.298 0.400 A 20 GLU CG C 13 37.108 0.400 A 20 GLU N N 15 117.784 0.400 A 21 LEU H H 1 8.826 0.020 A 21 LEU HA H 1 4.616 0.020 A 21 LEU HBy H 1 1.715 0.020 A 21 LEU HBx H 1 1.041 0.020 A 21 LEU HDx% H 1 0.736 0.020 A 21 LEU HDy% H 1 0.907 0.020 A 21 LEU HG H 1 1.585 0.020 A 21 LEU C C 13 175.387 0.400 A 21 LEU CA C 13 53.324 0.400 A 21 LEU CB C 13 46.193 0.400 A 21 LEU CD1 C 13 24.928 0.400 A 21 LEU CD2 C 13 24.690 0.400 A 21 LEU CG C 13 26.587 0.400 A 21 LEU N N 15 124.142 0.400 A 22 SER H H 1 7.893 0.020 A 22 SER HA H 1 4.836 0.020 A 22 SER HBy H 1 4.003 0.020 A 22 SER HBx H 1 3.877 0.020 A 22 SER C C 13 173.707 0.400 A 22 SER CA C 13 59.350 0.400 A 22 SER CB C 13 63.550 0.400 A 22 SER N N 15 118.178 0.400 A 23 LEU H H 1 9.051 0.020 A 23 LEU HA H 1 4.561 0.020 A 23 LEU HBx H 1 1.318 0.020 A 23 LEU HBy H 1 1.706 0.020 A 23 LEU HDx% H 1 0.429 0.020 A 23 LEU HDy% H 1 0.023 0.020 A 23 LEU HG H 1 1.668 0.020 A 23 LEU C C 13 177.348 0.400 A 23 LEU CA C 13 52.832 0.400 A 23 LEU CB C 13 45.361 0.400 A 23 LEU CD1 C 13 25.645 0.400 A 23 LEU CD2 C 13 21.816 0.400 A 23 LEU CG C 13 25.694 0.400 A 23 LEU N N 15 121.478 0.400 A 24 ILE H H 1 8.523 0.020 A 24 ILE HA H 1 4.343 0.020 A 24 ILE HB H 1 1.484 0.020 A 24 ILE HD1% H 1 0.810 0.020 A 24 ILE HG1y H 1 1.349 0.020 A 24 ILE HG1x H 1 1.035 0.020 A 24 ILE HG2% H 1 0.874 0.020 A 24 ILE C C 13 175.616 0.400 A 24 ILE CA C 13 59.114 0.400 A 24 ILE CB C 13 38.899 0.400 A 24 ILE CD1 C 13 12.486 0.400 A 24 ILE CG1 C 13 27.212 0.400 A 24 ILE CG2 C 13 16.984 0.400 A 24 ILE N N 15 123.637 0.400 A 25 LYS H H 1 8.668 0.020 A 25 LYS HA H 1 3.291 0.020 A 25 LYS HBy H 1 1.588 0.020 A 25 LYS HBx H 1 1.472 0.020 A 25 LYS HDy H 1 1.676 0.020 A 25 LYS HDx H 1 1.647 0.020 A 25 LYS HEx H 1 2.997 0.020 A 25 LYS HEy H 1 2.997 0.020 A 25 LYS HGx H 1 1.166 0.020 A 25 LYS HGy H 1 1.166 0.020 A 25 LYS C C 13 176.295 0.400 A 25 LYS CA C 13 58.580 0.400 A 25 LYS CB C 13 32.513 0.400 A 25 LYS CD C 13 29.617 0.400 A 25 LYS CE C 13 41.921 0.400 A 25 LYS CG C 13 24.115 0.400 A 25 LYS N N 15 129.247 0.400 A 26 GLY H H 1 8.677 0.020 A 26 GLY HAy H 1 4.273 0.020 A 26 GLY HAx H 1 3.725 0.020 A 26 GLY C C 13 174.532 0.400 A 26 GLY CA C 13 44.962 0.400 A 26 GLY N N 15 112.648 0.400 A 27 THR H H 1 7.306 0.020 A 27 THR HA H 1 4.598 0.020 A 27 THR HB H 1 4.317 0.020 A 27 THR HG2% H 1 1.101 0.020 A 27 THR C C 13 171.869 0.400 A 27 THR CA C 13 60.880 0.400 A 27 THR CB C 13 71.965 0.400 A 27 THR CG2 C 13 21.887 0.400 A 27 THR N N 15 109.830 0.400 A 28 LYS H H 1 8.070 0.020 A 28 LYS HA H 1 5.153 0.020 A 28 LYS HBy H 1 1.658 0.020 A 28 LYS HBx H 1 1.640 0.020 A 28 LYS HDx H 1 1.628 0.020 A 28 LYS HDy H 1 1.628 0.020 A 28 LYS HEx H 1 2.883 0.020 A 28 LYS HEy H 1 2.883 0.020 A 28 LYS HGy H 1 1.262 0.020 A 28 LYS HGx H 1 1.113 0.020 A 28 LYS C C 13 175.852 0.400 A 28 LYS CA C 13 54.924 0.400 A 28 LYS CB C 13 34.730 0.400 A 28 LYS CD C 13 29.501 0.400 A 28 LYS CE C 13 41.732 0.400 A 28 LYS CG C 13 24.686 0.400 A 28 LYS N N 15 117.752 0.400 A 29 VAL H H 1 8.772 0.020 A 29 VAL HA H 1 4.747 0.020 A 29 VAL HB H 1 1.686 0.020 A 29 VAL HG1% H 1 0.499 0.020 A 29 VAL HG2% H 1 0.466 0.020 A 29 VAL C C 13 174.088 0.400 A 29 VAL CA C 13 58.898 0.400 A 29 VAL CB C 13 34.785 0.400 A 29 VAL CG1 C 13 21.090 0.400 A 29 VAL CG2 C 13 20.120 0.400 A 29 VAL N N 15 119.844 0.400 A 30 ILE H H 1 8.285 0.020 A 30 ILE HA H 1 4.359 0.020 A 30 ILE HB H 1 2.073 0.020 A 30 ILE HD1% H 1 0.675 0.020 A 30 ILE HG1x H 1 1.356 0.020 A 30 ILE HG1y H 1 1.425 0.020 A 30 ILE HG2% H 1 0.660 0.020 A 30 ILE C C 13 175.967 0.400 A 30 ILE CA C 13 59.132 0.400 A 30 ILE CB C 13 37.048 0.400 A 30 ILE CD1 C 13 10.305 0.400 A 30 ILE CG1 C 13 26.671 0.400 A 30 ILE CG2 C 13 17.390 0.400 A 30 ILE N N 15 122.376 0.400 A 31 VAL H H 1 9.372 0.020 A 31 VAL HA H 1 3.973 0.020 A 31 VAL HB H 1 2.231 0.020 A 31 VAL HGx% H 1 0.578 0.020 A 31 VAL HGy% H 1 1.250 0.020 A 31 VAL C C 13 175.311 0.400 A 31 VAL CA C 13 64.619 0.400 A 31 VAL CB C 13 31.987 0.400 A 31 VAL CG1 C 13 22.130 0.400 A 31 VAL CG2 C 13 23.169 0.400 A 31 VAL N N 15 128.775 0.400 A 32 MET H H 1 9.366 0.020 A 32 MET HA H 1 4.659 0.020 A 32 MET HBy H 1 2.269 0.020 A 32 MET HBx H 1 1.455 0.020 A 32 MET HE% H 1 1.988 0.020 A 32 MET HGy H 1 2.526 0.020 A 32 MET HGx H 1 2.407 0.020 A 32 MET C C 13 176.347 0.400 A 32 MET CA C 13 56.588 0.400 A 32 MET CB C 13 36.234 0.400 A 32 MET CE C 13 16.826 0.400 A 32 MET CG C 13 31.191 0.400 A 32 MET N N 15 124.999 0.400 A 33 GLU H H 1 7.785 0.020 A 33 GLU HA H 1 4.402 0.020 A 33 GLU HBx H 1 1.836 0.020 A 33 GLU HBy H 1 1.836 0.020 A 33 GLU HGx H 1 2.155 0.020 A 33 GLU HGy H 1 2.155 0.020 A 33 GLU C C 13 173.618 0.400 A 33 GLU CA C 13 55.907 0.400 A 33 GLU CB C 13 33.900 0.400 A 33 GLU CG C 13 36.105 0.400 A 33 GLU N N 15 118.248 0.400 A 34 LYS H H 1 8.609 0.020 A 34 LYS HA H 1 4.256 0.020 A 34 LYS HBy H 1 1.356 0.020 A 34 LYS HBx H 1 1.247 0.020 A 34 LYS HDy H 1 1.108 0.020 A 34 LYS HDx H 1 0.949 0.020 A 34 LYS HEy H 1 2.053 0.020 A 34 LYS HEx H 1 1.265 0.020 A 34 LYS HGy H 1 0.311 0.020 A 34 LYS HGx H 1 -1.110 0.020 A 34 LYS CA C 13 55.250 0.400 A 34 LYS CB C 13 35.010 0.400 A 34 LYS CD C 13 30.136 0.400 A 34 LYS CE C 13 41.095 0.400 A 34 LYS CG C 13 23.814 0.400 A 34 LYS N N 15 123.925 0.400 A 35 CYS HA H 1 4.921 0.020 A 35 CYS HBx H 1 3.540 0.020 A 35 CYS HBy H 1 3.540 0.020 A 35 CYS CA C 13 58.463 0.400 A 35 CYS CB C 13 29.808 0.400 A 36 SER HA H 1 4.041 0.020 A 36 SER HBx H 1 3.817 0.020 A 36 SER HBy H 1 3.817 0.020 A 36 SER C C 13 174.170 0.400 A 36 SER CA C 13 60.376 0.400 A 36 SER CB C 13 63.336 0.400 A 37 ASP H H 1 8.168 0.020 A 37 ASP HA H 1 4.622 0.020 A 37 ASP HBy H 1 3.036 0.020 A 37 ASP HBx H 1 2.666 0.020 A 37 ASP C C 13 176.849 0.400 A 37 ASP CA C 13 54.119 0.400 A 37 ASP CB C 13 40.309 0.400 A 37 ASP N N 15 120.448 0.400 A 38 GLY H H 1 8.021 0.020 A 38 GLY HAy H 1 4.174 0.020 A 38 GLY HAx H 1 3.599 0.020 A 38 GLY C C 13 174.020 0.400 A 38 GLY CA C 13 45.025 0.400 A 38 GLY N N 15 105.920 0.400 A 39 TRP H H 1 7.986 0.020 A 39 TRP HA H 1 4.815 0.020 A 39 TRP HBy H 1 3.214 0.020 A 39 TRP HBx H 1 3.161 0.020 A 39 TRP HD1 H 1 6.925 0.020 A 39 TRP HE1 H 1 9.875 0.020 A 39 TRP HE3 H 1 7.338 0.020 A 39 TRP HZ2 H 1 7.421 0.020 A 39 TRP HZ3 H 1 6.758 0.020 A 39 TRP C C 13 174.652 0.400 A 39 TRP CA C 13 57.505 0.400 A 39 TRP CB C 13 29.881 0.400 A 39 TRP CD1 C 13 126.980 0.400 A 39 TRP CE3 C 13 119.700 0.400 A 39 TRP CZ2 C 13 114.540 0.400 A 39 TRP CZ3 C 13 120.840 0.400 A 39 TRP N N 15 122.876 0.400 A 39 TRP NE1 N 15 128.990 0.400 A 40 TRP H H 1 8.990 0.020 A 40 TRP HA H 1 5.524 0.020 A 40 TRP HBx H 1 2.275 0.020 A 40 TRP HBy H 1 2.888 0.020 A 40 TRP HD1 H 1 7.387 0.020 A 40 TRP HE3 H 1 7.383 0.020 A 40 TRP HH2 H 1 7.288 0.020 A 40 TRP HZ2 H 1 7.533 0.020 A 40 TRP HZ3 H 1 6.835 0.020 A 40 TRP C C 13 172.808 0.400 A 40 TRP CA C 13 52.958 0.400 A 40 TRP CB C 13 33.653 0.400 A 40 TRP CD1 C 13 122.660 0.400 A 40 TRP CE3 C 13 121.330 0.400 A 40 TRP CH2 C 13 125.360 0.400 A 40 TRP CZ2 C 13 114.380 0.400 A 40 TRP CZ3 C 13 121.420 0.400 A 40 TRP N N 15 124.070 0.400 A 41 ARG H H 1 8.644 0.020 A 41 ARG HA H 1 4.655 0.020 A 41 ARG HBy H 1 1.052 0.020 A 41 ARG HBx H 1 -0.308 0.020 A 41 ARG HDx H 1 2.391 0.020 A 41 ARG HDy H 1 2.391 0.020 A 41 ARG HGy H 1 0.870 0.020 A 41 ARG HGx H 1 0.239 0.020 A 41 ARG C C 13 176.684 0.400 A 41 ARG CA C 13 53.740 0.400 A 41 ARG CB C 13 32.642 0.400 A 41 ARG CD C 13 43.277 0.400 A 41 ARG CG C 13 27.441 0.400 A 41 ARG N N 15 121.145 0.400 A 42 GLY H H 1 9.128 0.020 A 42 GLY HAy H 1 4.910 0.020 A 42 GLY HAx H 1 4.165 0.020 A 42 GLY C C 13 169.709 0.400 A 42 GLY CA C 13 46.355 0.400 A 42 GLY N N 15 114.080 0.400 A 43 SER H H 1 9.112 0.020 A 43 SER HA H 1 5.816 0.020 A 43 SER HBy H 1 3.721 0.020 A 43 SER HBx H 1 3.646 0.020 A 43 SER C C 13 174.215 0.400 A 43 SER CA C 13 55.349 0.400 A 43 SER CB C 13 66.526 0.400 A 43 SER N N 15 111.505 0.400 A 44 TYR H H 1 8.895 0.020 A 44 TYR HA H 1 4.817 0.020 A 44 TYR HBy H 1 3.087 0.020 A 44 TYR HBx H 1 2.792 0.020 A 44 TYR HD1 H 1 7.293 0.020 A 44 TYR HD2 H 1 7.293 0.020 A 44 TYR HE1 H 1 6.884 0.020 A 44 TYR HE2 H 1 6.884 0.020 A 44 TYR C C 13 175.151 0.400 A 44 TYR CA C 13 57.888 0.400 A 44 TYR CB C 13 41.609 0.400 A 44 TYR CD1 C 13 133.680 0.400 A 44 TYR CD2 C 13 133.679 0.400 A 44 TYR CE1 C 13 118.490 0.400 A 44 TYR CE2 C 13 118.489 0.400 A 44 TYR N N 15 123.955 0.400 A 45 ASN H H 1 8.928 0.020 A 45 ASN HA H 1 4.104 0.020 A 45 ASN HBy H 1 2.868 0.020 A 45 ASN HBx H 1 1.787 0.020 A 45 ASN HD2y H 1 7.233 0.020 A 45 ASN HD2x H 1 6.531 0.020 A 45 ASN C C 13 174.862 0.400 A 45 ASN CA C 13 53.369 0.400 A 45 ASN CB C 13 37.215 0.400 A 45 ASN CG C 13 177.452 0.400 A 45 ASN N N 15 128.267 0.400 A 45 ASN ND2 N 15 110.380 0.400 A 46 GLY H H 1 8.508 0.020 A 46 GLY HAy H 1 4.138 0.020 A 46 GLY HAx H 1 3.515 0.020 A 46 GLY C C 13 173.684 0.400 A 46 GLY CA C 13 45.378 0.400 A 46 GLY N N 15 103.761 0.400 A 47 GLN H H 1 7.844 0.020 A 47 GLN HA H 1 4.615 0.020 A 47 GLN HBy H 1 2.131 0.020 A 47 GLN HBx H 1 2.064 0.020 A 47 GLN HGy H 1 2.442 0.020 A 47 GLN HGx H 1 2.350 0.020 A 47 GLN C C 13 174.353 0.400 A 47 GLN CA C 13 54.495 0.400 A 47 GLN CG C 13 33.989 0.400 A 47 GLN N N 15 121.201 0.400 A 48 VAL H H 1 8.406 0.020 A 48 VAL HA H 1 5.298 0.020 A 48 VAL HB H 1 1.821 0.020 A 48 VAL HGx% H 1 0.762 0.020 A 48 VAL HGy% H 1 0.817 0.020 A 48 VAL C C 13 176.591 0.400 A 48 VAL CA C 13 59.993 0.400 A 48 VAL CB C 13 34.816 0.400 A 48 VAL CG1 C 13 20.865 0.400 A 48 VAL CG2 C 13 20.851 0.400 A 48 VAL N N 15 121.830 0.400 A 49 GLY H H 1 8.755 0.020 A 49 GLY HAy H 1 4.138 0.020 A 49 GLY HAx H 1 3.939 0.020 A 49 GLY C C 13 171.140 0.400 A 49 GLY CA C 13 45.746 0.400 A 49 GLY N N 15 111.420 0.400 A 50 TRP H H 1 8.959 0.020 A 50 TRP HA H 1 5.660 0.020 A 50 TRP HBx H 1 2.983 0.020 A 50 TRP HBy H 1 3.421 0.020 A 50 TRP HD1 H 1 7.384 0.020 A 50 TRP HE3 H 1 7.488 0.020 A 50 TRP HH2 H 1 7.152 0.020 A 50 TRP HZ2 H 1 7.443 0.020 A 50 TRP HZ3 H 1 7.126 0.020 A 50 TRP C C 13 176.833 0.400 A 50 TRP CA C 13 56.979 0.400 A 50 TRP CB C 13 32.106 0.400 A 50 TRP CD1 C 13 128.220 0.400 A 50 TRP CE3 C 13 120.700 0.400 A 50 TRP CH2 C 13 124.860 0.400 A 50 TRP CZ2 C 13 114.840 0.400 A 50 TRP CZ3 C 13 122.410 0.400 A 50 TRP N N 15 120.558 0.400 A 51 PHE H H 1 9.620 0.020 A 51 PHE HA H 1 5.203 0.020 A 51 PHE HBy H 1 3.334 0.020 A 51 PHE HBx H 1 2.619 0.020 A 51 PHE HD1 H 1 6.972 0.020 A 51 PHE HD2 H 1 6.972 0.020 A 51 PHE HE1 H 1 6.880 0.020 A 51 PHE HE2 H 1 6.880 0.020 A 51 PHE HZ H 1 7.131 0.020 A 51 PHE CA C 13 55.765 0.400 A 51 PHE CB C 13 38.634 0.400 A 51 PHE CD1 C 13 134.650 0.400 A 51 PHE CD2 C 13 134.649 0.400 A 51 PHE CE1 C 13 129.541 0.400 A 51 PHE CE2 C 13 129.540 0.400 A 51 PHE CZ C 13 130.950 0.400 A 51 PHE N N 15 117.580 0.400 A 52 PRO HA H 1 3.639 0.020 A 52 PRO HBy H 1 1.531 0.020 A 52 PRO HBx H 1 1.239 0.020 A 52 PRO HDy H 1 2.597 0.020 A 52 PRO HDx H 1 2.260 0.020 A 52 PRO HGy H 1 0.899 0.020 A 52 PRO HGx H 1 0.421 0.020 A 52 PRO C C 13 178.796 0.400 A 52 PRO CA C 13 61.480 0.400 A 52 PRO CB C 13 30.318 0.400 A 52 PRO CD C 13 49.898 0.400 A 52 PRO CG C 13 27.487 0.400 A 53 SER H H 1 7.997 0.020 A 53 SER HA H 1 2.812 0.020 A 53 SER HBy H 1 1.835 0.020 A 53 SER HBx H 1 1.633 0.020 A 53 SER C C 13 174.909 0.400 A 53 SER CA C 13 60.777 0.400 A 53 SER CB C 13 60.897 0.400 A 53 SER N N 15 120.294 0.400 A 54 ASN H H 1 8.052 0.020 A 54 ASN HA H 1 4.485 0.020 A 54 ASN HBy H 1 2.754 0.020 A 54 ASN HBx H 1 2.578 0.020 A 54 ASN C C 13 175.243 0.400 A 54 ASN CA C 13 54.393 0.400 A 54 ASN CB C 13 36.609 0.400 A 54 ASN N N 15 115.637 0.400 A 55 TYR H H 1 7.743 0.020 A 55 TYR HA H 1 4.346 0.020 A 55 TYR HBy H 1 3.301 0.020 A 55 TYR HBx H 1 2.911 0.020 A 55 TYR HD1 H 1 7.120 0.020 A 55 TYR HD2 H 1 7.120 0.020 A 55 TYR C C 13 175.053 0.400 A 55 TYR CA C 13 59.633 0.400 A 55 TYR CB C 13 38.289 0.400 A 55 TYR CD1 C 13 133.190 0.400 A 55 TYR CD2 C 13 133.189 0.400 A 55 TYR N N 15 118.479 0.400 A 56 VAL H H 1 7.500 0.020 A 56 VAL HA H 1 5.457 0.020 A 56 VAL HB H 1 2.006 0.020 A 56 VAL HGx% H 1 0.550 0.020 A 56 VAL HGy% H 1 0.869 0.020 A 56 VAL C C 13 174.229 0.400 A 56 VAL CA C 13 58.329 0.400 A 56 VAL CB C 13 35.347 0.400 A 56 VAL CG1 C 13 21.816 0.400 A 56 VAL CG2 C 13 19.518 0.400 A 56 VAL N N 15 109.861 0.400 A 57 THR H H 1 9.098 0.020 A 57 THR HA H 1 4.813 0.020 A 57 THR HB H 1 4.052 0.020 A 57 THR HG2% H 1 1.274 0.020 A 57 THR C C 13 174.019 0.400 A 57 THR CA C 13 60.040 0.400 A 57 THR CB C 13 70.857 0.400 A 57 THR CG2 C 13 20.994 0.400 A 57 THR N N 15 113.952 0.400 A 58 GLU H H 1 9.091 0.020 A 58 GLU HA H 1 4.540 0.020 A 58 GLU HBy H 1 2.299 0.020 A 58 GLU HBx H 1 2.135 0.020 A 58 GLU HGy H 1 2.466 0.020 A 58 GLU HGx H 1 2.358 0.020 A 58 GLU C C 13 176.206 0.400 A 58 GLU CA C 13 57.449 0.400 A 58 GLU CB C 13 31.021 0.400 A 58 GLU CG C 13 37.567 0.400 A 58 GLU N N 15 126.127 0.400 A 59 GLU H H 1 8.423 0.020 A 59 GLU HA H 1 4.392 0.020 A 59 GLU HBy H 1 2.071 0.020 A 59 GLU HBx H 1 1.942 0.020 A 59 GLU HGx H 1 2.258 0.020 A 59 GLU HGy H 1 2.258 0.020 A 59 GLU C C 13 176.077 0.400 A 59 GLU CA C 13 56.688 0.400 A 59 GLU CB C 13 30.377 0.400 A 59 GLU CG C 13 36.282 0.400 A 59 GLU N N 15 121.917 0.400 A 60 GLY H H 1 8.197 0.020 A 60 GLY HAy H 1 3.814 0.020 A 60 GLY HAx H 1 3.800 0.020 A 60 GLY C C 13 172.665 0.400 A 60 GLY CA C 13 45.042 0.400 A 60 GLY N N 15 110.428 0.400 A 61 ASP H H 1 7.767 0.020 A 61 ASP HA H 1 4.373 0.020 A 61 ASP HBy H 1 2.619 0.020 A 61 ASP HBx H 1 2.534 0.020 A 61 ASP CA C 13 55.773 0.400 A 61 ASP CB C 13 42.279 0.400 A 61 ASP N N 15 125.532 0.400 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 10 LYS H A 56 VAL HA 1.0 . 3.52 2 2 A 10 LYS H A 10 LYS HBx 1.0 . 2.92 3 3 A 10 LYS H A 9 VAL HA 1.0 . 2.60 4 4 A 10 LYS H A 9 VAL HGy% 1.0 . 3.81 5 5 A 24 ILE H A 25 LYS H 1.0 . 4.11 6 6 A 25 LYS H A 12 ASN HA 1.0 . 3.24 7 7 A 25 LYS H A 24 ILE HA 1.0 . 2.42 8 8 A 25 LYS H A 25 LYS HBx 1.0 . 2.70 9 9 A 25 LYS H A 25 LYS HBy 1.0 . 2.82 10 10 A 25 LYS H A 25 LYS HGx 1.0 . 4.15 11 10 A 25 LYS H A 25 LYS HGy 1.0 . 4.15 12 11 A 25 LYS H A 24 ILE HG2% 1.0 . 3.38 13 12 A 25 LYS H A 9 VAL HGx% 1.0 . 4.32 14 13 A 6 PRO HA A 31 VAL H 1.0 . 4.10 15 14 A 31 VAL H A 31 VAL HB 1.0 . 2.95 16 15 A 31 VAL H A 30 ILE HG2% 1.0 . 3.81 17 16 A 31 VAL H A 30 ILE HA 1.0 . 2.68 18 17 A 31 VAL H A 31 VAL HGy% 1.0 . 3.16 19 18 A 13 TYR HBx A 14 MET H 1.0 . 5.50 20 19 A 14 MET H A 13 TYR HA 1.0 . 2.57 21 20 A 14 MET HA A 15 ALA H 1.0 . 2.68 22 21 A 15 ALA H A 15 ALA HB% 1.0 . 3.03 23 22 A 15 ALA H A 22 SER HA 1.0 . 4.85 24 23 A 7 ALA HB% A 58 GLU H 1.0 . 5.50 25 24 A 58 GLU H A 57 THR HG2% 1.0 . 5.50 26 25 A 58 GLU H A 57 THR HA 1.0 . 2.79 27 26 A 32 MET H A 42 GLY H 1.0 . 5.43 28 27 A 32 MET H A 43 SER H 1.0 . 5.50 29 28 A 32 MET H A 33 GLU H 1.0 . 3.08 30 29 A 32 MET H A 42 GLY HAx 1.0 . 4.18 31 30 A 32 MET H A 31 VAL HA 1.0 . 2.70 32 31 A 32 MET H A 32 MET HBx 1.0 . 3.52 33 32 A 32 MET H A 31 VAL HGx% 1.0 . 3.84 34 33 A 32 MET H A 42 GLY HAy 1.0 . 4.18 35 34 A 39 TRP HA A 40 TRP H 1.0 . 3.23 36 35 A 20 GLU HA A 21 LEU H 1.0 . 2.82 37 36 A 21 LEU H A 20 GLU HBx 1.0 . 4.48 38 37 A 21 LEU H A 21 LEU HBx 1.0 . 3.31 39 38 A 21 LEU H A 20 GLU HBy 1.0 . 4.48 40 39 A 44 TYR H A 47 GLN H 1.0 . 3.63 41 40 A 44 TYR H A 43 SER HA 1.0 . 2.51 42 41 A 44 TYR H A 48 VAL HA 1.0 . 4.19 43 42 A 44 TYR H A 44 TYR HBx 1.0 . 4.11 44 43 A 44 TYR H A 21 LEU HDy% 1.0 . 4.51 45 44 A 44 TYR H A 21 LEU HDx% 1.0 . 4.51 46 45 A 9 VAL H A 8 TYR HBx 1.0 . 4.01 47 45 A 8 TYR HBy A 9 VAL H 1.0 . 4.01 48 46 A 9 VAL H A 8 TYR HA 1.0 . 2.48 49 47 A 9 VAL H A 9 VAL HB 1.0 . 2.87 50 48 A 24 ILE H A 23 LEU HBy 1.0 . 3.91 51 49 A 24 ILE H A 24 ILE HG2% 1.0 . 5.14 52 50 A 9 VAL HGy% A 9 VAL H 1.0 . 2.90 53 51 A 9 VAL HGy% A 24 ILE H 1.0 . 3.04 54 52 A 10 LYS H A 9 VAL H 1.0 . 5.13 55 53 A 9 VAL H A 28 LYS HA 1.0 . 3.91 56 54 A 24 ILE H A 24 ILE HB 1.0 . 3.04 57 55 A 24 ILE H A 24 ILE HG1y 1.0 . 4.18 58 56 A 24 ILE H A 23 LEU HA 1.0 . 2.83 59 57 A 7 ALA H A 29 VAL H 1.0 . 3.27 60 58 A 28 LYS HA A 7 ALA H 1.0 . 4.69 61 59 A 6 PRO HA A 7 ALA H 1.0 . 2.54 62 60 A 30 ILE HA A 7 ALA H 1.0 . 3.96 63 61 A 7 ALA H A 6 PRO HBx 1.0 . 3.97 64 62 A 7 ALA H A 28 LYS HBy 1.0 . 5.09 65 63 A 7 ALA H A 28 LYS HBx 1.0 . 5.50 66 64 A 7 ALA HB% A 7 ALA H 1.0 . 3.06 67 65 A 7 ALA H A 28 LYS HGx 1.0 . 3.33 68 66 A 7 ALA H A 6 PRO HBy 1.0 . 3.97 69 67 A 43 SER H A 30 ILE H 1.0 . 3.14 70 68 A 30 ILE H A 29 VAL HA 1.0 . 2.77 71 69 A 30 ILE H A 30 ILE HB 1.0 . 2.86 72 70 A 30 ILE H A 29 VAL HB 1.0 . 3.03 73 71 A 30 ILE H A 30 ILE HG1x 1.0 . 3.17 74 72 A 30 ILE HG2% A 30 ILE H 1.0 . 4.37 75 73 A 30 ILE H A 30 ILE HD1% 1.0 . 4.64 76 74 A 30 ILE H A 29 VAL HG2% 1.0 . 4.35 77 75 A 58 GLU H A 59 GLU H 1.0 . 3.77 78 76 A 59 GLU H A 60 GLY H 1.0 . 3.56 79 77 A 59 GLU H A 58 GLU HBy 1.0 . 2.98 80 78 A 57 THR HG2% A 59 GLU H 1.0 . 4.00 81 79 A 47 GLN HA A 48 VAL H 1.0 . 2.70 82 80 A 59 GLU H A 58 GLU HBx 1.0 . 2.98 83 81 A 48 VAL H A 48 VAL HB 1.0 . 3.01 84 82 A 48 VAL H A 48 VAL HGy% 1.0 . 3.90 85 83 A 22 SER HA A 23 LEU H 1.0 . 2.85 86 84 A 13 TYR HBx A 23 LEU H 1.0 . 4.82 87 85 A 23 LEU H A 23 LEU HBx 1.0 . 3.12 88 86 A 15 ALA HB% A 16 GLU H 1.0 . 4.46 89 87 A 16 GLU H A 15 ALA HA 1.0 . 2.65 90 88 A 16 GLU H A 20 GLU HBx 1.0 . 5.26 91 89 A 14 MET H A 13 TYR H 1.0 . 4.60 92 90 A 13 TYR H A 12 ASN H 1.0 . 4.53 93 91 A 47 GLN H A 46 GLY H 1.0 . 3.40 94 92 A 49 GLY HAy A 50 TRP H 1.0 . 3.60 95 93 A 20 GLU HA A 50 TRP H 1.0 . 3.63 96 94 A 23 LEU H A 13 TYR H 1.0 . 3.25 97 95 A 12 ASN HA A 13 TYR H 1.0 . 2.42 98 96 A 24 ILE HA A 13 TYR H 1.0 . 5.03 99 97 A 13 TYR HBx A 13 TYR H 1.0 . 4.12 100 98 A 23 LEU HBx A 13 TYR H 1.0 . 3.19 101 99 A 23 LEU HBy A 13 TYR H 1.0 . 4.24 102 100 A 17 ARG HA A 18 GLU H 1.0 . 3.17 103 101 A 18 GLU H A 18 GLU HBx 1.0 . 4.08 104 101 A 18 GLU H A 18 GLU HBy 1.0 . 4.08 105 102 A 9 VAL H A 29 VAL H 1.0 . 4.52 106 103 A 8 TYR H A 58 GLU HA 1.0 . 4.20 107 104 A 8 TYR H A 56 VAL HB 1.0 . 4.90 108 105 A 8 TYR H A 7 ALA HA 1.0 . 2.63 109 106 A 8 TYR H A 8 TYR HBx 1.0 . 2.74 110 106 A 8 TYR HBy A 8 TYR H 1.0 . 2.74 111 107 A 7 ALA HB% A 8 TYR H 1.0 . 3.53 112 108 A 57 THR HG2% A 8 TYR H 1.0 . 3.84 113 109 A 53 SER H A 55 TYR H 1.0 . 5.15 114 110 A 39 TRP HA A 53 SER H 1.0 . 4.99 115 111 A 4 ASN H A 5 MET H 1.0 . 3.55 116 112 A 31 VAL HB A 5 MET H 1.0 . 4.25 117 113 A 5 MET H A 32 MET HA 1.0 . 3.68 118 114 A 5 MET H A 4 ASN HA 1.0 . 2.86 119 115 A 5 MET H A 5 MET HBy 1.0 . 3.30 120 116 A 5 MET H A 5 MET HBx 1.0 . 3.30 121 117 A 31 VAL H A 5 MET H 1.0 . 5.14 122 118 A 30 ILE HG2% A 5 MET H 1.0 . 5.01 123 119 A 28 LYS HA A 29 VAL H 1.0 . 2.44 124 120 A 8 TYR HA A 29 VAL H 1.0 . 3.73 125 121 A 29 VAL H A 29 VAL HG1% 1.0 . 3.48 126 122 A 15 ALA H A 22 SER H 1.0 . 4.44 127 123 A 22 SER H A 22 SER HBy 1.0 . 3.92 128 124 A 22 SER H A 21 LEU HG 1.0 . 5.24 129 125 A 22 SER H A 21 LEU HA 1.0 . 2.50 130 126 A 22 SER H A 22 SER HBx 1.0 . 3.92 131 127 A 21 LEU HBx A 22 SER H 1.0 . 4.60 132 128 A 15 ALA HB% A 22 SER H 1.0 . 5.15 133 129 A 55 TYR H A 56 VAL H 1.0 . 3.29 134 130 A 55 TYR H A 54 ASN H 1.0 . 3.11 135 131 A 4 ASN H A 32 MET HA 1.0 . 3.13 136 132 A 4 ASN H A 4 ASN HA 1.0 . 2.83 137 133 A 27 THR HA A 28 LYS H 1.0 . 2.82 138 134 A 28 LYS H A 27 THR HB 1.0 . 2.70 139 135 A 28 LYS HBx A 28 LYS H 1.0 . 2.84 140 136 A 28 LYS H A 27 THR HG2% 1.0 . 3.96 141 137 A 33 GLU H A 32 MET HBx 1.0 . 4.30 142 138 A 19 ASP H A 20 GLU H 1.0 . 3.24 143 139 A 20 GLU H A 50 TRP HD1 1.0 . 5.04 144 140 A 25 LYS H A 12 ASN H 1.0 . 3.86 145 141 A 12 ASN H A 11 PHE H 1.0 . 4.50 146 142 A 12 ASN H A 11 PHE HA 1.0 . 2.57 147 143 A 25 LYS HBx A 12 ASN H 1.0 . 4.35 148 144 A 25 LYS HBy A 12 ASN H 1.0 . 4.04 149 145 A 15 ALA HA A 17 ARG H 1.0 . 5.05 150 146 A 20 GLU H A 17 ARG H 1.0 . 5.12 151 147 A 16 GLU H A 17 ARG H 1.0 . 2.83 152 148 A 17 ARG H A 17 ARG HBy 1.0 . 3.73 153 149 A 17 ARG H A 17 ARG HBx 1.0 . 3.73 154 150 A 15 ALA HB% A 17 ARG H 1.0 . 4.79 155 151 A 19 ASP H A 18 GLU HBx 1.0 . 4.19 156 151 A 18 GLU HBy A 19 ASP H 1.0 . 4.19 157 152 A 42 GLY H A 41 ARG HA 1.0 . 2.86 158 153 A 11 PHE H A 25 LYS HA 1.0 . 4.47 159 154 A 10 LYS H A 11 PHE H 1.0 . 2.75 160 155 A 9 VAL HA A 11 PHE H 1.0 . 4.25 161 156 A 10 LYS HBx A 11 PHE H 1.0 . 3.29 162 157 A 9 VAL HGx% A 11 PHE H 1.0 . 3.12 163 158 A 26 GLY H A 25 LYS HGx 1.0 . 3.30 164 158 A 25 LYS HGy A 26 GLY H 1.0 . 3.30 165 159 A 9 VAL HB A 26 GLY H 1.0 . 3.18 166 160 A 25 LYS HBx A 26 GLY H 1.0 . 4.58 167 161 A 9 VAL H A 26 GLY H 1.0 . 4.21 168 162 A 25 LYS HA A 26 GLY H 1.0 . 2.57 169 163 A 9 VAL HGx% A 26 GLY H 1.0 . 3.95 170 164 A 43 SER H A 30 ILE HB 1.0 . 3.81 171 165 A 43 SER H A 42 GLY HAy 1.0 . 3.18 172 166 A 43 SER H A 42 GLY HAx 1.0 . 3.18 173 167 A 48 VAL HA A 49 GLY H 1.0 . 2.76 174 168 A 44 TYR H A 49 GLY H 1.0 . 5.11 175 169 A 60 GLY H A 59 GLU HA 1.0 . 2.84 176 170 A 56 VAL H A 56 VAL HGx% 1.0 . 4.08 177 171 A 56 VAL H A 56 VAL HGy% 1.0 . 3.01 178 172 A 26 GLY H A 27 THR H 1.0 . 2.91 179 173 A 9 VAL H A 27 THR H 1.0 . 4.72 180 174 A 24 ILE H A 27 THR H 1.0 . 5.12 181 175 A 25 LYS HA A 27 THR H 1.0 . 4.02 182 176 A 9 VAL HB A 27 THR H 1.0 . 3.19 183 177 A 27 THR HG2% A 27 THR H 1.0 . 2.92 184 178 A 9 VAL HGy% A 27 THR H 1.0 . 3.82 185 179 A 46 GLY H A 45 ASN HA 1.0 . 3.25 186 180 A 49 GLY H A 48 VAL HGx% 1.0 . 3.42 187 181 A 48 VAL HB A 49 GLY H 1.0 . 5.31 188 182 A 42 GLY H A 51 PHE HE% 1.0 . 4.43 189 183 A 47 GLN H A 48 VAL H 1.0 . 5.21 190 184 A 2 SER HA A 3 LEU H 1.0 . 3.22 191 185 A 4 ASN H A 32 MET HGy 1.0 . 5.50 192 186 A 31 VAL HA A 5 MET H 1.0 . 5.50 193 187 A 7 ALA H A 30 ILE HD1% 1.0 . 5.42 194 188 A 7 ALA H A 29 VAL HG2% 1.0 . 5.45 195 189 A 12 ASN H A 25 LYS HGx 1.0 . 5.48 196 189 A 25 LYS HGy A 12 ASN H 1.0 . 5.48 197 190 A 14 MET H A 13 TYR HBy 1.0 . 5.40 198 191 A 16 GLU H A 20 GLU HBy 1.0 . 5.26 199 192 A 19 ASP H A 18 GLU HGx 1.0 . 5.50 200 192 A 19 ASP H A 18 GLU HGy 1.0 . 5.50 201 193 A 25 LYS H A 23 LEU HBy 1.0 . 5.31 202 194 A 24 ILE HG2% A 27 THR H 1.0 . 5.34 203 195 A 32 MET H A 32 MET HGx 1.0 . 5.20 204 196 A 43 SER H A 31 VAL HA 1.0 . 4.23 205 197 A 30 ILE HA A 43 SER H 1.0 . 5.50 206 198 A 51 PHE HA A 52 PRO HDy 1.0 . 3.06 207 199 A 21 LEU HBx A 21 LEU HG 1.0 . 2.73 208 200 A 21 LEU HBx A 51 PHE HD% 1.0 . 4.16 209 201 A 21 LEU HBx A 51 PHE HBx 1.0 . 4.13 210 202 A 21 LEU HBx A 21 LEU HDy% 1.0 . 3.34 211 203 A 21 LEU HBy A 21 LEU HDy% 1.0 . 3.38 212 204 A 21 LEU HBy A 21 LEU HDx% 1.0 . 3.38 213 205 A 49 GLY HAy A 48 VAL HGx% 1.0 . 3.47 214 206 A 48 VAL HGy% A 49 GLY HAy 1.0 . 4.28 215 207 A 9 VAL HGx% A 23 LEU HBx 1.0 . 3.30 216 208 A 9 VAL HGx% A 23 LEU HBy 1.0 . 2.53 217 209 A 9 VAL HGy% A 23 LEU HBy 1.0 . 2.77 218 210 A 17 ARG HDy A 17 ARG HBy 1.0 . 3.43 219 210 A 17 ARG HBy A 17 ARG HDx 1.0 . 3.43 220 211 A 17 ARG HDy A 17 ARG HGx 1.0 . 2.66 221 211 A 17 ARG HDx A 17 ARG HGx 1.0 . 2.66 222 212 A 41 ARG HDy A 41 ARG HBy 1.0 . 3.47 223 212 A 41 ARG HBy A 41 ARG HDx 1.0 . 3.47 224 213 A 13 TYR HBx A 23 LEU HBx 1.0 . 2.70 225 214 A 13 TYR HBx A 23 LEU HBy 1.0 . 4.16 226 215 A 25 LYS HBy A 25 LYS HEx 1.0 . 4.28 227 215 A 25 LYS HBy A 25 LYS HEy 1.0 . 4.28 228 216 A 25 LYS HEy A 25 LYS HGx 1.0 . 2.40 229 216 A 25 LYS HEx A 25 LYS HGx 1.0 . 2.40 230 216 A 25 LYS HGy A 25 LYS HEx 1.0 . 2.40 231 216 A 25 LYS HGy A 25 LYS HEy 1.0 . 2.40 232 217 A 11 PHE HA A 25 LYS HEx 1.0 . 4.49 233 217 A 11 PHE HA A 25 LYS HEy 1.0 . 4.49 234 218 A 28 LYS HBx A 28 LYS HEx 1.0 . 2.66 235 218 A 28 LYS HBx A 28 LYS HEy 1.0 . 2.66 236 219 A 28 LYS HDx A 28 LYS HEx 1.0 . 2.79 237 219 A 28 LYS HDy A 28 LYS HEx 1.0 . 2.79 238 219 A 28 LYS HEy A 28 LYS HDx 1.0 . 2.79 239 219 A 28 LYS HEy A 28 LYS HDy 1.0 . 2.79 240 220 A 10 LYS HBy A 10 LYS HEy 1.0 . 4.54 241 221 A 10 LYS HBy A 10 LYS HEx 1.0 . 4.54 242 222 A 10 LYS HDy A 10 LYS HEx 1.0 . 2.85 243 222 A 10 LYS HDx A 10 LYS HEx 1.0 . 2.85 244 223 A 34 LYS HGx A 34 LYS HEy 1.0 . 4.09 245 224 A 8 TYR HA A 8 TYR HBx 1.0 . 2.43 246 224 A 8 TYR HBy A 8 TYR HA 1.0 . 2.43 247 225 A 57 THR HG2% A 8 TYR HBx 1.0 . 2.76 248 225 A 57 THR HG2% A 8 TYR HBy 1.0 . 2.76 249 226 A 19 ASP HA A 19 ASP HBy 1.0 . 2.76 250 227 A 19 ASP HA A 19 ASP HBx 1.0 . 2.76 251 228 A 24 ILE HB A 24 ILE HG1x 1.0 . 2.40 252 229 A 24 ILE HB A 27 THR HG2% 1.0 . 2.40 253 230 A 30 ILE HB A 30 ILE HG1y 1.0 . 2.40 254 231 A 54 ASN HA A 54 ASN HBy 1.0 . 3.01 255 232 A 59 GLU HA A 59 GLU HGx 1.0 . 3.11 256 232 A 59 GLU HA A 59 GLU HGy 1.0 . 3.11 257 233 A 59 GLU HGy A 59 GLU HBy 1.0 . 2.55 258 233 A 59 GLU HBy A 59 GLU HGx 1.0 . 2.55 259 234 A 32 MET HBy A 32 MET HE% 1.0 . 2.51 260 235 A 32 MET HBy A 33 GLU HBx 1.0 . 4.16 261 235 A 32 MET HBy A 33 GLU HBy 1.0 . 4.16 262 236 A 33 GLU HA A 33 GLU HGx 1.0 . 3.30 263 236 A 33 GLU HA A 33 GLU HGy 1.0 . 3.30 264 237 A 33 GLU HBx A 33 GLU HGx 1.0 . 2.40 265 237 A 33 GLU HBy A 33 GLU HGx 1.0 . 2.40 266 237 A 33 GLU HGy A 33 GLU HBx 1.0 . 2.40 267 237 A 33 GLU HBy A 33 GLU HGy 1.0 . 2.40 268 238 A 31 VAL HB A 5 MET HBy 1.0 . 3.60 269 239 A 17 ARG HDy A 17 ARG HBx 1.0 . 3.43 270 239 A 17 ARG HBx A 17 ARG HDx 1.0 . 3.43 271 240 A 31 VAL HGx% A 40 TRP HBx 1.0 . 4.21 272 241 A 15 ALA HA A 20 GLU HBy 1.0 . 4.16 273 242 A 39 TRP HE3 A 50 TRP HBy 1.0 . 4.21 274 243 A 31 VAL HB A 5 MET HBx 1.0 . 3.60 275 244 A 32 MET HBx A 32 MET HGy 1.0 . 2.48 276 245 A 32 MET HGx A 32 MET HBy 1.0 . 2.70 277 246 A 32 MET HBx A 32 MET HGx 1.0 . 3.04 278 247 A 59 GLU HGy A 59 GLU HBx 1.0 . 2.55 279 247 A 59 GLU HBx A 59 GLU HGx 1.0 . 2.55 280 248 A 18 GLU HBx A 18 GLU HGx 1.0 . 2.40 281 248 A 18 GLU HBy A 18 GLU HGx 1.0 . 2.40 282 248 A 18 GLU HGy A 18 GLU HBx 1.0 . 2.40 283 248 A 18 GLU HBy A 18 GLU HGy 1.0 . 2.40 284 249 A 25 LYS HGy A 25 LYS HDy 1.0 . 2.55 285 249 A 25 LYS HDy A 25 LYS HGx 1.0 . 2.55 286 250 A 25 LYS HEy A 25 LYS HDy 1.0 . 2.94 287 250 A 25 LYS HDy A 25 LYS HEx 1.0 . 2.94 288 251 A 25 LYS HEy A 25 LYS HDx 1.0 . 2.94 289 251 A 25 LYS HDx A 25 LYS HEx 1.0 . 2.94 290 252 A 25 LYS HGy A 25 LYS HDx 1.0 . 2.55 291 252 A 25 LYS HDx A 25 LYS HGx 1.0 . 2.55 292 253 A 28 LYS HGx A 28 LYS HDx 1.0 . 2.56 293 253 A 28 LYS HGx A 28 LYS HDy 1.0 . 2.56 294 254 A 10 LYS HEy A 10 LYS HDx 1.0 . 2.85 295 254 A 10 LYS HDy A 10 LYS HEy 1.0 . 2.85 296 255 A 10 LYS HDy A 10 LYS HGy 1.0 . 2.94 297 255 A 10 LYS HDx A 10 LYS HGy 1.0 . 2.94 298 256 A 10 LYS HBy A 10 LYS HDx 1.0 . 2.73 299 256 A 10 LYS HBy A 10 LYS HDy 1.0 . 2.73 300 257 A 10 LYS HDy A 10 LYS HGx 1.0 . 2.94 301 257 A 10 LYS HGx A 10 LYS HDx 1.0 . 2.94 302 258 A 17 ARG HDy A 17 ARG HGy 1.0 . 2.66 303 258 A 17 ARG HGy A 17 ARG HDx 1.0 . 2.66 304 259 A 17 ARG HA A 17 ARG HGx 1.0 . 3.62 305 260 A 24 ILE HA A 24 ILE HG1x 1.0 . 3.91 306 261 A 30 ILE HA A 30 ILE HG1y 1.0 . 4.24 307 262 A 30 ILE HB A 30 ILE HG1x 1.0 . 2.63 308 263 A 23 LEU HA A 23 LEU HG 1.0 . 3.50 309 264 A 13 TYR HD% A 23 LEU HDx% 1.0 . 4.18 310 265 A 51 PHE HD% A 23 LEU HDx% 1.0 . 4.13 311 266 A 23 LEU HBx A 23 LEU HDx% 1.0 . 2.77 312 267 A 23 LEU HBy A 23 LEU HDx% 1.0 . 2.74 313 268 A 23 LEU HDx% A 51 PHE HBy 1.0 . 4.33 314 269 A 9 VAL HA A 9 VAL HGx% 1.0 . 2.83 315 270 A 28 LYS HBy A 28 LYS HGx 1.0 . 2.58 316 271 A 28 LYS HGy A 28 LYS HDx 1.0 . 2.55 317 271 A 28 LYS HDy A 28 LYS HGy 1.0 . 2.55 318 272 A 44 TYR HBy A 21 LEU HDy% 1.0 . 4.25 319 273 A 21 LEU HA A 21 LEU HDx% 1.0 . 4.03 320 274 A 21 LEU HBx A 21 LEU HDx% 1.0 . 3.34 321 275 A 9 VAL HGx% A 24 ILE HD1% 1.0 . 4.77 322 276 A 9 VAL HGx% A 23 LEU HDx% 1.0 . 2.69 323 277 A 25 LYS HBx A 25 LYS HGx 1.0 . 2.55 324 277 A 25 LYS HBx A 25 LYS HGy 1.0 . 2.55 325 278 A 25 LYS HBy A 25 LYS HGx 1.0 . 2.40 326 278 A 25 LYS HBy A 25 LYS HGy 1.0 . 2.40 327 279 A 23 LEU HDy% A 21 LEU HDy% 1.0 . 3.54 328 280 A 34 LYS HGx A 34 LYS HEx 1.0 . 4.09 329 281 A 44 TYR HBy A 21 LEU HDx% 1.0 . 4.25 330 282 A 27 THR HB A 44 TYR HE% 1.0 . 2.55 331 283 A 48 VAL HA A 43 SER HBx 1.0 . 4.56 332 284 A 31 VAL HA A 42 GLY HAy 1.0 . 3.05 333 285 A 31 VAL HA A 31 VAL HGx% 1.0 . 2.40 334 286 A 31 VAL HA A 42 GLY HAx 1.0 . 3.05 335 287 A 22 SER HA A 22 SER HBx 1.0 . 2.76 336 288 A 14 MET HA A 22 SER HBx 1.0 . 4.17 337 289 A 56 VAL HA A 9 VAL HA 1.0 . 2.65 338 290 A 56 VAL HGy% A 53 SER HA 1.0 . 3.19 339 291 A 27 THR HA A 27 THR HB 1.0 . 2.55 340 292 A 53 SER HA A 53 SER HBy 1.0 . 2.70 341 293 A 53 SER HA A 53 SER HBx 1.0 . 2.70 342 294 A 48 VAL HA A 48 VAL HB 1.0 . 2.79 343 295 A 48 VAL HA A 48 VAL HGy% 1.0 . 2.40 344 296 A 22 SER HA A 23 LEU HA 1.0 . 4.98 345 297 A 57 THR HA A 58 GLU HA 1.0 . 5.32 346 298 A 57 THR HA A 57 THR HB 1.0 . 3.00 347 299 A 15 ALA HB% A 22 SER HA 1.0 . 4.26 348 300 A 55 TYR HA A 55 TYR HD% 1.0 . 4.26 349 301 A 29 VAL HA A 44 TYR HD% 1.0 . 3.09 350 302 A 29 VAL HA A 44 TYR HBy 1.0 . 4.27 351 303 A 29 VAL HA A 29 VAL HB 1.0 . 2.44 352 304 A 29 VAL HA A 29 VAL HG1% 1.0 . 2.72 353 305 A 6 PRO HA A 30 ILE HA 1.0 . 2.70 354 306 A 24 ILE HA A 23 LEU HA 1.0 . 4.64 355 307 A 30 ILE HA A 30 ILE HG1x 1.0 . 3.00 356 308 A 30 ILE HG2% A 30 ILE HA 1.0 . 2.63 357 309 A 12 ASN HA A 24 ILE HA 1.0 . 2.65 358 310 A 24 ILE HA A 24 ILE HG1y 1.0 . 3.21 359 311 A 24 ILE HA A 24 ILE HG2% 1.0 . 2.40 360 312 A 18 GLU HA A 18 GLU HGx 1.0 . 2.58 361 312 A 18 GLU HGy A 18 GLU HA 1.0 . 2.58 362 313 A 18 GLU HA A 18 GLU HBx 1.0 . 2.40 363 313 A 18 GLU HBy A 18 GLU HA 1.0 . 2.40 364 314 A 35 CYS HA A 35 CYS HBx 1.0 . 2.55 365 314 A 35 CYS HA A 35 CYS HBy 1.0 . 2.55 366 315 A 25 LYS HBy A 25 LYS HA 1.0 . 2.53 367 316 A 25 LYS HA A 25 LYS HGx 1.0 . 2.55 368 316 A 25 LYS HGy A 25 LYS HA 1.0 . 2.55 369 317 A 9 VAL HB A 25 LYS HA 1.0 . 2.93 370 318 A 9 VAL HGx% A 25 LYS HA 1.0 . 2.40 371 319 A 56 VAL HA A 7 ALA HB% 1.0 . 3.95 372 320 A 56 VAL HA A 56 VAL HB 1.0 . 2.55 373 321 A 56 VAL HA A 56 VAL HGy% 1.0 . 4.04 374 322 A 44 TYR HD% A 44 TYR HA 1.0 . 2.85 375 323 A 44 TYR HBy A 44 TYR HA 1.0 . 2.55 376 324 A 39 TRP HA A 40 TRP HD1 1.0 . 4.53 377 325 A 13 TYR HA A 13 TYR HD% 1.0 . 2.70 378 326 A 13 TYR HA A 13 TYR HBy 1.0 . 2.55 379 327 A 2 SER HA A 2 SER HBx 1.0 . 2.45 380 327 A 2 SER HA A 2 SER HBy 1.0 . 2.45 381 328 A 10 LYS HBy A 10 LYS HA 1.0 . 2.89 382 329 A 8 TYR HA A 7 ALA HA 1.0 . 4.58 383 330 A 39 TRP HA A 52 PRO HA 1.0 . 3.10 384 331 A 58 GLU HA A 59 GLU HA 1.0 . 4.67 385 332 A 7 ALA HB% A 58 GLU HA 1.0 . 2.64 386 333 A 50 TRP HA A 50 TRP HE3 1.0 . 3.51 387 334 A 41 ARG HA A 50 TRP HA 1.0 . 2.55 388 335 A 8 TYR HA A 28 LYS HGy 1.0 . 4.28 389 336 A 32 MET HA A 32 MET HGy 1.0 . 2.91 390 337 A 32 MET HA A 32 MET HGx 1.0 . 2.70 391 338 A 32 MET HBx A 32 MET HA 1.0 . 2.77 392 339 A 33 GLU HA A 33 GLU HBx 1.0 . 2.43 393 339 A 33 GLU HBy A 33 GLU HA 1.0 . 2.43 394 340 A 3 LEU HA A 3 LEU HG 1.0 . 4.15 395 341 A 51 PHE HA A 39 TRP HZ3 1.0 . 3.43 396 342 A 51 PHE HA A 13 TYR HE% 1.0 . 4.18 397 343 A 51 PHE HA A 51 PHE HBx 1.0 . 2.70 398 344 A 51 PHE HA A 52 PRO HDx 1.0 . 3.06 399 345 A 40 TRP HD1 A 34 LYS HA 1.0 . 4.12 400 346 A 43 SER HA A 48 VAL HA 1.0 . 2.40 401 347 A 43 SER HA A 43 SER HBy 1.0 . 2.88 402 348 A 43 SER HA A 43 SER HBx 1.0 . 2.88 403 349 A 43 SER HA A 48 VAL HGy% 1.0 . 2.83 404 350 A 20 GLU HA A 50 TRP HBx 1.0 . 3.91 405 351 A 20 GLU HA A 20 GLU HGy 1.0 . 2.85 406 352 A 20 GLU HA A 20 GLU HGx 1.0 . 2.85 407 353 A 34 LYS HA A 40 TRP HA 1.0 . 3.24 408 354 A 34 LYS HGx A 34 LYS HA 1.0 . 4.21 409 355 A 8 TYR HA A 28 LYS HA 1.0 . 2.40 410 356 A 28 LYS HA A 28 LYS HBy 1.0 . 2.40 411 357 A 28 LYS HA A 28 LYS HGy 1.0 . 3.11 412 358 A 11 PHE HA A 11 PHE HD% 1.0 . 3.04 413 359 A 25 LYS HBy A 11 PHE HA 1.0 . 3.10 414 360 A 11 PHE HA A 25 LYS HGx 1.0 . 3.62 415 360 A 25 LYS HGy A 11 PHE HA 1.0 . 3.62 416 361 A 17 ARG HA A 17 ARG HGy 1.0 . 3.62 417 362 A 17 ARG HA A 18 GLU HA 1.0 . 4.46 418 363 A 54 ASN HA A 54 ASN HBx 1.0 . 3.01 419 364 A 12 ASN HA A 9 VAL HGx% 1.0 . 4.17 420 365 A 12 ASN HA A 11 PHE HA 1.0 . 4.84 421 366 A 22 SER HA A 21 LEU HA 1.0 . 5.21 422 367 A 21 LEU HA A 21 LEU HBy 1.0 . 2.55 423 368 A 21 LEU HA A 21 LEU HDy% 1.0 . 4.03 424 369 A 21 LEU HG A 21 LEU HA 1.0 . 3.62 425 370 A 15 ALA HB% A 21 LEU HA 1.0 . 4.20 426 371 A 14 MET HA A 22 SER HBy 1.0 . 4.17 427 372 A 14 MET HA A 22 SER HA 1.0 . 3.69 428 373 A 15 ALA HA A 20 GLU HBx 1.0 . 4.16 429 374 A 40 TRP HD1 A 40 TRP HA 1.0 . 2.40 430 375 A 40 TRP HA A 40 TRP HBy 1.0 . 2.71 431 376 A 5 MET HA A 5 MET HBy 1.0 . 3.05 432 377 A 5 MET HA A 5 MET HBx 1.0 . 3.05 433 378 A 23 LEU HBy A 23 LEU HA 1.0 . 2.61 434 379 A 23 LEU HA A 23 LEU HDy% 1.0 . 2.40 435 380 A 9 VAL HGx% A 23 LEU HA 1.0 . 4.23 436 381 A 58 GLU HA A 7 ALA HA 1.0 . 2.70 437 382 A 5 MET HA A 6 PRO HDy 1.0 . 2.70 438 383 A 5 MET HA A 6 PRO HDx 1.0 . 2.70 439 384 A 9 VAL HA A 9 VAL HGy% 1.0 . 2.40 440 385 A 48 VAL HGy% A 43 SER HBx 1.0 . 2.62 441 386 A 22 SER HA A 22 SER HBy 1.0 . 2.76 442 387 A 31 VAL HGy% A 40 TRP HE3 1.0 . 3.07 443 388 A 31 VAL HGy% A 51 PHE HZ 1.0 . 2.63 444 389 A 31 VAL HGy% A 51 PHE HE% 1.0 . 3.18 445 390 A 31 VAL HGy% A 31 VAL HA 1.0 . 2.54 446 391 A 31 VAL HGy% A 29 VAL HG2% 1.0 . 3.07 447 392 A 7 ALA HB% A 56 VAL HB 1.0 . 2.40 448 393 A 7 ALA HB% A 56 VAL HGy% 1.0 . 3.02 449 394 A 9 VAL HGy% A 23 LEU HBx 1.0 . 3.68 450 395 A 9 VAL HGy% A 24 ILE HB 1.0 . 4.50 451 396 A 9 VAL HGy% A 24 ILE HG1y 1.0 . 4.69 452 397 A 9 VAL HGy% A 29 VAL HG1% 1.0 . 3.00 453 398 A 9 VAL HGy% A 23 LEU HDx% 1.0 . 2.55 454 399 A 31 VAL HGx% A 40 TRP HBy 1.0 . 3.44 455 400 A 51 PHE HD% A 23 LEU HDy% 1.0 . 4.23 456 401 A 27 THR HA A 27 THR HG2% 1.0 . 2.70 457 402 A 27 THR HG2% A 24 ILE HG1x 1.0 . 3.51 458 403 A 24 ILE HG2% A 27 THR HG2% 1.0 . 2.70 459 404 A 27 THR HG2% A 24 ILE HD1% 1.0 . 4.36 460 405 A 9 VAL HGy% A 27 THR HG2% 1.0 . 4.13 461 406 A 31 VAL HGx% A 51 PHE HZ 1.0 . 4.25 462 407 A 56 VAL HGx% A 51 PHE HE% 1.0 . 2.45 463 408 A 56 VAL HA A 56 VAL HGx% 1.0 . 2.53 464 409 A 56 VAL HGx% A 23 LEU HDx% 1.0 . 2.40 465 410 A 31 VAL HGx% A 34 LYS HGx 1.0 . 3.44 466 411 A 23 LEU HBy A 23 LEU HDy% 1.0 . 2.77 467 412 A 23 LEU HDy% A 21 LEU HDx% 1.0 . 3.54 468 413 A 9 VAL HGy% A 23 LEU HDy% 1.0 . 2.48 469 414 A 57 THR HG2% A 57 THR HA 1.0 . 2.77 470 415 A 48 VAL HGy% A 43 SER HBy 1.0 . 2.62 471 416 A 48 VAL HA A 48 VAL HGx% 1.0 . 3.25 472 417 A 48 VAL HGx% A 32 MET HE% 1.0 . 4.49 473 418 A 29 VAL HG1% A 44 TYR HE% 1.0 . 4.21 474 419 A 29 VAL HG1% A 44 TYR HBy 1.0 . 3.03 475 420 A 44 TYR HBx A 29 VAL HG1% 1.0 . 4.11 476 421 A 29 VAL HB A 29 VAL HG1% 1.0 . 2.75 477 422 A 29 VAL HG1% A 23 LEU HDy% 1.0 . 3.22 478 423 A 29 VAL HG1% A 28 LYS HGy 1.0 . 5.33 479 424 A 15 ALA HB% A 20 GLU HBy 1.0 . 3.06 480 425 A 15 ALA HB% A 20 GLU HBx 1.0 . 3.06 481 426 A 15 ALA HB% A 21 LEU HBx 1.0 . 4.49 482 427 A 29 VAL HG2% A 51 PHE HE% 1.0 . 4.21 483 428 A 29 VAL HB A 29 VAL HG2% 1.0 . 2.52 484 429 A 29 VAL HG2% A 23 LEU HDy% 1.0 . 3.67 485 430 A 56 VAL HGy% A 51 PHE HE% 1.0 . 2.40 486 431 A 31 VAL HGy% A 56 VAL HGy% 1.0 . 3.41 487 432 A 56 VAL HGy% A 23 LEU HDx% 1.0 . 4.62 488 433 A 29 VAL HG2% A 56 VAL HGy% 1.0 . 5.11 489 434 A 24 ILE HG2% A 26 GLY HAx 1.0 . 4.84 490 435 A 6 PRO HA A 30 ILE HG2% 1.0 . 4.20 491 436 A 30 ILE HG2% A 4 ASN HA 1.0 . 2.70 492 437 A 30 ILE HG2% A 30 ILE HG1y 1.0 . 2.63 493 438 A 32 MET HA A 32 MET HE% 1.0 . 4.11 494 439 A 32 MET HE% A 43 SER HBy 1.0 . 3.94 495 440 A 32 MET HE% A 43 SER HBx 1.0 . 3.94 496 441 A 48 VAL HGy% A 32 MET HE% 1.0 . 2.55 497 442 A 30 ILE HG2% A 32 MET HE% 1.0 . 4.01 498 443 A 31 VAL HGx% A 32 MET HE% 1.0 . 4.84 499 444 A 24 ILE HA A 24 ILE HD1% 1.0 . 2.77 500 445 A 24 ILE HB A 24 ILE HD1% 1.0 . 3.36 501 446 A 30 ILE HD1% A 28 LYS HDx 1.0 . 4.28 502 446 A 30 ILE HD1% A 28 LYS HDy 1.0 . 4.28 503 447 A 6 PRO HA A 30 ILE HD1% 1.0 . 3.03 504 448 A 30 ILE HA A 30 ILE HD1% 1.0 . 2.62 505 449 A 30 ILE HB A 30 ILE HD1% 1.0 . 3.20 506 450 A 30 ILE HD1% A 28 LYS HGy 1.0 . 4.36 507 451 A 28 LYS HA A 29 VAL HG1% 1.0 . 4.41 508 452 A 29 VAL HG2% A 51 PHE HD% 1.0 . 3.73 509 453 A 51 PHE HD% A 53 SER HA 1.0 . 4.95 510 454 A 56 VAL HGy% A 51 PHE HD% 1.0 . 3.69 511 455 A 27 THR HB A 44 TYR HD% 1.0 . 5.02 512 456 A 29 VAL HB A 44 TYR HD% 1.0 . 4.22 513 457 A 29 VAL HG1% A 44 TYR HD% 1.0 . 3.25 514 458 A 23 LEU HA A 13 TYR HD% 1.0 . 5.20 515 459 A 8 TYR HA A 8 TYR HD% 1.0 . 2.90 516 460 A 28 LYS HBy A 8 TYR HD% 1.0 . 4.02 517 461 A 28 LYS HGx A 8 TYR HD% 1.0 . 3.12 518 462 A 57 THR HG2% A 8 TYR HD% 1.0 . 3.45 519 463 A 28 LYS HGy A 8 TYR HD% 1.0 . 3.66 520 464 A 23 LEU HG A 13 TYR HD% 1.0 . 4.08 521 465 A 55 TYR HA A 11 PHE HD% 1.0 . 3.46 522 466 A 34 LYS HBx A 40 TRP HH2 1.0 . 5.50 523 467 A 56 VAL HGy% A 40 TRP HZ3 1.0 . 3.68 524 468 A 7 ALA HB% A 40 TRP HZ3 1.0 . 4.08 525 469 A 31 VAL HGy% A 40 TRP HZ3 1.0 . 4.25 526 470 A 23 LEU HG A 13 TYR HE% 1.0 . 4.76 527 471 A 27 THR HG2% A 44 TYR HE% 1.0 . 3.61 528 472 A 15 ALA HB% A 13 TYR HE% 1.0 . 4.14 529 473 A 28 LYS HGx A 8 TYR HE% 1.0 . 3.31 530 474 A 43 SER HA A 48 VAL HB 1.0 . 4.93 531 475 A 43 SER HA A 44 TYR HBx 1.0 . 5.50 532 476 A 50 TRP HA A 39 TRP HZ3 1.0 . 5.50 533 477 A 39 TRP HE3 A 50 TRP HA 1.0 . 4.71 534 478 A 40 TRP HA A 34 LYS HBx 1.0 . 5.30 535 479 A 31 VAL HGx% A 40 TRP HA 1.0 . 5.07 536 480 A 15 ALA HB% A 20 GLU HA 1.0 . 4.01 537 481 A 56 VAL HA A 51 PHE HE% 1.0 . 4.91 538 482 A 48 VAL HA A 43 SER HBy 1.0 . 4.56 539 483 A 28 LYS HA A 28 LYS HGx 1.0 . 3.90 540 484 A 9 VAL HGy% A 28 LYS HA 1.0 . 4.19 541 485 A 6 PRO HA A 7 ALA HB% 1.0 . 4.38 542 486 A 6 PRO HA A 31 VAL HGy% 1.0 . 4.75 543 487 A 8 TYR HA A 28 LYS HBy 1.0 . 4.10 544 488 A 8 TYR HA A 28 LYS HGx 1.0 . 3.82 545 489 A 40 TRP HH2 A 34 LYS HGy 1.0 . 5.50 546 490 A 31 VAL HGx% A 40 TRP HZ2 1.0 . 5.45 547 491 A 31 VAL HGx% A 40 TRP HE3 1.0 . 3.65 548 492 A 56 VAL HGy% A 40 TRP HE3 1.0 . 3.75 549 493 A 34 LYS HBx A 40 TRP HZ2 1.0 . 4.52 550 494 A 40 TRP HZ2 A 34 LYS HEx 1.0 . 5.47 551 495 A 40 TRP HZ2 A 34 LYS HEy 1.0 . 5.47 552 496 A 15 ALA HA A 13 TYR HE% 1.0 . 4.07 553 497 A 20 GLU HA A 13 TYR HE% 1.0 . 4.73 554 498 A 51 PHE HE% A 53 SER HA 1.0 . 3.32 555 499 A 28 LYS HBy A 8 TYR HE% 1.0 . 4.39 556 500 A 8 TYR HE% A 28 LYS HDx 1.0 . 4.77 557 500 A 28 LYS HDy A 8 TYR HE% 1.0 . 4.77 558 501 A 39 TRP HA A 50 TRP HE3 1.0 . 5.50 559 502 A 50 TRP HE3 A 40 TRP HA 1.0 . 4.67 560 503 A 40 TRP HA A 50 TRP HZ3 1.0 . 4.65 561 504 A 50 TRP HZ2 A 41 ARG HDx 1.0 . 4.28 562 504 A 41 ARG HDy A 50 TRP HZ2 1.0 . 4.28 563 505 A 51 PHE HA A 39 TRP HE3 1.0 . 4.84 564 506 A 39 TRP HE3 A 52 PRO HA 1.0 . 5.50 565 507 A 51 PHE HA A 51 PHE HD% 1.0 . 4.76 566 508 A 51 PHE HA A 13 TYR HD% 1.0 . 5.50 567 509 A 23 LEU HDy% A 44 TYR HD% 1.0 . 3.87 568 510 A 22 SER HA A 23 LEU HDy% 1.0 . 4.92 569 511 A 51 PHE HBx A 23 LEU HDy% 1.0 . 3.83 570 512 A 44 TYR HBx A 23 LEU HDy% 1.0 . 4.43 571 513 A 51 PHE HBy A 23 LEU HDy% 1.0 . 4.43 572 514 A 13 TYR HBx A 23 LEU HDy% 1.0 . 4.87 573 515 A 21 LEU HBy A 23 LEU HDy% 1.0 . 5.27 574 516 A 41 ARG HDy A 41 ARG HBx 1.0 . 3.47 575 516 A 41 ARG HBx A 41 ARG HDx 1.0 . 3.47 576 517 A 40 TRP HBy A 34 LYS HGy 1.0 . 4.26 577 518 A 34 LYS HGy A 40 TRP HZ2 1.0 . 5.12 578 519 A 40 TRP HA A 34 LYS HGy 1.0 . 4.88 579 520 A 40 TRP HD1 A 34 LYS HGy 1.0 . 4.68 580 521 A 40 TRP HE3 A 34 LYS HGy 1.0 . 4.86 581 522 A 34 LYS HA A 34 LYS HGy 1.0 . 3.64 582 523 A 34 LYS HBx A 34 LYS HGy 1.0 . 2.77 583 524 A 31 VAL HB A 34 LYS HGy 1.0 . 5.50 584 525 A 40 TRP HBx A 34 LYS HGy 1.0 . 5.50 585 526 A 9 VAL HA A 23 LEU HDy% 1.0 . 4.53 586 527 A 50 TRP HZ3 A 35 CYS HBx 1.0 . 4.21 587 527 A 35 CYS HBy A 50 TRP HZ3 1.0 . 4.21 588 528 A 3 LEU H A 3 LEU HBy 1.0 . 3.33 589 528 A 3 LEU H A 3 LEU HBx 1.0 . 3.33 590 529 A 3 LEU HA A 3 LEU HBy 1.0 . 2.50 591 529 A 3 LEU HA A 3 LEU HBx 1.0 . 2.50 592 530 A 3 LEU HA A 3 LEU HDx% 1.0 . 2.40 593 530 A 3 LEU HA A 3 LEU HDy% 1.0 . 2.40 594 531 A 3 LEU HG A 3 LEU HBy 1.0 . 2.31 595 531 A 3 LEU HG A 3 LEU HBx 1.0 . 2.31 596 532 A 3 LEU HBy A 3 LEU HDx% 1.0 . 2.57 597 532 A 3 LEU HDy% A 3 LEU HBy 1.0 . 2.57 598 532 A 3 LEU HBx A 3 LEU HDy% 1.0 . 2.57 599 532 A 3 LEU HBx A 3 LEU HDx% 1.0 . 2.57 600 533 A 4 ASN H A 3 LEU HBy 1.0 . 5.18 601 533 A 4 ASN H A 3 LEU HBx 1.0 . 5.18 602 534 A 4 ASN HA A 4 ASN HBy 1.0 . 2.62 603 534 A 4 ASN HA A 4 ASN HBx 1.0 . 2.62 604 535 A 30 ILE HG2% A 4 ASN HBy 1.0 . 3.31 605 535 A 30 ILE HG2% A 4 ASN HBx 1.0 . 3.31 606 536 A 5 MET H A 5 MET HGy 1.0 . 5.18 607 536 A 5 MET H A 5 MET HGx 1.0 . 5.18 608 537 A 5 MET H A 6 PRO HDx 1.0 . 5.34 609 537 A 5 MET H A 6 PRO HDy 1.0 . 5.34 610 538 A 5 MET HA A 5 MET HGy 1.0 . 3.78 611 538 A 5 MET HA A 5 MET HGx 1.0 . 3.78 612 539 A 5 MET HA A 6 PRO HGy 1.0 . 4.47 613 539 A 5 MET HA A 6 PRO HGx 1.0 . 4.47 614 540 A 5 MET HA A 6 PRO HDx 1.0 . 2.24 615 540 A 5 MET HA A 6 PRO HDy 1.0 . 2.24 616 541 A 5 MET HBx A 5 MET HGy 1.0 . 2.35 617 541 A 5 MET HBy A 5 MET HGy 1.0 . 2.35 618 541 A 5 MET HGx A 5 MET HBx 1.0 . 2.35 619 541 A 5 MET HGx A 5 MET HBy 1.0 . 2.35 620 542 A 5 MET HBx A 6 PRO HDx 1.0 . 4.37 621 542 A 5 MET HBy A 6 PRO HDx 1.0 . 4.37 622 542 A 6 PRO HDy A 5 MET HBx 1.0 . 4.37 623 542 A 6 PRO HDy A 5 MET HBy 1.0 . 4.37 624 543 A 7 ALA H A 6 PRO HBy 1.0 . 3.25 625 543 A 7 ALA H A 6 PRO HBx 1.0 . 3.25 626 544 A 6 PRO HBy A 28 LYS HDx 1.0 . 2.99 627 544 A 6 PRO HBx A 28 LYS HDx 1.0 . 2.99 628 544 A 28 LYS HDy A 6 PRO HBy 1.0 . 2.99 629 544 A 28 LYS HDy A 6 PRO HBx 1.0 . 2.99 630 545 A 30 ILE HD1% A 6 PRO HGy 1.0 . 4.45 631 545 A 30 ILE HD1% A 6 PRO HGx 1.0 . 4.45 632 546 A 7 ALA HB% A 58 GLU HGy 1.0 . 4.11 633 546 A 7 ALA HB% A 58 GLU HGx 1.0 . 4.11 634 547 A 10 LYS HA A 10 LYS HGy 1.0 . 3.02 635 547 A 10 LYS HA A 10 LYS HGx 1.0 . 3.02 636 548 A 10 LYS HBy A 10 LYS HEx 1.0 . 3.83 637 548 A 10 LYS HBy A 10 LYS HEy 1.0 . 3.83 638 549 A 10 LYS HDx A 10 LYS HGy 1.0 . 2.30 639 549 A 10 LYS HDy A 10 LYS HGy 1.0 . 2.30 640 549 A 10 LYS HGx A 10 LYS HDx 1.0 . 2.30 641 549 A 10 LYS HDy A 10 LYS HGx 1.0 . 2.30 642 550 A 10 LYS HEy A 10 LYS HGy 1.0 . 3.33 643 550 A 10 LYS HEx A 10 LYS HGy 1.0 . 3.33 644 550 A 10 LYS HGx A 10 LYS HEx 1.0 . 3.33 645 550 A 10 LYS HGx A 10 LYS HEy 1.0 . 3.33 646 551 A 56 VAL HA A 10 LYS HGy 1.0 . 4.16 647 551 A 56 VAL HA A 10 LYS HGx 1.0 . 4.16 648 552 A 56 VAL HGy% A 10 LYS HGy 1.0 . 4.43 649 552 A 56 VAL HGy% A 10 LYS HGx 1.0 . 4.43 650 553 A 11 PHE HA A 11 PHE HBy 1.0 . 2.43 651 553 A 11 PHE HA A 11 PHE HBx 1.0 . 2.43 652 554 A 11 PHE HA A 25 LYS HDy 1.0 . 3.94 653 554 A 11 PHE HA A 25 LYS HDx 1.0 . 3.94 654 555 A 12 ASN H A 11 PHE HBy 1.0 . 3.16 655 555 A 12 ASN H A 11 PHE HBx 1.0 . 3.16 656 556 A 13 TYR HD% A 52 PRO HGy 1.0 . 5.34 657 556 A 13 TYR HD% A 52 PRO HGx 1.0 . 5.34 658 557 A 13 TYR HE% A 20 GLU HBy 1.0 . 3.97 659 557 A 13 TYR HE% A 20 GLU HBx 1.0 . 3.97 660 558 A 13 TYR HE% A 20 GLU HGx 1.0 . 4.20 661 558 A 13 TYR HE% A 20 GLU HGy 1.0 . 4.20 662 559 A 13 TYR HE% A 52 PRO HGy 1.0 . 4.13 663 559 A 13 TYR HE% A 52 PRO HGx 1.0 . 4.13 664 560 A 13 TYR HE% A 52 PRO HDx 1.0 . 4.16 665 560 A 13 TYR HE% A 52 PRO HDy 1.0 . 4.16 666 561 A 14 MET H A 14 MET HBy 1.0 . 2.87 667 561 A 14 MET H A 14 MET HBx 1.0 . 2.87 668 562 A 14 MET H A 14 MET HGy 1.0 . 5.34 669 562 A 14 MET H A 14 MET HGx 1.0 . 5.34 670 563 A 14 MET HA A 14 MET HBy 1.0 . 2.62 671 563 A 14 MET HA A 14 MET HBx 1.0 . 2.62 672 564 A 14 MET HA A 14 MET HGy 1.0 . 3.78 673 564 A 14 MET HA A 14 MET HGx 1.0 . 3.78 674 565 A 14 MET HA A 22 SER HBy 1.0 . 3.34 675 565 A 14 MET HA A 22 SER HBx 1.0 . 3.34 676 566 A 14 MET HBy A 14 MET HGy 1.0 . 2.09 677 566 A 14 MET HBx A 14 MET HGy 1.0 . 2.09 678 566 A 14 MET HGx A 14 MET HBy 1.0 . 2.09 679 566 A 14 MET HBx A 14 MET HGx 1.0 . 2.09 680 567 A 15 ALA H A 14 MET HGy 1.0 . 5.26 681 567 A 15 ALA H A 14 MET HGx 1.0 . 5.26 682 568 A 15 ALA HA A 20 GLU HBy 1.0 . 3.58 683 568 A 15 ALA HA A 20 GLU HBx 1.0 . 3.58 684 569 A 15 ALA HB% A 20 GLU HBy 1.0 . 2.53 685 569 A 15 ALA HB% A 20 GLU HBx 1.0 . 2.53 686 570 A 15 ALA HB% A 21 LEU HDx% 1.0 . 4.68 687 570 A 15 ALA HB% A 21 LEU HDy% 1.0 . 4.68 688 571 A 16 GLU H A 16 GLU HBy 1.0 . 3.46 689 571 A 16 GLU H A 16 GLU HBx 1.0 . 3.46 690 572 A 16 GLU H A 16 GLU HGy 1.0 . 5.17 691 572 A 16 GLU H A 16 GLU HGx 1.0 . 5.17 692 573 A 16 GLU HA A 16 GLU HBy 1.0 . 2.58 693 573 A 16 GLU HBx A 16 GLU HA 1.0 . 2.58 694 574 A 16 GLU HA A 16 GLU HGy 1.0 . 2.92 695 574 A 16 GLU HGx A 16 GLU HA 1.0 . 2.92 696 575 A 16 GLU HBx A 16 GLU HGy 1.0 . 2.26 697 575 A 16 GLU HBy A 16 GLU HGy 1.0 . 2.26 698 575 A 16 GLU HGx A 16 GLU HBy 1.0 . 2.26 699 575 A 16 GLU HBx A 16 GLU HGx 1.0 . 2.26 700 576 A 17 ARG H A 17 ARG HBx 1.0 . 3.10 701 576 A 17 ARG H A 17 ARG HBy 1.0 . 3.10 702 577 A 17 ARG H A 17 ARG HGx 1.0 . 5.15 703 577 A 17 ARG H A 17 ARG HGy 1.0 . 5.15 704 578 A 17 ARG H A 20 GLU HBy 1.0 . 3.26 705 578 A 17 ARG H A 20 GLU HBx 1.0 . 3.26 706 579 A 17 ARG HA A 17 ARG HGx 1.0 . 3.10 707 579 A 17 ARG HA A 17 ARG HGy 1.0 . 3.10 708 580 A 17 ARG HBy A 17 ARG HGx 1.0 . 2.34 709 580 A 17 ARG HBx A 17 ARG HGx 1.0 . 2.34 710 580 A 17 ARG HGy A 17 ARG HBx 1.0 . 2.34 711 580 A 17 ARG HBy A 17 ARG HGy 1.0 . 2.34 712 581 A 17 ARG HBx A 17 ARG HDx 1.0 . 2.62 713 581 A 17 ARG HBy A 17 ARG HDx 1.0 . 2.62 714 581 A 17 ARG HDy A 17 ARG HBx 1.0 . 2.62 715 581 A 17 ARG HDy A 17 ARG HBy 1.0 . 2.62 716 582 A 17 ARG HDy A 17 ARG HGx 1.0 . 2.23 717 582 A 17 ARG HDx A 17 ARG HGx 1.0 . 2.23 718 582 A 17 ARG HGy A 17 ARG HDx 1.0 . 2.23 719 582 A 17 ARG HDy A 17 ARG HGy 1.0 . 2.23 720 583 A 19 ASP H A 20 GLU HBy 1.0 . 5.34 721 583 A 19 ASP H A 20 GLU HBx 1.0 . 5.34 722 584 A 19 ASP HA A 19 ASP HBx 1.0 . 2.31 723 584 A 19 ASP HA A 19 ASP HBy 1.0 . 2.31 724 585 A 50 TRP HD1 A 19 ASP HBx 1.0 . 4.07 725 585 A 50 TRP HD1 A 19 ASP HBy 1.0 . 4.07 726 586 A 20 GLU H A 20 GLU HBy 1.0 . 2.85 727 586 A 20 GLU H A 20 GLU HBx 1.0 . 2.85 728 587 A 20 GLU HA A 20 GLU HBy 1.0 . 2.53 729 587 A 20 GLU HA A 20 GLU HBx 1.0 . 2.53 730 588 A 20 GLU HA A 20 GLU HGx 1.0 . 2.47 731 588 A 20 GLU HA A 20 GLU HGy 1.0 . 2.47 732 589 A 20 GLU HBx A 20 GLU HGx 1.0 . 2.20 733 589 A 20 GLU HBy A 20 GLU HGx 1.0 . 2.20 734 589 A 20 GLU HGy A 20 GLU HBy 1.0 . 2.20 735 589 A 20 GLU HBx A 20 GLU HGy 1.0 . 2.20 736 590 A 21 LEU H A 20 GLU HBy 1.0 . 3.70 737 590 A 21 LEU H A 20 GLU HBx 1.0 . 3.70 738 591 A 21 LEU H A 20 GLU HGx 1.0 . 4.68 739 591 A 21 LEU H A 20 GLU HGy 1.0 . 4.68 740 592 A 21 LEU HA A 21 LEU HDx% 1.0 . 2.52 741 592 A 21 LEU HA A 21 LEU HDy% 1.0 . 2.52 742 593 A 21 LEU HBy A 21 LEU HDx% 1.0 . 2.96 743 593 A 21 LEU HBy A 21 LEU HDy% 1.0 . 2.96 744 594 A 21 LEU HBx A 21 LEU HDx% 1.0 . 2.82 745 594 A 21 LEU HBx A 21 LEU HDy% 1.0 . 2.82 746 595 A 22 SER H A 21 LEU HDx% 1.0 . 3.94 747 595 A 22 SER H A 21 LEU HDy% 1.0 . 3.94 748 596 A 23 LEU HDy% A 21 LEU HDx% 1.0 . 2.59 749 596 A 23 LEU HDy% A 21 LEU HDy% 1.0 . 2.59 750 597 A 29 VAL HG1% A 21 LEU HDx% 1.0 . 3.78 751 597 A 29 VAL HG1% A 21 LEU HDy% 1.0 . 3.78 752 598 A 29 VAL HG2% A 21 LEU HDx% 1.0 . 3.71 753 598 A 29 VAL HG2% A 21 LEU HDy% 1.0 . 3.71 754 599 A 44 TYR H A 21 LEU HDx% 1.0 . 3.97 755 599 A 44 TYR H A 21 LEU HDy% 1.0 . 3.97 756 600 A 44 TYR HBy A 21 LEU HDx% 1.0 . 3.25 757 600 A 44 TYR HBy A 21 LEU HDy% 1.0 . 3.25 758 601 A 44 TYR HBx A 21 LEU HDx% 1.0 . 3.93 759 601 A 44 TYR HBx A 21 LEU HDy% 1.0 . 3.93 760 602 A 44 TYR HD% A 21 LEU HDx% 1.0 . 4.86 761 602 A 44 TYR HD% A 21 LEU HDy% 1.0 . 4.86 762 603 A 51 PHE HD% A 21 LEU HDx% 1.0 . 3.30 763 603 A 51 PHE HD% A 21 LEU HDy% 1.0 . 3.30 764 604 A 22 SER H A 22 SER HBy 1.0 . 3.15 765 604 A 22 SER H A 22 SER HBx 1.0 . 3.15 766 605 A 22 SER HA A 22 SER HBy 1.0 . 2.35 767 605 A 22 SER HA A 22 SER HBx 1.0 . 2.35 768 606 A 23 LEU HDy% A 22 SER HBy 1.0 . 5.31 769 606 A 23 LEU HDy% A 22 SER HBx 1.0 . 5.31 770 607 A 23 LEU HDx% A 52 PRO HDx 1.0 . 4.44 771 607 A 23 LEU HDx% A 52 PRO HDy 1.0 . 4.44 772 608 A 23 LEU HDx% A 55 TYR HBy 1.0 . 2.69 773 608 A 23 LEU HDx% A 55 TYR HBx 1.0 . 2.69 774 609 A 23 LEU HDy% A 55 TYR HBy 1.0 . 5.34 775 609 A 23 LEU HDy% A 55 TYR HBx 1.0 . 5.34 776 610 A 25 LYS HDy A 25 LYS HGx 1.0 . 2.20 777 610 A 25 LYS HGy A 25 LYS HDy 1.0 . 2.20 778 610 A 25 LYS HGy A 25 LYS HDx 1.0 . 2.20 779 610 A 25 LYS HDx A 25 LYS HGx 1.0 . 2.20 780 611 A 25 LYS HDy A 25 LYS HEx 1.0 . 2.48 781 611 A 25 LYS HDx A 25 LYS HEx 1.0 . 2.48 782 611 A 25 LYS HEy A 25 LYS HDy 1.0 . 2.48 783 611 A 25 LYS HEy A 25 LYS HDx 1.0 . 2.48 784 612 A 30 ILE HA A 42 GLY HAx 1.0 . 5.16 785 612 A 30 ILE HA A 42 GLY HAy 1.0 . 5.16 786 613 A 30 ILE HB A 43 SER HBy 1.0 . 3.34 787 613 A 30 ILE HB A 43 SER HBx 1.0 . 3.34 788 614 A 30 ILE HG2% A 43 SER HBy 1.0 . 4.26 789 614 A 30 ILE HG2% A 43 SER HBx 1.0 . 4.26 790 615 A 30 ILE HG1y A 43 SER HBy 1.0 . 4.39 791 615 A 30 ILE HG1y A 43 SER HBx 1.0 . 4.39 792 616 A 31 VAL HGx% A 34 LYS HDy 1.0 . 3.40 793 616 A 31 VAL HGx% A 34 LYS HDx 1.0 . 3.40 794 617 A 31 VAL HGx% A 34 LYS HEx 1.0 . 3.28 795 617 A 31 VAL HGx% A 34 LYS HEy 1.0 . 3.28 796 618 A 31 VAL HGy% A 34 LYS HDy 1.0 . 4.52 797 618 A 31 VAL HGy% A 34 LYS HDx 1.0 . 4.52 798 619 A 33 GLU HBx A 41 ARG HBx 1.0 . 3.09 799 619 A 33 GLU HBy A 41 ARG HBx 1.0 . 3.09 800 619 A 41 ARG HBy A 33 GLU HBx 1.0 . 3.09 801 619 A 33 GLU HBy A 41 ARG HBy 1.0 . 3.09 802 620 A 33 GLU HGy A 41 ARG HBx 1.0 . 4.49 803 620 A 41 ARG HBy A 33 GLU HGx 1.0 . 4.49 804 620 A 33 GLU HGy A 41 ARG HBy 1.0 . 4.49 805 620 A 33 GLU HGx A 41 ARG HBx 1.0 . 4.49 806 621 A 34 LYS HBy A 34 LYS HDy 1.0 . 3.22 807 621 A 34 LYS HDx A 34 LYS HBy 1.0 . 3.22 808 622 A 34 LYS HBx A 34 LYS HDy 1.0 . 2.90 809 622 A 34 LYS HBx A 34 LYS HDx 1.0 . 2.90 810 623 A 34 LYS HGy A 34 LYS HEx 1.0 . 3.67 811 623 A 34 LYS HGy A 34 LYS HEy 1.0 . 3.67 812 624 A 34 LYS HGx A 34 LYS HEx 1.0 . 3.50 813 624 A 34 LYS HGx A 34 LYS HEy 1.0 . 3.50 814 625 A 34 LYS HDy A 34 LYS HEx 1.0 . 2.33 815 625 A 34 LYS HDx A 34 LYS HEx 1.0 . 2.33 816 625 A 34 LYS HEy A 34 LYS HDy 1.0 . 2.33 817 625 A 34 LYS HDx A 34 LYS HEy 1.0 . 2.33 818 626 A 40 TRP HZ2 A 34 LYS HDy 1.0 . 4.20 819 626 A 40 TRP HZ2 A 34 LYS HDx 1.0 . 4.20 820 627 A 40 TRP HD1 A 34 LYS HEx 1.0 . 5.34 821 627 A 40 TRP HD1 A 34 LYS HEy 1.0 . 5.34 822 628 A 40 TRP HE3 A 34 LYS HEx 1.0 . 5.34 823 628 A 40 TRP HE3 A 34 LYS HEy 1.0 . 5.34 824 629 A 40 TRP HZ2 A 34 LYS HEx 1.0 . 4.68 825 629 A 40 TRP HZ2 A 34 LYS HEy 1.0 . 4.68 826 630 A 40 TRP HH2 A 34 LYS HEx 1.0 . 4.24 827 630 A 40 TRP HH2 A 34 LYS HEy 1.0 . 4.24 828 631 A 37 ASP HA A 37 ASP HBy 1.0 . 2.32 829 631 A 37 ASP HA A 37 ASP HBx 1.0 . 2.32 830 632 A 39 TRP HZ3 A 52 PRO HDx 1.0 . 3.72 831 632 A 39 TRP HZ3 A 52 PRO HDy 1.0 . 3.72 832 633 A 41 ARG HA A 41 ARG HGy 1.0 . 3.05 833 633 A 41 ARG HA A 41 ARG HGx 1.0 . 3.05 834 634 A 50 TRP HZ3 A 41 ARG HBx 1.0 . 5.31 835 634 A 50 TRP HZ3 A 41 ARG HBy 1.0 . 5.31 836 635 A 50 TRP HZ2 A 41 ARG HBx 1.0 . 5.17 837 635 A 50 TRP HZ2 A 41 ARG HBy 1.0 . 5.17 838 636 A 42 GLY H A 41 ARG HGy 1.0 . 3.33 839 636 A 42 GLY H A 41 ARG HGx 1.0 . 3.33 840 637 A 43 SER H A 42 GLY HAx 1.0 . 2.78 841 637 A 43 SER H A 42 GLY HAy 1.0 . 2.78 842 638 A 51 PHE HE% A 42 GLY HAx 1.0 . 3.40 843 638 A 51 PHE HE% A 42 GLY HAy 1.0 . 3.40 844 639 A 43 SER HA A 43 SER HBy 1.0 . 2.30 845 639 A 43 SER HA A 43 SER HBx 1.0 . 2.30 846 640 A 48 VAL HA A 43 SER HBy 1.0 . 3.87 847 640 A 48 VAL HA A 43 SER HBx 1.0 . 3.87 848 641 A 45 ASN HA A 45 ASN HBy 1.0 . 2.57 849 641 A 45 ASN HA A 45 ASN HBx 1.0 . 2.57 850 642 A 47 GLN H A 47 GLN HBy 1.0 . 3.19 851 642 A 47 GLN H A 47 GLN HBx 1.0 . 3.19 852 643 A 47 GLN HA A 47 GLN HGy 1.0 . 2.62 853 643 A 47 GLN HA A 47 GLN HGx 1.0 . 2.62 854 644 A 47 GLN HBy A 47 GLN HGy 1.0 . 2.27 855 644 A 47 GLN HBx A 47 GLN HGy 1.0 . 2.27 856 644 A 47 GLN HGx A 47 GLN HBy 1.0 . 2.27 857 644 A 47 GLN HBx A 47 GLN HGx 1.0 . 2.27 858 645 A 51 PHE HA A 52 PRO HDx 1.0 . 2.32 859 645 A 51 PHE HA A 52 PRO HDy 1.0 . 2.32 860 646 A 51 PHE HBy A 52 PRO HGy 1.0 . 4.42 861 646 A 51 PHE HBy A 52 PRO HGx 1.0 . 4.42 862 647 A 51 PHE HBy A 52 PRO HDx 1.0 . 4.08 863 647 A 51 PHE HBy A 52 PRO HDy 1.0 . 4.08 864 648 A 51 PHE HBx A 52 PRO HDx 1.0 . 4.09 865 648 A 51 PHE HBx A 52 PRO HDy 1.0 . 4.09 866 649 A 51 PHE HD% A 52 PRO HDx 1.0 . 4.16 867 649 A 51 PHE HD% A 52 PRO HDy 1.0 . 4.16 868 650 A 53 SER HA A 53 SER HBy 1.0 . 2.24 869 650 A 53 SER HA A 53 SER HBx 1.0 . 2.24 870 651 A 54 ASN H A 54 ASN HBy 1.0 . 3.34 871 651 A 54 ASN H A 54 ASN HBx 1.0 . 3.34 872 652 A 54 ASN HA A 54 ASN HBy 1.0 . 2.62 873 652 A 54 ASN HA A 54 ASN HBx 1.0 . 2.62 874 653 A 55 TYR H A 55 TYR HBy 1.0 . 2.86 875 653 A 55 TYR H A 55 TYR HBx 1.0 . 2.86 876 654 A 55 TYR HA A 55 TYR HBy 1.0 . 2.64 877 654 A 55 TYR HA A 55 TYR HBx 1.0 . 2.64 878 655 A 58 GLU H A 58 GLU HBy 1.0 . 3.26 879 655 A 58 GLU H A 58 GLU HBx 1.0 . 3.26 880 656 A 58 GLU H A 58 GLU HGy 1.0 . 4.81 881 656 A 58 GLU H A 58 GLU HGx 1.0 . 4.81 882 657 A 58 GLU HA A 58 GLU HGy 1.0 . 2.37 883 657 A 58 GLU HA A 58 GLU HGx 1.0 . 2.37 884 658 A 58 GLU HBx A 58 GLU HGy 1.0 . 2.10 885 658 A 58 GLU HBy A 58 GLU HGy 1.0 . 2.10 886 658 A 58 GLU HGx A 58 GLU HBy 1.0 . 2.10 887 658 A 58 GLU HGx A 58 GLU HBx 1.0 . 2.10 888 659 A 59 GLU H A 58 GLU HBy 1.0 . 2.54 889 659 A 59 GLU H A 58 GLU HBx 1.0 . 2.54 890 660 A 59 GLU H A 59 GLU HBy 1.0 . 3.02 891 660 A 59 GLU H A 59 GLU HBx 1.0 . 3.02 892 661 A 59 GLU HBx A 59 GLU HGx 1.0 . 2.20 893 661 A 59 GLU HBy A 59 GLU HGx 1.0 . 2.20 894 661 A 59 GLU HGy A 59 GLU HBy 1.0 . 2.20 895 661 A 59 GLU HGy A 59 GLU HBx 1.0 . 2.20 896 662 A 61 ASP H A 61 ASP HBy 1.0 . 3.64 897 662 A 61 ASP H A 61 ASP HBx 1.0 . 3.64 stop_ save_