data_nef_c15339_2jrm save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 LYS middle . . 3 A 3 ARG middle . . 4 A 4 GLN middle . . 5 A 5 LYS middle . . 6 A 6 ARG middle . . 7 A 7 ASP middle . . 8 A 8 ARG middle . . 9 A 9 LEU middle . . 10 A 10 GLU middle . . 11 A 11 ARG middle . . 12 A 12 ALA middle . . 13 A 13 GLN middle . . 14 A 14 SER middle . . 15 A 15 GLN middle . . 16 A 16 GLY middle . false 17 A 17 TYR middle . . 18 A 18 LYS middle . . 19 A 19 ALA middle . . 20 A 20 GLY middle . false 21 A 21 LEU middle . . 22 A 22 ASN middle . . 23 A 23 GLY middle . false 24 A 24 ARG middle . . 25 A 25 SER middle . . 26 A 26 GLN middle . . 27 A 27 GLU middle . . 28 A 28 ALA middle . . 29 A 29 CYS middle . . 30 A 30 PRO middle . false 31 A 31 TYR middle . . 32 A 32 GLN middle . . 33 A 33 GLN middle . . 34 A 34 VAL middle . . 35 A 35 ASP middle . . 36 A 36 ALA middle . . 37 A 37 ARG middle . . 38 A 38 SER middle . . 39 A 39 TYR middle . . 40 A 40 TRP middle . . 41 A 41 LEU middle . . 42 A 42 GLY middle . false 43 A 43 GLY middle . false 44 A 44 TRP middle . . 45 A 45 ARG middle . . 46 A 46 ASP middle . . 47 A 47 ALA middle . . 48 A 48 ARG middle . . 49 A 49 ASP middle . . 50 A 50 GLU middle . . 51 A 51 LYS middle . . 52 A 52 GLN middle . . 53 A 53 SER middle . . 54 A 54 GLY middle . false 55 A 55 LEU middle . . 56 A 56 TYR middle . . 57 A 57 LYS middle . . 58 A 58 LEU middle . . 59 A 59 GLU middle . . 60 A 60 HIS middle . . 61 A 61 HIS middle . . 62 A 62 HIS middle . . 63 A 63 HIS middle . . 64 A 64 HIS middle . . 65 A 65 HIS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET HA H 1 4.544 . A 1 MET HBx H 1 3.049 . A 1 MET HBy H 1 3.049 . A 1 MET C C 13 173.875 . A 1 MET CA C 13 55.811 . A 1 MET CB C 13 29.946 . A 2 LYS H H 1 8.138 . A 2 LYS HA H 1 4.325 . A 2 LYS HBx H 1 1.746 . A 2 LYS HBy H 1 1.824 . A 2 LYS HDx H 1 1.664 . A 2 LYS HDy H 1 1.664 . A 2 LYS HEx H 1 2.961 . A 2 LYS HEy H 1 2.961 . A 2 LYS HGx H 1 1.342 . A 2 LYS HGy H 1 1.406 . A 2 LYS C C 13 176.460 . A 2 LYS CA C 13 56.632 . A 2 LYS CB C 13 33.087 . A 2 LYS CD C 13 29.161 . A 2 LYS CE C 13 42.117 . A 2 LYS CG C 13 24.908 . A 2 LYS N N 15 125.275 . A 3 ARG H H 1 8.624 . A 3 ARG HA H 1 4.220 . A 3 ARG HBx H 1 1.784 . A 3 ARG HBy H 1 1.784 . A 3 ARG HDx H 1 3.151 . A 3 ARG HDy H 1 3.151 . A 3 ARG HGx H 1 1.608 . A 3 ARG HGy H 1 1.608 . A 3 ARG C C 13 176.426 . A 3 ARG CA C 13 56.705 . A 3 ARG CB C 13 30.577 . A 3 ARG CD C 13 43.285 . A 3 ARG CG C 13 27.075 . A 3 ARG N N 15 123.963 . A 4 GLN H H 1 8.613 . A 4 GLN HA H 1 4.221 . A 4 GLN HBx H 1 1.956 . A 4 GLN HBy H 1 2.049 . A 4 GLN HE2y H 1 7.596 . A 4 GLN HE2x H 1 6.904 . A 4 GLN HGx H 1 2.367 . A 4 GLN HGy H 1 2.367 . A 4 GLN C C 13 176.604 . A 4 GLN CA C 13 56.626 . A 4 GLN CB C 13 29.536 . A 4 GLN CG C 13 33.891 . A 4 GLN N N 15 121.223 . A 4 GLN NE2 N 15 112.823 . A 5 LYS H H 1 8.180 . A 5 LYS HA H 1 4.161 . A 5 LYS HBx H 1 1.763 . A 5 LYS HBy H 1 1.763 . A 5 LYS HDx H 1 1.603 . A 5 LYS HDy H 1 1.603 . A 5 LYS HEx H 1 2.933 . A 5 LYS HEy H 1 2.933 . A 5 LYS HGx H 1 1.335 . A 5 LYS HGy H 1 1.335 . A 5 LYS C C 13 176.971 . A 5 LYS CA C 13 57.367 . A 5 LYS CB C 13 32.873 . A 5 LYS CD C 13 29.150 . A 5 LYS CE C 13 42.128 . A 5 LYS CG C 13 24.872 . A 5 LYS N N 15 122.464 . A 6 ARG H H 1 8.345 . A 6 ARG HA H 1 4.119 . A 6 ARG HBx H 1 1.768 . A 6 ARG HBy H 1 1.768 . A 6 ARG HDy H 1 3.134 . A 6 ARG HDx H 1 3.129 . A 6 ARG HGx H 1 1.561 . A 6 ARG HGy H 1 1.561 . A 6 ARG C C 13 176.908 . A 6 ARG CA C 13 57.246 . A 6 ARG CB C 13 30.166 . A 6 ARG CD C 13 43.334 . A 6 ARG CG C 13 27.008 . A 6 ARG N N 15 121.458 . A 7 ASP H H 1 8.422 . A 7 ASP HA H 1 4.414 . A 7 ASP HBx H 1 2.629 . A 7 ASP HBy H 1 2.736 . A 7 ASP C C 13 177.562 . A 7 ASP CA C 13 55.809 . A 7 ASP CB C 13 41.064 . A 7 ASP N N 15 120.954 . A 8 ARG H H 1 8.061 . A 8 ARG HA H 1 3.971 . A 8 ARG HBx H 1 1.830 . A 8 ARG HBy H 1 1.830 . A 8 ARG HDx H 1 3.171 . A 8 ARG HDy H 1 3.221 . A 8 ARG HGx H 1 1.412 . A 8 ARG HGy H 1 1.527 . A 8 ARG C C 13 178.412 . A 8 ARG CA C 13 59.160 . A 8 ARG CB C 13 30.192 . A 8 ARG CD C 13 43.129 . A 8 ARG CG C 13 27.399 . A 8 ARG N N 15 119.853 . A 9 LEU H H 1 7.801 . A 9 LEU HA H 1 3.727 . A 9 LEU HBx H 1 -0.085 . A 9 LEU HBy H 1 1.261 . A 9 LEU HD1% H 1 0.516 . A 9 LEU HD2% H 1 0.263 . A 9 LEU HG H 1 1.361 . A 9 LEU C C 13 178.182 . A 9 LEU CA C 13 57.192 . A 9 LEU CB C 13 38.370 . A 9 LEU CD1 C 13 24.599 . A 9 LEU CD2 C 13 20.376 . A 9 LEU CG C 13 25.960 . A 9 LEU N N 15 121.052 . A 10 GLU H H 1 8.172 . A 10 GLU HA H 1 4.014 . A 10 GLU HBx H 1 2.022 . A 10 GLU HBy H 1 2.022 . A 10 GLU HGy H 1 2.378 . A 10 GLU HGx H 1 2.230 . A 10 GLU C C 13 180.022 . A 10 GLU CA C 13 59.504 . A 10 GLU CB C 13 29.451 . A 10 GLU CG C 13 36.677 . A 10 GLU N N 15 120.463 . A 11 ARG H H 1 8.202 . A 11 ARG HA H 1 4.117 . A 11 ARG HBx H 1 1.881 . A 11 ARG HBy H 1 1.881 . A 11 ARG HDx H 1 3.203 . A 11 ARG HDy H 1 3.243 . A 11 ARG HGx H 1 1.568 . A 11 ARG HGy H 1 1.754 . A 11 ARG C C 13 178.321 . A 11 ARG CA C 13 59.328 . A 11 ARG CB C 13 29.798 . A 11 ARG CD C 13 43.509 . A 11 ARG CG C 13 27.678 . A 11 ARG N N 15 119.987 . A 12 ALA H H 1 7.661 . A 12 ALA HA H 1 4.603 . A 12 ALA HB% H 1 1.453 . A 12 ALA C C 13 179.757 . A 12 ALA CA C 13 55.536 . A 12 ALA CB C 13 18.423 . A 12 ALA N N 15 122.208 . A 13 GLN H H 1 8.205 . A 13 GLN HA H 1 4.332 . A 13 GLN HBx H 1 2.329 . A 13 GLN HBy H 1 2.414 . A 13 GLN HE2y H 1 7.739 . A 13 GLN HE2x H 1 6.707 . A 13 GLN HGx H 1 2.340 . A 13 GLN HGy H 1 2.406 . A 13 GLN C C 13 178.128 . A 13 GLN CA C 13 59.565 . A 13 GLN CB C 13 29.572 . A 13 GLN CG C 13 33.403 . A 13 GLN N N 15 118.449 . A 13 GLN NE2 N 15 110.948 . A 14 SER H H 1 8.245 . A 14 SER HA H 1 4.281 . A 14 SER HBx H 1 4.083 . A 14 SER HBy H 1 4.083 . A 14 SER C C 13 177.751 . A 14 SER CA C 13 61.583 . A 14 SER CB C 13 62.897 . A 14 SER N N 15 115.275 . A 15 GLN H H 1 8.686 . A 15 GLN HA H 1 4.124 . A 15 GLN HBx H 1 2.428 . A 15 GLN HBy H 1 2.883 . A 15 GLN HE2y H 1 7.749 . A 15 GLN HE2x H 1 7.073 . A 15 GLN HGx H 1 2.662 . A 15 GLN HGy H 1 2.846 . A 15 GLN C C 13 179.621 . A 15 GLN CA C 13 58.803 . A 15 GLN CB C 13 28.201 . A 15 GLN CG C 13 34.108 . A 15 GLN N N 15 121.722 . A 15 GLN NE2 N 15 111.644 . A 16 GLY H H 1 8.439 . A 16 GLY HAx H 1 1.849 . A 16 GLY HAy H 1 3.742 . A 16 GLY C C 13 175.080 . A 16 GLY CA C 13 45.784 . A 16 GLY N N 15 113.363 . A 17 TYR H H 1 8.167 . A 17 TYR HA H 1 4.014 . A 17 TYR HBx H 1 2.873 . A 17 TYR HBy H 1 3.031 . A 17 TYR HD1 H 1 7.056 . A 17 TYR HD2 H 1 7.056 . A 17 TYR HE1 H 1 6.573 . A 17 TYR HE2 H 1 6.573 . A 17 TYR C C 13 177.200 . A 17 TYR CA C 13 60.567 . A 17 TYR CB C 13 38.755 . A 17 TYR CD1 C 13 133.363 . A 17 TYR CD2 C 13 133.363 . A 17 TYR CE1 C 13 117.788 . A 17 TYR CE2 C 13 117.788 . A 17 TYR N N 15 123.123 . A 18 LYS H H 1 8.003 . A 18 LYS HA H 1 3.681 . A 18 LYS HBx H 1 1.855 . A 18 LYS HBy H 1 1.906 . A 18 LYS HDx H 1 1.707 . A 18 LYS HDy H 1 1.707 . A 18 LYS HEx H 1 2.994 . A 18 LYS HEy H 1 2.994 . A 18 LYS HGx H 1 1.466 . A 18 LYS HGy H 1 1.614 . A 18 LYS C C 13 178.838 . A 18 LYS CA C 13 59.677 . A 18 LYS CB C 13 32.393 . A 18 LYS CD C 13 29.409 . A 18 LYS CE C 13 42.149 . A 18 LYS CG C 13 25.416 . A 18 LYS N N 15 117.920 . A 19 ALA H H 1 8.067 . A 19 ALA HA H 1 4.194 . A 19 ALA HB% H 1 1.612 . A 19 ALA C C 13 180.263 . A 19 ALA CA C 13 55.349 . A 19 ALA CB C 13 19.039 . A 19 ALA N N 15 120.778 . A 20 GLY H H 1 8.527 . A 20 GLY HAx H 1 3.101 . A 20 GLY HAy H 1 3.303 . A 20 GLY C C 13 177.818 . A 20 GLY CA C 13 47.102 . A 20 GLY N N 15 107.003 . A 21 LEU H H 1 8.310 . A 21 LEU HA H 1 3.696 . A 21 LEU HBx H 1 1.300 . A 21 LEU HBy H 1 1.554 . A 21 LEU HD1% H 1 0.620 . A 21 LEU HD2% H 1 0.577 . A 21 LEU HG H 1 1.221 . A 21 LEU C C 13 178.603 . A 21 LEU CA C 13 57.417 . A 21 LEU CB C 13 41.798 . A 21 LEU CD1 C 13 25.379 . A 21 LEU CD2 C 13 22.745 . A 21 LEU CG C 13 25.781 . A 21 LEU N N 15 124.762 . A 22 ASN H H 1 7.628 . A 22 ASN HA H 1 4.701 . A 22 ASN HBx H 1 2.788 . A 22 ASN HBy H 1 2.976 . A 22 ASN HD2y H 1 7.572 . A 22 ASN HD2x H 1 7.014 . A 22 ASN C C 13 175.456 . A 22 ASN CA C 13 53.292 . A 22 ASN CB C 13 39.188 . A 22 ASN N N 15 114.867 . A 22 ASN ND2 N 15 112.816 . A 23 GLY H H 1 7.586 . A 23 GLY HAx H 1 3.810 . A 23 GLY HAy H 1 4.102 . A 23 GLY C C 13 175.226 . A 23 GLY CA C 13 46.302 . A 23 GLY N N 15 106.650 . A 24 ARG H H 1 8.156 . A 24 ARG HA H 1 4.508 . A 24 ARG HBx H 1 1.810 . A 24 ARG HBy H 1 2.093 . A 24 ARG HDx H 1 3.276 . A 24 ARG HDy H 1 3.276 . A 24 ARG HGx H 1 1.801 . A 24 ARG HGy H 1 1.920 . A 24 ARG C C 13 177.405 . A 24 ARG CA C 13 55.103 . A 24 ARG CB C 13 30.537 . A 24 ARG CD C 13 42.737 . A 24 ARG CG C 13 27.117 . A 24 ARG N N 15 118.161 . A 25 SER H H 1 9.015 . A 25 SER HA H 1 4.804 . A 25 SER HBx H 1 4.010 . A 25 SER HBy H 1 4.305 . A 25 SER C C 13 175.005 . A 25 SER CA C 13 57.752 . A 25 SER CB C 13 64.687 . A 25 SER N N 15 119.720 . A 26 GLN H H 1 8.662 . A 26 GLN HA H 1 3.162 . A 26 GLN HBx H 1 0.962 . A 26 GLN HBy H 1 1.354 . A 26 GLN HE2y H 1 6.867 . A 26 GLN HE2x H 1 6.818 . A 26 GLN HGx H 1 1.229 . A 26 GLN HGy H 1 1.337 . A 26 GLN C C 13 177.736 . A 26 GLN CA C 13 58.643 . A 26 GLN CB C 13 27.352 . A 26 GLN CG C 13 33.415 . A 26 GLN N N 15 120.247 . A 26 GLN NE2 N 15 112.091 . A 27 GLU H H 1 8.244 . A 27 GLU HA H 1 3.886 . A 27 GLU HBx H 1 1.794 . A 27 GLU HBy H 1 1.976 . A 27 GLU HGy H 1 2.218 . A 27 GLU HGx H 1 2.169 . A 27 GLU C C 13 176.177 . A 27 GLU CA C 13 57.807 . A 27 GLU CB C 13 28.583 . A 27 GLU CG C 13 36.628 . A 27 GLU N N 15 117.869 . A 28 ALA H H 1 7.451 . A 28 ALA HA H 1 4.070 . A 28 ALA HB% H 1 1.546 . A 28 ALA C C 13 176.063 . A 28 ALA CA C 13 51.945 . A 28 ALA CB C 13 18.113 . A 28 ALA N N 15 120.356 . A 29 CYS H H 1 6.591 . A 29 CYS HA H 1 1.828 . A 29 CYS HBy H 1 2.250 . A 29 CYS HBx H 1 1.943 . A 29 CYS CA C 13 56.231 . A 29 CYS CB C 13 27.778 . A 29 CYS N N 15 121.588 . A 30 PRO HA H 1 4.323 . A 30 PRO HBx H 1 1.555 . A 30 PRO HBy H 1 1.722 . A 30 PRO HDx H 1 2.123 . A 30 PRO HDy H 1 3.269 . A 30 PRO HGx H 1 0.637 . A 30 PRO HGy H 1 1.688 . A 30 PRO C C 13 175.515 . A 30 PRO CA C 13 63.382 . A 30 PRO CB C 13 31.551 . A 30 PRO CD C 13 50.316 . A 30 PRO CG C 13 25.208 . A 31 TYR H H 1 6.804 . A 31 TYR HA H 1 4.582 . A 31 TYR HBx H 1 2.100 . A 31 TYR HBy H 1 3.099 . A 31 TYR HD1 H 1 6.962 . A 31 TYR HD2 H 1 6.962 . A 31 TYR HE1 H 1 7.002 . A 31 TYR HE2 H 1 7.002 . A 31 TYR C C 13 174.785 . A 31 TYR CA C 13 58.348 . A 31 TYR CB C 13 41.030 . A 31 TYR CD1 C 13 132.844 . A 31 TYR CD2 C 13 132.844 . A 31 TYR CE1 C 13 118.714 . A 31 TYR CE2 C 13 118.714 . A 31 TYR N N 15 118.903 . A 32 GLN H H 1 8.763 . A 32 GLN HA H 1 4.344 . A 32 GLN HBx H 1 1.898 . A 32 GLN HBy H 1 2.133 . A 32 GLN HE2y H 1 7.424 . A 32 GLN HE2x H 1 6.726 . A 32 GLN HGx H 1 2.309 . A 32 GLN HGy H 1 2.309 . A 32 GLN C C 13 176.528 . A 32 GLN CA C 13 55.996 . A 32 GLN CB C 13 30.182 . A 32 GLN CG C 13 33.828 . A 32 GLN N N 15 120.327 . A 32 GLN NE2 N 15 112.951 . A 33 GLN H H 1 8.230 . A 33 GLN HA H 1 4.262 . A 33 GLN HBx H 1 2.047 . A 33 GLN HBy H 1 2.245 . A 33 GLN HE2y H 1 7.780 . A 33 GLN HE2x H 1 7.123 . A 33 GLN HGx H 1 2.607 . A 33 GLN HGy H 1 2.607 . A 33 GLN C C 13 177.216 . A 33 GLN CA C 13 56.931 . A 33 GLN CB C 13 28.699 . A 33 GLN CG C 13 34.266 . A 33 GLN N N 15 121.712 . A 33 GLN NE2 N 15 113.606 . A 34 VAL H H 1 8.484 . A 34 VAL HA H 1 3.551 . A 34 VAL HB H 1 2.091 . A 34 VAL HG1% H 1 0.979 . A 34 VAL HG2% H 1 1.043 . A 34 VAL C C 13 177.685 . A 34 VAL CA C 13 66.570 . A 34 VAL CB C 13 31.946 . A 34 VAL CG1 C 13 20.742 . A 34 VAL CG2 C 13 21.379 . A 34 VAL N N 15 122.145 . A 35 ASP H H 1 8.324 . A 35 ASP HA H 1 4.434 . A 35 ASP HBx H 1 2.703 . A 35 ASP HBy H 1 2.836 . A 35 ASP C C 13 177.892 . A 35 ASP CA C 13 56.826 . A 35 ASP CB C 13 38.807 . A 35 ASP N N 15 120.937 . A 36 ALA H H 1 8.431 . A 36 ALA HA H 1 3.598 . A 36 ALA HB% H 1 0.696 . A 36 ALA C C 13 178.949 . A 36 ALA CA C 13 55.327 . A 36 ALA CB C 13 17.371 . A 36 ALA N N 15 126.210 . A 37 ARG H H 1 8.458 . A 37 ARG HA H 1 3.857 . A 37 ARG HBx H 1 1.633 . A 37 ARG HBy H 1 1.799 . A 37 ARG HDx H 1 2.953 . A 37 ARG HDy H 1 3.106 . A 37 ARG HE H 1 7.276 . A 37 ARG HGx H 1 1.473 . A 37 ARG HGy H 1 1.743 . A 37 ARG C C 13 177.746 . A 37 ARG CA C 13 60.636 . A 37 ARG CB C 13 29.931 . A 37 ARG CD C 13 43.387 . A 37 ARG CG C 13 28.346 . A 37 ARG N N 15 116.717 . A 37 ARG NE N 15 83.844 . A 38 SER H H 1 8.173 . A 38 SER HA H 1 4.130 . A 38 SER C C 13 178.293 . A 38 SER CA C 13 62.627 . A 38 SER N N 15 114.110 . A 39 TYR H H 1 8.343 . A 39 TYR HA H 1 4.213 . A 39 TYR HBx H 1 2.944 . A 39 TYR HBy H 1 3.031 . A 39 TYR HD1 H 1 7.326 . A 39 TYR HD2 H 1 7.326 . A 39 TYR HE1 H 1 6.767 . A 39 TYR HE2 H 1 6.767 . A 39 TYR C C 13 178.701 . A 39 TYR CA C 13 62.466 . A 39 TYR CB C 13 38.687 . A 39 TYR CD1 C 13 133.216 . A 39 TYR CD2 C 13 133.216 . A 39 TYR CE1 C 13 118.412 . A 39 TYR CE2 C 13 118.412 . A 39 TYR N N 15 123.318 . A 40 TRP H H 1 8.818 . A 40 TRP HA H 1 4.586 . A 40 TRP HBx H 1 3.364 . A 40 TRP HBy H 1 3.777 . A 40 TRP HD1 H 1 7.653 . A 40 TRP HE1 H 1 10.958 . A 40 TRP HE3 H 1 7.343 . A 40 TRP HH2 H 1 6.963 . A 40 TRP HZ2 H 1 7.171 . A 40 TRP HZ3 H 1 6.569 . A 40 TRP C C 13 179.359 . A 40 TRP CA C 13 61.953 . A 40 TRP CB C 13 31.349 . A 40 TRP CD1 C 13 128.757 . A 40 TRP CE3 C 13 121.109 . A 40 TRP CH2 C 13 124.802 . A 40 TRP CZ2 C 13 114.322 . A 40 TRP CZ3 C 13 122.875 . A 40 TRP N N 15 123.286 . A 40 TRP NE1 N 15 130.950 . A 41 LEU H H 1 9.368 . A 41 LEU HA H 1 4.405 . A 41 LEU HBx H 1 1.639 . A 41 LEU HBy H 1 2.113 . A 41 LEU HD1% H 1 0.929 . A 41 LEU HD2% H 1 0.980 . A 41 LEU HG H 1 2.177 . A 41 LEU C C 13 179.498 . A 41 LEU CA C 13 58.206 . A 41 LEU CB C 13 41.754 . A 41 LEU CD1 C 13 25.809 . A 41 LEU CD2 C 13 23.315 . A 41 LEU CG C 13 27.678 . A 41 LEU N N 15 119.265 . A 42 GLY H H 1 8.283 . A 42 GLY HAx H 1 3.857 . A 42 GLY HAy H 1 3.929 . A 42 GLY C C 13 176.508 . A 42 GLY CA C 13 47.412 . A 42 GLY N N 15 108.413 . A 43 GLY H H 1 8.181 . A 43 GLY HAx H 1 4.124 . A 43 GLY HAy H 1 4.258 . A 43 GLY C C 13 174.891 . A 43 GLY CA C 13 47.341 . A 43 GLY N N 15 109.904 . A 44 TRP H H 1 8.460 . A 44 TRP HA H 1 3.578 . A 44 TRP HBx H 1 2.200 . A 44 TRP HBy H 1 3.393 . A 44 TRP HD1 H 1 6.383 . A 44 TRP HE1 H 1 10.152 . A 44 TRP HE3 H 1 7.436 . A 44 TRP HH2 H 1 7.213 . A 44 TRP HZ2 H 1 7.547 . A 44 TRP HZ3 H 1 7.034 . A 44 TRP C C 13 178.547 . A 44 TRP CA C 13 62.646 . A 44 TRP CB C 13 29.467 . A 44 TRP CD1 C 13 126.147 . A 44 TRP CE3 C 13 120.891 . A 44 TRP CH2 C 13 124.522 . A 44 TRP CZ2 C 13 114.623 . A 44 TRP CZ3 C 13 121.988 . A 44 TRP N N 15 124.152 . A 44 TRP NE1 N 15 128.122 . A 45 ARG H H 1 8.759 . A 45 ARG HA H 1 3.669 . A 45 ARG HBx H 1 2.017 . A 45 ARG HBy H 1 2.142 . A 45 ARG HDx H 1 3.241 . A 45 ARG HDy H 1 3.354 . A 45 ARG HE H 1 7.454 . A 45 ARG HGy H 1 2.205 . A 45 ARG HGx H 1 1.742 . A 45 ARG C C 13 178.784 . A 45 ARG CA C 13 59.785 . A 45 ARG CB C 13 30.295 . A 45 ARG CD C 13 43.592 . A 45 ARG CG C 13 28.252 . A 45 ARG N N 15 118.655 . A 45 ARG NE N 15 84.817 . A 46 ASP H H 1 8.084 . A 46 ASP HA H 1 4.362 . A 46 ASP HBx H 1 2.756 . A 46 ASP HBy H 1 3.138 . A 46 ASP C C 13 178.818 . A 46 ASP CA C 13 57.518 . A 46 ASP CB C 13 39.752 . A 46 ASP N N 15 120.646 . A 47 ALA H H 1 7.873 . A 47 ALA HA H 1 3.627 . A 47 ALA HB% H 1 0.818 . A 47 ALA C C 13 179.397 . A 47 ALA CA C 13 54.962 . A 47 ALA CB C 13 18.940 . A 47 ALA N N 15 122.126 . A 48 ARG H H 1 7.587 . A 48 ARG HA H 1 3.538 . A 48 ARG HBx H 1 1.135 . A 48 ARG HBy H 1 1.135 . A 48 ARG HDx H 1 2.401 . A 48 ARG HDy H 1 2.603 . A 48 ARG HE H 1 7.000 . A 48 ARG HGx H 1 0.921 . A 48 ARG HGy H 1 1.614 . A 48 ARG C C 13 178.647 . A 48 ARG CA C 13 57.880 . A 48 ARG CB C 13 28.753 . A 48 ARG CD C 13 42.205 . A 48 ARG CG C 13 25.305 . A 48 ARG N N 15 117.721 . A 48 ARG NE N 15 84.221 . A 49 ASP H H 1 8.249 . A 49 ASP HA H 1 4.383 . A 49 ASP HBx H 1 2.728 . A 49 ASP HBy H 1 2.728 . A 49 ASP C C 13 178.360 . A 49 ASP CA C 13 56.330 . A 49 ASP CB C 13 40.401 . A 49 ASP N N 15 119.997 . A 50 GLU H H 1 8.060 . A 50 GLU HA H 1 4.007 . A 50 GLU HBx H 1 2.054 . A 50 GLU HBy H 1 2.054 . A 50 GLU HGy H 1 2.418 . A 50 GLU HGx H 1 2.191 . A 50 GLU C C 13 178.675 . A 50 GLU CA C 13 58.740 . A 50 GLU CB C 13 29.585 . A 50 GLU CG C 13 36.270 . A 50 GLU N N 15 121.823 . A 51 LYS H H 1 8.089 . A 51 LYS HA H 1 4.057 . A 51 LYS HBx H 1 1.766 . A 51 LYS HBy H 1 1.766 . A 51 LYS HDx H 1 1.573 . A 51 LYS HDy H 1 1.573 . A 51 LYS HEx H 1 2.859 . A 51 LYS HEy H 1 2.897 . A 51 LYS HGx H 1 1.341 . A 51 LYS HGy H 1 1.408 . A 51 LYS C C 13 178.241 . A 51 LYS CA C 13 57.727 . A 51 LYS CB C 13 32.090 . A 51 LYS CD C 13 28.920 . A 51 LYS CE C 13 41.985 . A 51 LYS CG C 13 24.798 . A 51 LYS N N 15 119.415 . A 52 GLN H H 1 8.043 . A 52 GLN HA H 1 4.189 . A 52 GLN HBy H 1 2.120 . A 52 GLN HBx H 1 2.091 . A 52 GLN HE2y H 1 7.472 . A 52 GLN HE2x H 1 6.818 . A 52 GLN HGx H 1 2.330 . A 52 GLN HGy H 1 2.330 . A 52 GLN C C 13 176.965 . A 52 GLN CA C 13 56.977 . A 52 GLN CB C 13 28.858 . A 52 GLN CG C 13 33.839 . A 52 GLN N N 15 118.262 . A 52 GLN NE2 N 15 112.140 . A 53 SER H H 1 8.088 . A 53 SER HA H 1 4.339 . A 53 SER HBx H 1 3.917 . A 53 SER HBy H 1 3.917 . A 53 SER C C 13 175.679 . A 53 SER CA C 13 59.492 . A 53 SER CB C 13 63.849 . A 53 SER N N 15 114.966 . A 54 GLY H H 1 8.228 . A 54 GLY HAy H 1 3.939 . A 54 GLY HAx H 1 3.867 . A 54 GLY C C 13 174.591 . A 54 GLY CA C 13 45.776 . A 54 GLY N N 15 110.315 . A 55 LEU H H 1 7.846 . A 55 LEU HA H 1 4.174 . A 55 LEU HBx H 1 1.333 . A 55 LEU HBy H 1 1.477 . A 55 LEU HD1% H 1 0.815 . A 55 LEU HD2% H 1 0.748 . A 55 LEU HG H 1 1.434 . A 55 LEU C C 13 177.315 . A 55 LEU CA C 13 55.716 . A 55 LEU CB C 13 42.103 . A 55 LEU CD1 C 13 24.781 . A 55 LEU CD2 C 13 23.405 . A 55 LEU CG C 13 26.770 . A 55 LEU N N 15 121.456 . A 56 TYR H H 1 7.960 . A 56 TYR HA H 1 4.450 . A 56 TYR HBx H 1 2.856 . A 56 TYR HBy H 1 2.984 . A 56 TYR HD1 H 1 7.010 . A 56 TYR HD2 H 1 7.009 . A 56 TYR HE1 H 1 6.692 . A 56 TYR HE2 H 1 6.689 . A 56 TYR C C 13 176.206 . A 56 TYR CA C 13 58.242 . A 56 TYR CB C 13 38.478 . A 56 TYR CD1 C 13 133.235 . A 56 TYR CD2 C 13 133.237 . A 56 TYR CE1 C 13 118.115 . A 56 TYR CE2 C 13 118.116 . A 56 TYR N N 15 119.665 . A 57 LYS H H 1 8.015 . A 57 LYS HA H 1 4.154 . A 57 LYS HBx H 1 1.649 . A 57 LYS HBy H 1 1.747 . A 57 LYS HDx H 1 1.588 . A 57 LYS HDy H 1 1.588 . A 57 LYS HEx H 1 2.916 . A 57 LYS HEy H 1 2.916 . A 57 LYS HGy H 1 1.278 . A 57 LYS HGx H 1 1.276 . A 57 LYS C C 13 176.553 . A 57 LYS CA C 13 56.656 . A 57 LYS CB C 13 32.870 . A 57 LYS CD C 13 29.095 . A 57 LYS CE C 13 42.057 . A 57 LYS CG C 13 24.799 . A 57 LYS N N 15 122.012 . A 58 LEU H H 1 8.035 . A 58 LEU HA H 1 4.185 . A 58 LEU HBx H 1 1.485 . A 58 LEU HBy H 1 1.568 . A 58 LEU HD1% H 1 0.856 . A 58 LEU HD2% H 1 0.798 . A 58 LEU HG H 1 1.545 . A 58 LEU C C 13 177.527 . A 58 LEU CA C 13 55.574 . A 58 LEU CB C 13 42.175 . A 58 LEU CD1 C 13 24.894 . A 58 LEU CD2 C 13 23.551 . A 58 LEU CG C 13 26.954 . A 58 LEU N N 15 122.265 . A 59 GLU H H 1 8.253 . A 59 GLU HA H 1 4.123 . A 59 GLU HBx H 1 1.808 . A 59 GLU HBy H 1 1.808 . A 59 GLU HGx H 1 2.060 . A 59 GLU HGy H 1 2.154 . A 59 GLU C C 13 176.231 . A 59 GLU CA C 13 56.658 . A 59 GLU CB C 13 30.246 . A 59 GLU CG C 13 36.089 . A 59 GLU N N 15 120.313 . A 60 HIS H H 1 8.188 . A 60 HIS CA C 13 56.187 . A 60 HIS CB C 13 29.810 . A 60 HIS N N 15 119.081 . stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 1 MET HA A 2 LYS H 1.0 1.8 5.0 2 2 A 2 LYS H A 1 MET HBx 1.0 1.8 5.0 3 2 A 2 LYS H A 1 MET HBy 1.0 1.8 5.0 4 3 A 2 LYS H A 2 LYS HGy 1.0 1.8 5.0 5 3 A 2 LYS H A 2 LYS HGx 1.0 1.8 5.0 6 4 A 2 LYS HA A 2 LYS HDx 1.0 1.8 5.0 7 4 A 2 LYS HA A 2 LYS HDy 1.0 1.8 5.0 8 5 A 2 LYS HA A 3 ARG H 1.0 1.8 5.0 9 6 A 2 LYS HBx A 2 LYS HEx 1.0 1.8 5.0 10 6 A 2 LYS HEy A 2 LYS HBx 1.0 1.8 5.0 11 6 A 2 LYS HBy A 2 LYS HEy 1.0 1.8 5.0 12 6 A 2 LYS HBy A 2 LYS HEx 1.0 1.8 5.0 13 7 A 3 ARG H A 2 LYS HBx 1.0 1.8 5.0 14 8 A 3 ARG H A 2 LYS HBy 1.0 1.8 5.0 15 9 A 2 LYS HGx A 2 LYS HEx 1.0 1.8 5.0 16 9 A 2 LYS HGx A 2 LYS HEy 1.0 1.8 5.0 17 10 A 2 LYS HEx A 2 LYS HGy 1.0 1.8 5.0 18 10 A 2 LYS HEy A 2 LYS HGy 1.0 1.8 5.0 19 11 A 3 ARG H A 3 ARG HA 1.0 1.8 5.0 20 12 A 3 ARG H A 3 ARG HBx 1.0 1.8 5.0 21 12 A 3 ARG H A 3 ARG HBy 1.0 1.8 5.0 22 13 A 3 ARG H A 3 ARG HGx 1.0 1.8 5.0 23 13 A 3 ARG H A 3 ARG HGy 1.0 1.8 5.0 24 14 A 3 ARG H A 4 GLN H 1.0 1.8 3.5 25 15 A 3 ARG HA A 3 ARG HDx 1.0 1.8 5.0 26 15 A 3 ARG HA A 3 ARG HDy 1.0 1.8 5.0 27 16 A 3 ARG HA A 4 GLN H 1.0 1.8 5.0 28 17 A 4 GLN H A 3 ARG HBx 1.0 1.8 5.0 29 17 A 3 ARG HBy A 4 GLN H 1.0 1.8 5.0 30 18 A 4 GLN H A 3 ARG HGx 1.0 1.8 5.0 31 18 A 3 ARG HGy A 4 GLN H 1.0 1.8 5.0 32 19 A 4 GLN H A 4 GLN HA 1.0 1.8 5.0 33 20 A 4 GLN H A 4 GLN HBx 1.0 1.8 5.0 34 21 A 4 GLN H A 4 GLN HBy 1.0 1.8 5.0 35 22 A 4 GLN H A 4 GLN HGx 1.0 1.8 5.0 36 22 A 4 GLN H A 4 GLN HGy 1.0 1.8 5.0 37 23 A 4 GLN H A 5 LYS H 1.0 1.8 5.0 38 24 A 4 GLN HA A 5 LYS H 1.0 1.8 3.5 39 25 A 4 GLN HA A 7 ASP HBx 1.0 1.8 5.0 40 26 A 4 GLN HA A 7 ASP HBy 1.0 1.8 5.0 41 27 A 5 LYS H A 4 GLN HBx 1.0 1.8 5.0 42 27 A 5 LYS H A 4 GLN HBy 1.0 1.8 5.0 43 28 A 4 GLN HBy A 5 LYS HGx 1.0 1.8 5.0 44 28 A 4 GLN HBx A 5 LYS HGx 1.0 1.8 5.0 45 28 A 5 LYS HGy A 4 GLN HBx 1.0 1.8 5.0 46 28 A 4 GLN HBy A 5 LYS HGy 1.0 1.8 5.0 47 29 A 7 ASP H A 4 GLN HBx 1.0 1.8 5.0 48 29 A 4 GLN HBy A 7 ASP H 1.0 1.8 5.0 49 30 A 4 GLN HBy A 7 ASP HBx 1.0 1.8 5.0 50 30 A 7 ASP HBx A 4 GLN HBx 1.0 1.8 5.0 51 31 A 4 GLN HBx A 7 ASP HBy 1.0 1.8 5.0 52 31 A 4 GLN HBy A 7 ASP HBy 1.0 1.8 5.0 53 32 A 5 LYS H A 5 LYS HA 1.0 1.8 5.0 54 33 A 5 LYS H A 5 LYS HBx 1.0 1.8 3.5 55 33 A 5 LYS H A 5 LYS HBy 1.0 1.8 3.5 56 34 A 5 LYS H A 6 ARG H 1.0 1.8 5.0 57 35 A 5 LYS H A 7 ASP HBy 1.0 1.8 5.0 58 35 A 5 LYS H A 7 ASP HBx 1.0 1.8 5.0 59 36 A 5 LYS HA A 5 LYS HDx 1.0 1.8 5.0 60 36 A 5 LYS HA A 5 LYS HDy 1.0 1.8 5.0 61 37 A 5 LYS HA A 6 ARG H 1.0 1.8 3.5 62 38 A 5 LYS HA A 8 ARG HGy 1.0 1.8 5.0 63 38 A 5 LYS HA A 8 ARG HGx 1.0 1.8 5.0 64 39 A 5 LYS HBx A 5 LYS HEx 1.0 1.8 5.0 65 39 A 5 LYS HEy A 5 LYS HBx 1.0 1.8 5.0 66 39 A 5 LYS HBy A 5 LYS HEy 1.0 1.8 5.0 67 39 A 5 LYS HBy A 5 LYS HEx 1.0 1.8 5.0 68 40 A 6 ARG H A 5 LYS HBx 1.0 1.8 5.0 69 40 A 5 LYS HBy A 6 ARG H 1.0 1.8 5.0 70 41 A 9 LEU HD1% A 5 LYS HBx 1.0 1.8 5.0 71 41 A 5 LYS HBy A 9 LEU HD1% 1.0 1.8 5.0 72 42 A 6 ARG H A 5 LYS HDx 1.0 1.8 5.0 73 42 A 6 ARG H A 5 LYS HDy 1.0 1.8 5.0 74 43 A 9 LEU HD1% A 5 LYS HEx 1.0 1.8 5.0 75 43 A 5 LYS HEy A 9 LEU HD1% 1.0 1.8 5.0 76 44 A 6 ARG H A 6 ARG HA 1.0 1.8 3.5 77 45 A 6 ARG H A 6 ARG HBx 1.0 1.8 5.0 78 45 A 6 ARG H A 6 ARG HBy 1.0 1.8 5.0 79 46 A 6 ARG H A 9 LEU HD1% 1.0 1.8 5.0 80 47 A 6 ARG HA A 6 ARG HDy 1.0 1.8 5.0 81 47 A 6 ARG HA A 6 ARG HDx 1.0 1.8 5.0 82 48 A 7 ASP H A 6 ARG HA 1.0 1.8 3.5 83 49 A 6 ARG HA A 9 LEU HBx 1.0 1.8 5.0 84 50 A 6 ARG HA A 9 LEU HBy 1.0 1.8 5.0 85 51 A 9 LEU HD1% A 6 ARG HA 1.0 1.8 5.0 86 52 A 7 ASP H A 6 ARG HBx 1.0 1.8 3.5 87 52 A 7 ASP H A 6 ARG HBy 1.0 1.8 3.5 88 53 A 7 ASP H A 6 ARG HGx 1.0 1.8 5.0 89 53 A 7 ASP H A 6 ARG HGy 1.0 1.8 5.0 90 54 A 6 ARG HGx A 9 LEU HBx 1.0 1.8 5.0 91 54 A 6 ARG HGy A 9 LEU HBx 1.0 1.8 5.0 92 55 A 9 LEU HBy A 6 ARG HGx 1.0 1.8 5.0 93 55 A 6 ARG HGy A 9 LEU HBy 1.0 1.8 5.0 94 56 A 9 LEU HD1% A 6 ARG HGx 1.0 1.8 5.0 95 56 A 9 LEU HD1% A 6 ARG HGy 1.0 1.8 5.0 96 57 A 6 ARG HGy A 10 GLU HGx 1.0 1.8 5.0 97 57 A 6 ARG HGx A 10 GLU HGx 1.0 1.8 5.0 98 57 A 10 GLU HGy A 6 ARG HGx 1.0 1.8 5.0 99 57 A 6 ARG HGy A 10 GLU HGy 1.0 1.8 5.0 100 58 A 6 ARG HDy A 10 GLU HBx 1.0 1.8 5.0 101 58 A 6 ARG HDx A 10 GLU HBx 1.0 1.8 5.0 102 58 A 10 GLU HBy A 6 ARG HDy 1.0 1.8 5.0 103 58 A 6 ARG HDx A 10 GLU HBy 1.0 1.8 5.0 104 59 A 7 ASP H A 7 ASP HA 1.0 1.8 5.0 105 60 A 7 ASP H A 7 ASP HBx 1.0 1.8 5.0 106 61 A 7 ASP H A 7 ASP HBy 1.0 1.8 5.0 107 62 A 7 ASP H A 8 ARG H 1.0 1.8 5.0 108 63 A 7 ASP HA A 8 ARG H 1.0 1.8 5.0 109 64 A 7 ASP HA A 10 GLU H 1.0 1.8 5.0 110 65 A 7 ASP HA A 10 GLU HBx 1.0 1.8 5.0 111 65 A 10 GLU HBy A 7 ASP HA 1.0 1.8 5.0 112 66 A 7 ASP HA A 11 ARG H 1.0 1.8 5.0 113 67 A 7 ASP HBx A 8 ARG H 1.0 1.8 5.0 114 68 A 8 ARG H A 7 ASP HBy 1.0 1.8 5.0 115 69 A 7 ASP HBx A 8 ARG HBy 1.0 1.8 5.0 116 69 A 7 ASP HBx A 8 ARG HBx 1.0 1.8 5.0 117 70 A 8 ARG HBy A 7 ASP HBy 1.0 1.8 5.0 118 70 A 7 ASP HBy A 8 ARG HBx 1.0 1.8 5.0 119 71 A 8 ARG H A 8 ARG HA 1.0 1.8 5.0 120 72 A 8 ARG HGx A 8 ARG H 1.0 1.8 5.0 121 73 A 8 ARG H A 8 ARG HGy 1.0 1.8 5.0 122 74 A 8 ARG H A 9 LEU H 1.0 1.8 5.0 123 75 A 8 ARG HA A 8 ARG HDx 1.0 1.8 5.0 124 75 A 8 ARG HA A 8 ARG HDy 1.0 1.8 5.0 125 76 A 8 ARG HA A 9 LEU H 1.0 1.8 5.0 126 77 A 8 ARG HA A 11 ARG HBx 1.0 1.8 5.0 127 77 A 8 ARG HA A 11 ARG HBy 1.0 1.8 5.0 128 78 A 8 ARG HA A 11 ARG HDy 1.0 1.8 5.0 129 78 A 8 ARG HA A 11 ARG HDx 1.0 1.8 5.0 130 79 A 8 ARG HA A 12 ALA H 1.0 1.8 5.0 131 80 A 9 LEU H A 8 ARG HBx 1.0 1.8 5.0 132 80 A 8 ARG HBy A 9 LEU H 1.0 1.8 5.0 133 81 A 9 LEU HD2% A 8 ARG HBx 1.0 1.8 5.0 134 81 A 8 ARG HBy A 9 LEU HD2% 1.0 1.8 5.0 135 82 A 9 LEU H A 8 ARG HGy 1.0 1.8 5.0 136 82 A 8 ARG HGx A 9 LEU H 1.0 1.8 5.0 137 83 A 9 LEU HG A 8 ARG HGy 1.0 1.8 5.0 138 83 A 8 ARG HGx A 9 LEU HG 1.0 1.8 5.0 139 84 A 8 ARG HGx A 9 LEU HD2% 1.0 1.8 5.0 140 85 A 9 LEU HD1% A 8 ARG HGy 1.0 1.8 5.0 141 86 A 9 LEU HD2% A 8 ARG HGy 1.0 1.8 5.0 142 87 A 9 LEU H A 9 LEU HA 1.0 1.8 5.0 143 88 A 9 LEU H A 9 LEU HBx 1.0 1.8 5.0 144 89 A 9 LEU H A 9 LEU HBy 1.0 1.8 5.0 145 90 A 9 LEU H A 9 LEU HG 1.0 1.8 5.0 146 91 A 9 LEU HD1% A 9 LEU H 1.0 1.8 5.0 147 92 A 9 LEU H A 9 LEU HD2% 1.0 1.8 5.0 148 93 A 10 GLU H A 9 LEU H 1.0 1.8 5.0 149 94 A 9 LEU H A 10 GLU HBx 1.0 1.8 5.0 150 94 A 10 GLU HBy A 9 LEU H 1.0 1.8 5.0 151 95 A 9 LEU H A 11 ARG H 1.0 1.8 5.0 152 96 A 9 LEU HD1% A 9 LEU HA 1.0 1.8 5.0 153 97 A 9 LEU HD2% A 9 LEU HA 1.0 1.8 5.0 154 98 A 10 GLU H A 9 LEU HA 1.0 1.8 5.0 155 99 A 9 LEU HA A 11 ARG H 1.0 1.8 5.0 156 100 A 9 LEU HA A 12 ALA H 1.0 1.8 5.0 157 101 A 9 LEU HA A 12 ALA HB% 1.0 1.8 5.0 158 102 A 9 LEU HA A 13 GLN H 1.0 1.8 5.0 159 103 A 10 GLU H A 9 LEU HBx 1.0 1.8 5.0 160 104 A 10 GLU H A 9 LEU HBy 1.0 1.8 5.0 161 105 A 9 LEU HBy A 39 TYR HBy 1.0 1.8 5.0 162 105 A 9 LEU HBx A 39 TYR HBy 1.0 1.8 5.0 163 105 A 39 TYR HBx A 9 LEU HBx 1.0 1.8 5.0 164 105 A 9 LEU HBy A 39 TYR HBx 1.0 1.8 5.0 165 106 A 39 TYR HD% A 9 LEU HBx 1.0 1.8 5.0 166 106 A 9 LEU HBy A 39 TYR HD% 1.0 1.8 5.0 167 107 A 39 TYR HE% A 9 LEU HBx 1.0 1.8 5.0 168 108 A 9 LEU HBy A 39 TYR HE% 1.0 1.8 5.0 169 109 A 10 GLU H A 9 LEU HG 1.0 1.8 5.0 170 110 A 9 LEU HG A 35 ASP HBy 1.0 1.8 5.0 171 110 A 9 LEU HG A 35 ASP HBx 1.0 1.8 5.0 172 111 A 9 LEU HG A 36 ALA HB% 1.0 1.8 5.0 173 112 A 9 LEU HG A 39 TYR HBy 1.0 1.8 5.0 174 112 A 9 LEU HG A 39 TYR HBx 1.0 1.8 5.0 175 113 A 9 LEU HD1% A 10 GLU H 1.0 1.8 5.0 176 114 A 10 GLU H A 9 LEU HD2% 1.0 1.8 5.0 177 115 A 9 LEU HD2% A 12 ALA HB% 1.0 1.8 5.0 178 116 A 9 LEU HD1% A 35 ASP H 1.0 1.8 5.0 179 117 A 9 LEU HD2% A 35 ASP HA 1.0 1.8 5.0 180 118 A 9 LEU HD1% A 35 ASP HBx 1.0 1.8 5.0 181 119 A 9 LEU HD1% A 35 ASP HBy 1.0 1.8 5.0 182 120 A 9 LEU HD2% A 35 ASP HBx 1.0 1.8 5.0 183 121 A 9 LEU HD2% A 35 ASP HBy 1.0 1.8 5.0 184 122 A 9 LEU HD2% A 36 ALA H 1.0 1.8 5.0 185 123 A 9 LEU HD2% A 36 ALA HA 1.0 1.8 5.0 186 124 A 9 LEU HD2% A 36 ALA HB% 1.0 1.8 5.0 187 125 A 9 LEU HD2% A 39 TYR H 1.0 1.8 5.0 188 126 A 9 LEU HD2% A 39 TYR HA 1.0 1.8 5.0 189 127 A 9 LEU HD1% A 39 TYR HBy 1.0 1.8 5.0 190 127 A 9 LEU HD1% A 39 TYR HBx 1.0 1.8 5.0 191 128 A 9 LEU HD2% A 39 TYR HBy 1.0 1.8 5.0 192 128 A 9 LEU HD2% A 39 TYR HBx 1.0 1.8 5.0 193 129 A 9 LEU HD1% A 39 TYR HD% 1.0 1.8 5.0 194 130 A 9 LEU HD2% A 39 TYR HD% 1.0 1.8 5.0 195 131 A 9 LEU HD1% A 39 TYR HE% 1.0 1.8 5.0 196 132 A 9 LEU HD2% A 39 TYR HE% 1.0 1.8 5.0 197 133 A 10 GLU H A 10 GLU HA 1.0 1.8 3.5 198 134 A 10 GLU H A 10 GLU HBx 1.0 1.8 2.9 199 134 A 10 GLU HBy A 10 GLU H 1.0 1.8 2.9 200 135 A 10 GLU HGy A 10 GLU H 1.0 1.8 5.0 201 136 A 10 GLU H A 10 GLU HGx 1.0 1.8 5.0 202 137 A 10 GLU H A 11 ARG H 1.0 1.8 2.9 203 138 A 10 GLU H A 12 ALA H 1.0 1.8 5.0 204 139 A 10 GLU HA A 11 ARG H 1.0 1.8 5.0 205 140 A 10 GLU HA A 13 GLN H 1.0 1.8 5.0 206 141 A 10 GLU HA A 13 GLN HBx 1.0 1.8 5.0 207 142 A 10 GLU HA A 13 GLN HBy 1.0 1.8 5.0 208 143 A 10 GLU HBy A 11 ARG H 1.0 1.8 3.5 209 143 A 11 ARG H A 10 GLU HBx 1.0 1.8 3.5 210 144 A 10 GLU HGy A 11 ARG H 1.0 1.8 5.0 211 145 A 11 ARG H A 10 GLU HGx 1.0 1.8 5.0 212 146 A 11 ARG HA A 11 ARG H 1.0 1.8 3.5 213 147 A 11 ARG HBy A 11 ARG H 1.0 1.8 2.9 214 147 A 11 ARG H A 11 ARG HBx 1.0 1.8 2.9 215 148 A 11 ARG HGx A 11 ARG H 1.0 1.8 5.0 216 149 A 11 ARG H A 11 ARG HGy 1.0 1.8 5.0 217 150 A 11 ARG HDx A 11 ARG H 1.0 1.8 5.0 218 150 A 11 ARG H A 11 ARG HDy 1.0 1.8 5.0 219 151 A 11 ARG H A 12 ALA H 1.0 1.8 5.0 220 152 A 11 ARG H A 13 GLN H 1.0 1.8 3.5 221 153 A 11 ARG HDx A 11 ARG HA 1.0 1.8 5.0 222 154 A 11 ARG HA A 11 ARG HDy 1.0 1.8 5.0 223 155 A 11 ARG HA A 12 ALA H 1.0 1.8 5.0 224 156 A 11 ARG HA A 14 SER H 1.0 1.8 5.0 225 157 A 11 ARG HA A 14 SER HBx 1.0 1.8 3.5 226 157 A 11 ARG HA A 14 SER HBy 1.0 1.8 3.5 227 158 A 11 ARG HA A 15 GLN H 1.0 1.8 5.0 228 159 A 11 ARG HBy A 12 ALA H 1.0 1.8 3.5 229 159 A 12 ALA H A 11 ARG HBx 1.0 1.8 3.5 230 160 A 12 ALA HB% A 11 ARG HBx 1.0 1.8 5.0 231 160 A 11 ARG HBy A 12 ALA HB% 1.0 1.8 5.0 232 161 A 13 GLN H A 11 ARG HBx 1.0 1.8 5.0 233 161 A 11 ARG HBy A 13 GLN H 1.0 1.8 5.0 234 162 A 14 SER H A 11 ARG HBx 1.0 1.8 5.0 235 162 A 11 ARG HBy A 14 SER H 1.0 1.8 5.0 236 163 A 11 ARG HBy A 14 SER HBx 1.0 1.8 5.0 237 163 A 14 SER HBy A 11 ARG HBx 1.0 1.8 5.0 238 163 A 11 ARG HBy A 14 SER HBy 1.0 1.8 5.0 239 163 A 11 ARG HBx A 14 SER HBx 1.0 1.8 5.0 240 164 A 11 ARG HBy A 15 GLN H 1.0 1.8 5.0 241 164 A 15 GLN H A 11 ARG HBx 1.0 1.8 5.0 242 165 A 11 ARG HBy A 15 GLN HBx 1.0 1.8 5.0 243 165 A 11 ARG HBx A 15 GLN HBx 1.0 1.8 5.0 244 165 A 15 GLN HBy A 11 ARG HBx 1.0 1.8 5.0 245 165 A 11 ARG HBy A 15 GLN HBy 1.0 1.8 5.0 246 166 A 11 ARG HGx A 12 ALA H 1.0 1.8 5.0 247 167 A 12 ALA H A 11 ARG HGy 1.0 1.8 5.0 248 168 A 11 ARG HGx A 14 SER HBx 1.0 1.8 5.0 249 168 A 11 ARG HGy A 14 SER HBx 1.0 1.8 5.0 250 168 A 14 SER HBy A 11 ARG HGy 1.0 1.8 5.0 251 168 A 14 SER HBy A 11 ARG HGx 1.0 1.8 5.0 252 169 A 12 ALA HA A 12 ALA H 1.0 1.8 5.0 253 170 A 12 ALA HB% A 12 ALA H 1.0 1.8 5.0 254 171 A 12 ALA H A 13 GLN H 1.0 1.8 5.0 255 172 A 14 SER H A 12 ALA H 1.0 1.8 5.0 256 173 A 12 ALA H A 15 GLN H 1.0 1.8 5.0 257 174 A 12 ALA H A 15 GLN HBx 1.0 1.8 5.0 258 175 A 15 GLN HBy A 12 ALA H 1.0 1.8 5.0 259 176 A 12 ALA HA A 13 GLN H 1.0 1.8 5.0 260 177 A 14 SER H A 12 ALA HA 1.0 1.8 5.0 261 178 A 12 ALA HA A 15 GLN H 1.0 1.8 5.0 262 179 A 12 ALA HA A 15 GLN HBx 1.0 1.8 5.0 263 180 A 15 GLN HBy A 12 ALA HA 1.0 1.8 5.0 264 181 A 12 ALA HA A 16 GLY H 1.0 1.8 5.0 265 182 A 12 ALA HA A 31 TYR HE% 1.0 1.8 5.0 266 183 A 12 ALA HA A 40 TRP HD1 1.0 1.8 5.0 267 184 A 12 ALA HB% A 13 GLN H 1.0 1.8 5.0 268 185 A 12 ALA HB% A 13 GLN HA 1.0 1.8 5.0 269 186 A 12 ALA HB% A 13 GLN HBx 1.0 1.8 5.0 270 186 A 12 ALA HB% A 13 GLN HBy 1.0 1.8 5.0 271 187 A 12 ALA HB% A 14 SER H 1.0 1.8 5.0 272 188 A 12 ALA HB% A 15 GLN H 1.0 1.8 5.0 273 189 A 12 ALA HB% A 15 GLN HBx 1.0 1.8 5.0 274 189 A 12 ALA HB% A 15 GLN HBy 1.0 1.8 5.0 275 190 A 12 ALA HB% A 31 TYR HBx 1.0 1.8 5.0 276 191 A 12 ALA HB% A 31 TYR HBy 1.0 1.8 5.0 277 192 A 12 ALA HB% A 31 TYR HD% 1.0 1.8 5.0 278 193 A 12 ALA HB% A 31 TYR HE% 1.0 1.8 5.0 279 194 A 12 ALA HB% A 36 ALA HA 1.0 1.8 5.0 280 195 A 12 ALA HB% A 36 ALA HB% 1.0 1.8 5.0 281 196 A 12 ALA HB% A 39 TYR H 1.0 1.8 5.0 282 197 A 12 ALA HB% A 39 TYR HA 1.0 1.8 5.0 283 198 A 12 ALA HB% A 39 TYR HBx 1.0 1.8 5.0 284 199 A 12 ALA HB% A 39 TYR HBy 1.0 1.8 5.0 285 200 A 12 ALA HB% A 39 TYR HD% 1.0 1.8 5.0 286 201 A 12 ALA HB% A 40 TRP H 1.0 1.8 5.0 287 202 A 12 ALA HB% A 40 TRP HA 1.0 1.8 5.0 288 203 A 12 ALA HB% A 40 TRP HBx 1.0 1.8 5.0 289 204 A 12 ALA HB% A 40 TRP HBy 1.0 1.8 5.0 290 205 A 12 ALA HB% A 40 TRP HD1 1.0 1.8 5.0 291 206 A 13 GLN HA A 13 GLN H 1.0 1.8 3.5 292 207 A 13 GLN H A 13 GLN HBx 1.0 1.8 3.5 293 208 A 13 GLN HBy A 13 GLN H 1.0 1.8 3.5 294 209 A 14 SER H A 13 GLN H 1.0 1.8 3.5 295 210 A 13 GLN H A 15 GLN H 1.0 1.8 5.0 296 211 A 39 TYR HBx A 13 GLN H 1.0 1.8 5.0 297 212 A 13 GLN H A 39 TYR HBy 1.0 1.8 5.0 298 213 A 39 TYR HD% A 13 GLN H 1.0 1.8 5.0 299 214 A 14 SER H A 13 GLN HA 1.0 1.8 5.0 300 215 A 13 GLN HA A 16 GLY H 1.0 1.8 5.0 301 216 A 39 TYR HBx A 13 GLN HA 1.0 1.8 5.0 302 217 A 13 GLN HA A 39 TYR HBy 1.0 1.8 5.0 303 218 A 13 GLN HA A 40 TRP HA 1.0 1.8 3.5 304 219 A 13 GLN HE2y A 13 GLN HBx 1.0 1.8 5.0 305 219 A 13 GLN HBy A 13 GLN HE2y 1.0 1.8 5.0 306 220 A 13 GLN HE2x A 13 GLN HBx 1.0 1.8 5.0 307 220 A 13 GLN HBy A 13 GLN HE2x 1.0 1.8 5.0 308 221 A 13 GLN HBy A 13 GLN HE2y 1.0 1.8 5.0 309 221 A 13 GLN HBy A 13 GLN HE2x 1.0 1.8 5.0 310 222 A 14 SER H A 13 GLN HBx 1.0 1.8 5.0 311 223 A 14 SER H A 13 GLN HBy 1.0 1.8 5.0 312 224 A 13 GLN HBy A 14 SER HBx 1.0 1.8 5.0 313 224 A 13 GLN HBx A 14 SER HBx 1.0 1.8 5.0 314 224 A 14 SER HBy A 13 GLN HBx 1.0 1.8 5.0 315 224 A 14 SER HBy A 13 GLN HBy 1.0 1.8 5.0 316 225 A 39 TYR HBx A 13 GLN HBx 1.0 1.8 5.0 317 225 A 39 TYR HBx A 13 GLN HBy 1.0 1.8 5.0 318 226 A 13 GLN HBy A 39 TYR HBy 1.0 1.8 5.0 319 226 A 13 GLN HBx A 39 TYR HBy 1.0 1.8 5.0 320 227 A 39 TYR HD% A 13 GLN HBx 1.0 1.8 5.0 321 228 A 39 TYR HD% A 13 GLN HBy 1.0 1.8 5.0 322 229 A 39 TYR HE% A 13 GLN HBx 1.0 1.8 5.0 323 229 A 39 TYR HE% A 13 GLN HBy 1.0 1.8 5.0 324 230 A 14 SER H A 13 GLN HGx 1.0 1.8 5.0 325 230 A 14 SER H A 13 GLN HGy 1.0 1.8 5.0 326 231 A 39 TYR HA A 13 GLN HGx 1.0 1.8 5.0 327 231 A 39 TYR HA A 13 GLN HGy 1.0 1.8 5.0 328 232 A 39 TYR HD% A 13 GLN HGx 1.0 1.8 5.0 329 232 A 39 TYR HD% A 13 GLN HGy 1.0 1.8 5.0 330 233 A 13 GLN HGy A 43 GLY HAx 1.0 1.8 5.0 331 233 A 43 GLY HAx A 13 GLN HGx 1.0 1.8 5.0 332 234 A 13 GLN HGy A 43 GLY HAy 1.0 1.8 5.0 333 234 A 13 GLN HGx A 43 GLY HAy 1.0 1.8 5.0 334 235 A 39 TYR HE% A 13 GLN HE2y 1.0 1.8 5.0 335 235 A 39 TYR HE% A 13 GLN HE2x 1.0 1.8 5.0 336 236 A 14 SER H A 14 SER HA 1.0 1.8 3.5 337 237 A 14 SER H A 14 SER HBx 1.0 1.8 3.5 338 237 A 14 SER H A 14 SER HBy 1.0 1.8 3.5 339 238 A 14 SER H A 15 GLN H 1.0 1.8 5.0 340 239 A 14 SER H A 15 GLN HBx 1.0 1.8 5.0 341 239 A 14 SER H A 15 GLN HBy 1.0 1.8 5.0 342 240 A 14 SER H A 16 GLY H 1.0 1.8 5.0 343 241 A 14 SER HA A 15 GLN H 1.0 1.8 5.0 344 242 A 14 SER HA A 15 GLN HA 1.0 1.8 5.0 345 243 A 14 SER HA A 17 TYR H 1.0 1.8 3.5 346 244 A 14 SER HA A 17 TYR HBx 1.0 1.8 5.0 347 245 A 14 SER HA A 17 TYR HBy 1.0 1.8 5.0 348 246 A 14 SER HA A 17 TYR HD% 1.0 1.8 5.0 349 247 A 14 SER HA A 18 LYS H 1.0 1.8 5.0 350 248 A 15 GLN H A 14 SER HBx 1.0 1.8 5.0 351 248 A 14 SER HBy A 15 GLN H 1.0 1.8 5.0 352 249 A 14 SER HBy A 15 GLN HBx 1.0 1.8 5.0 353 249 A 15 GLN HBy A 14 SER HBx 1.0 1.8 5.0 354 249 A 14 SER HBy A 15 GLN HBy 1.0 1.8 5.0 355 249 A 14 SER HBx A 15 GLN HBx 1.0 1.8 5.0 356 250 A 14 SER HBy A 17 TYR HBy 1.0 1.8 5.0 357 250 A 14 SER HBx A 17 TYR HBy 1.0 1.8 5.0 358 250 A 17 TYR HBx A 14 SER HBx 1.0 1.8 5.0 359 250 A 14 SER HBy A 17 TYR HBx 1.0 1.8 5.0 360 251 A 15 GLN HA A 15 GLN H 1.0 1.8 5.0 361 252 A 15 GLN H A 15 GLN HBx 1.0 1.8 5.0 362 253 A 15 GLN HBy A 15 GLN H 1.0 1.8 5.0 363 254 A 15 GLN HGx A 15 GLN H 1.0 1.8 5.0 364 255 A 15 GLN HGy A 15 GLN H 1.0 1.8 5.0 365 256 A 15 GLN H A 16 GLY H 1.0 1.8 3.5 366 257 A 17 TYR H A 15 GLN H 1.0 1.8 5.0 367 258 A 15 GLN HA A 16 GLY H 1.0 1.8 5.0 368 259 A 15 GLN HA A 18 LYS H 1.0 1.8 5.0 369 260 A 15 GLN HA A 18 LYS HBx 1.0 1.8 5.0 370 261 A 15 GLN HA A 18 LYS HBy 1.0 1.8 5.0 371 262 A 16 GLY H A 15 GLN HBx 1.0 1.8 5.0 372 263 A 15 GLN HBy A 16 GLY H 1.0 1.8 5.0 373 264 A 15 GLN HBy A 16 GLY HAy 1.0 1.8 5.0 374 264 A 15 GLN HBx A 16 GLY HAy 1.0 1.8 5.0 375 264 A 16 GLY HAx A 15 GLN HBx 1.0 1.8 5.0 376 264 A 15 GLN HBy A 16 GLY HAx 1.0 1.8 5.0 377 265 A 31 TYR HE% A 15 GLN HBx 1.0 1.8 5.0 378 266 A 15 GLN HBy A 31 TYR HE% 1.0 1.8 5.0 379 267 A 16 GLY HAx A 16 GLY H 1.0 1.8 5.0 380 268 A 16 GLY H A 16 GLY HAy 1.0 1.8 5.0 381 269 A 17 TYR H A 16 GLY H 1.0 1.8 3.5 382 270 A 17 TYR HBx A 16 GLY H 1.0 1.8 5.0 383 270 A 16 GLY H A 17 TYR HBy 1.0 1.8 5.0 384 271 A 16 GLY H A 18 LYS H 1.0 1.8 5.0 385 272 A 19 ALA HB% A 16 GLY H 1.0 1.8 5.0 386 273 A 40 TRP HA A 16 GLY H 1.0 1.8 5.0 387 274 A 40 TRP HD1 A 16 GLY H 1.0 1.8 5.0 388 275 A 40 TRP HE1 A 16 GLY H 1.0 1.8 5.0 389 276 A 17 TYR H A 16 GLY HAx 1.0 1.8 5.0 390 277 A 17 TYR H A 16 GLY HAy 1.0 1.8 5.0 391 278 A 19 ALA H A 16 GLY HAy 1.0 1.8 5.0 392 278 A 16 GLY HAx A 19 ALA H 1.0 1.8 5.0 393 279 A 16 GLY HAx A 19 ALA HB% 1.0 1.8 5.0 394 280 A 19 ALA HB% A 16 GLY HAy 1.0 1.8 5.0 395 281 A 20 GLY H A 16 GLY HAy 1.0 1.8 5.0 396 281 A 16 GLY HAx A 20 GLY H 1.0 1.8 5.0 397 282 A 40 TRP HA A 16 GLY HAx 1.0 1.8 5.0 398 283 A 40 TRP HA A 16 GLY HAy 1.0 1.8 5.0 399 284 A 40 TRP HD1 A 16 GLY HAy 1.0 1.8 5.0 400 284 A 40 TRP HD1 A 16 GLY HAx 1.0 1.8 5.0 401 285 A 40 TRP HE1 A 16 GLY HAy 1.0 1.8 5.0 402 285 A 16 GLY HAx A 40 TRP HE1 1.0 1.8 5.0 403 286 A 40 TRP HH2 A 16 GLY HAy 1.0 1.8 5.0 404 286 A 16 GLY HAx A 40 TRP HH2 1.0 1.8 5.0 405 287 A 16 GLY HAx A 44 TRP H 1.0 1.8 5.0 406 288 A 44 TRP H A 16 GLY HAy 1.0 1.8 5.0 407 289 A 17 TYR H A 17 TYR HA 1.0 1.8 5.0 408 290 A 17 TYR H A 17 TYR HBx 1.0 1.8 5.0 409 291 A 17 TYR H A 17 TYR HBy 1.0 1.8 5.0 410 292 A 17 TYR H A 17 TYR HD% 1.0 1.8 5.0 411 293 A 17 TYR H A 18 LYS H 1.0 1.8 3.5 412 294 A 17 TYR H A 19 ALA HB% 1.0 1.8 5.0 413 295 A 17 TYR H A 47 ALA HB% 1.0 1.8 5.0 414 296 A 17 TYR HA A 20 GLY H 1.0 1.8 5.0 415 297 A 17 TYR HA A 21 LEU HD2% 1.0 1.8 5.0 416 298 A 17 TYR HA A 44 TRP HA 1.0 1.8 5.0 417 299 A 17 TYR HA A 47 ALA H 1.0 1.8 5.0 418 300 A 17 TYR HA A 47 ALA HB% 1.0 1.8 5.0 419 301 A 17 TYR HBx A 17 TYR HE% 1.0 1.8 5.0 420 302 A 17 TYR HE% A 17 TYR HBy 1.0 1.8 5.0 421 303 A 17 TYR HBx A 18 LYS H 1.0 1.8 5.0 422 304 A 18 LYS H A 17 TYR HBy 1.0 1.8 5.0 423 305 A 21 LEU HD2% A 17 TYR HBy 1.0 1.8 5.0 424 305 A 17 TYR HBx A 21 LEU HD2% 1.0 1.8 5.0 425 306 A 17 TYR HBx A 43 GLY HAx 1.0 1.8 5.0 426 306 A 43 GLY HAx A 17 TYR HBy 1.0 1.8 5.0 427 307 A 17 TYR HBx A 43 GLY HAy 1.0 1.8 5.0 428 307 A 17 TYR HBy A 43 GLY HAy 1.0 1.8 5.0 429 308 A 47 ALA HB% A 17 TYR HBy 1.0 1.8 5.0 430 308 A 17 TYR HBx A 47 ALA HB% 1.0 1.8 5.0 431 309 A 17 TYR HD% A 18 LYS H 1.0 1.8 5.0 432 310 A 17 TYR HD% A 18 LYS HA 1.0 1.8 5.0 433 311 A 17 TYR HD% A 21 LEU HD1% 1.0 1.8 5.0 434 312 A 17 TYR HD% A 21 LEU HD2% 1.0 1.8 5.0 435 313 A 17 TYR HD% A 43 GLY HAy 1.0 1.8 5.0 436 313 A 17 TYR HD% A 43 GLY HAx 1.0 1.8 5.0 437 314 A 17 TYR HD% A 46 ASP HBx 1.0 1.8 5.0 438 315 A 17 TYR HD% A 46 ASP HBy 1.0 1.8 5.0 439 316 A 17 TYR HD% A 47 ALA H 1.0 1.8 5.0 440 317 A 17 TYR HD% A 47 ALA HA 1.0 1.8 5.0 441 318 A 17 TYR HD% A 47 ALA HB% 1.0 1.8 5.0 442 319 A 17 TYR HE% A 21 LEU HD1% 1.0 1.8 5.0 443 320 A 21 LEU HD2% A 17 TYR HE% 1.0 1.8 5.0 444 321 A 17 TYR HE% A 46 ASP HBx 1.0 1.8 5.0 445 322 A 17 TYR HE% A 46 ASP HBy 1.0 1.8 5.0 446 323 A 17 TYR HE% A 47 ALA H 1.0 1.8 5.0 447 324 A 17 TYR HE% A 47 ALA HA 1.0 1.8 5.0 448 325 A 47 ALA HB% A 17 TYR HE% 1.0 1.8 5.0 449 326 A 18 LYS HA A 18 LYS H 1.0 1.8 3.5 450 327 A 18 LYS H A 18 LYS HBx 1.0 1.8 5.0 451 328 A 18 LYS HBy A 18 LYS H 1.0 1.8 5.0 452 329 A 18 LYS HGx A 18 LYS H 1.0 1.8 5.0 453 330 A 18 LYS H A 18 LYS HGy 1.0 1.8 5.0 454 331 A 18 LYS HDy A 18 LYS H 1.0 1.8 5.0 455 331 A 18 LYS H A 18 LYS HDx 1.0 1.8 5.0 456 332 A 19 ALA HB% A 18 LYS H 1.0 1.8 5.0 457 333 A 18 LYS HA A 18 LYS HDx 1.0 1.8 5.0 458 333 A 18 LYS HA A 18 LYS HDy 1.0 1.8 5.0 459 334 A 18 LYS HA A 19 ALA H 1.0 1.8 5.0 460 335 A 18 LYS HA A 20 GLY H 1.0 1.8 5.0 461 336 A 18 LYS HA A 21 LEU H 1.0 1.8 5.0 462 337 A 18 LYS HA A 21 LEU HBx 1.0 1.8 5.0 463 338 A 18 LYS HA A 21 LEU HBy 1.0 1.8 5.0 464 339 A 18 LYS HA A 21 LEU HD1% 1.0 1.8 5.0 465 340 A 21 LEU HD2% A 18 LYS HA 1.0 1.8 5.0 466 341 A 18 LYS HA A 22 ASN H 1.0 1.8 5.0 467 342 A 18 LYS HEy A 18 LYS HBx 1.0 1.8 5.0 468 342 A 18 LYS HBx A 18 LYS HEx 1.0 1.8 5.0 469 343 A 18 LYS HEy A 18 LYS HBy 1.0 1.8 5.0 470 343 A 18 LYS HBy A 18 LYS HEx 1.0 1.8 5.0 471 344 A 18 LYS HBy A 19 ALA H 1.0 1.8 5.0 472 344 A 19 ALA H A 18 LYS HBx 1.0 1.8 5.0 473 345 A 19 ALA HA A 18 LYS HBx 1.0 1.8 5.0 474 345 A 18 LYS HBy A 19 ALA HA 1.0 1.8 5.0 475 346 A 22 ASN HBx A 18 LYS HBx 1.0 1.8 5.0 476 346 A 18 LYS HBx A 22 ASN HBy 1.0 1.8 5.0 477 347 A 18 LYS HBy A 22 ASN HBx 1.0 1.8 5.0 478 347 A 18 LYS HBy A 22 ASN HBy 1.0 1.8 5.0 479 348 A 18 LYS HGx A 18 LYS HEx 1.0 1.8 5.0 480 348 A 18 LYS HEy A 18 LYS HGx 1.0 1.8 5.0 481 349 A 18 LYS HEy A 18 LYS HGy 1.0 1.8 5.0 482 349 A 18 LYS HEx A 18 LYS HGy 1.0 1.8 5.0 483 350 A 21 LEU HBy A 18 LYS HGx 1.0 1.8 5.0 484 350 A 18 LYS HGx A 21 LEU HBx 1.0 1.8 5.0 485 351 A 21 LEU HBy A 18 LYS HGy 1.0 1.8 5.0 486 351 A 18 LYS HGy A 21 LEU HBx 1.0 1.8 5.0 487 352 A 21 LEU HD2% A 18 LYS HGy 1.0 1.8 5.0 488 352 A 21 LEU HD2% A 18 LYS HGx 1.0 1.8 5.0 489 353 A 22 ASN HBx A 18 LYS HGx 1.0 1.8 5.0 490 353 A 18 LYS HGx A 22 ASN HBy 1.0 1.8 5.0 491 354 A 22 ASN HBx A 18 LYS HGy 1.0 1.8 5.0 492 354 A 18 LYS HGy A 22 ASN HBy 1.0 1.8 5.0 493 355 A 18 LYS HGx A 22 ASN HD2y 1.0 1.8 5.0 494 355 A 18 LYS HGx A 22 ASN HD2x 1.0 1.8 5.0 495 356 A 22 ASN HD2x A 18 LYS HGy 1.0 1.8 5.0 496 356 A 18 LYS HGy A 22 ASN HD2y 1.0 1.8 5.0 497 356 A 18 LYS HGx A 22 ASN HD2y 1.0 1.8 5.0 498 356 A 18 LYS HGx A 22 ASN HD2x 1.0 1.8 5.0 499 357 A 18 LYS HGy A 22 ASN HD2y 1.0 1.8 5.0 500 357 A 22 ASN HD2x A 18 LYS HGy 1.0 1.8 5.0 501 358 A 19 ALA HA A 19 ALA H 1.0 1.8 5.0 502 359 A 19 ALA HB% A 19 ALA H 1.0 1.8 5.0 503 360 A 19 ALA H A 20 GLY H 1.0 1.8 3.5 504 361 A 21 LEU H A 19 ALA H 1.0 1.8 5.0 505 362 A 19 ALA HA A 20 GLY H 1.0 1.8 5.0 506 363 A 19 ALA HA A 20 GLY HAy 1.0 1.8 5.0 507 363 A 19 ALA HA A 20 GLY HAx 1.0 1.8 5.0 508 364 A 21 LEU H A 19 ALA HA 1.0 1.8 5.0 509 365 A 19 ALA HA A 22 ASN H 1.0 1.8 5.0 510 366 A 19 ALA HA A 22 ASN HBx 1.0 1.8 5.0 511 367 A 19 ALA HA A 22 ASN HBy 1.0 1.8 5.0 512 368 A 19 ALA HA A 23 GLY H 1.0 1.8 5.0 513 369 A 19 ALA HB% A 20 GLY H 1.0 1.8 5.0 514 370 A 19 ALA HB% A 20 GLY HAx 1.0 1.8 5.0 515 371 A 19 ALA HB% A 20 GLY HAy 1.0 1.8 5.0 516 372 A 19 ALA HB% A 23 GLY H 1.0 1.8 5.0 517 373 A 19 ALA HB% A 24 ARG H 1.0 1.8 5.0 518 374 A 19 ALA HB% A 26 GLN HA 1.0 1.8 5.0 519 375 A 19 ALA HB% A 30 PRO HDy 1.0 1.8 5.0 520 375 A 19 ALA HB% A 30 PRO HDx 1.0 1.8 5.0 521 376 A 19 ALA HB% A 40 TRP HE1 1.0 1.8 5.0 522 377 A 19 ALA HB% A 40 TRP HZ2 1.0 1.8 5.0 523 378 A 19 ALA HB% A 40 TRP HZ3 1.0 1.8 5.0 524 379 A 19 ALA HB% A 40 TRP HH2 1.0 1.8 5.0 525 380 A 19 ALA HB% A 44 TRP HD1 1.0 1.8 5.0 526 381 A 19 ALA HB% A 44 TRP HE1 1.0 1.8 5.0 527 382 A 20 GLY HAx A 20 GLY H 1.0 1.8 5.0 528 383 A 20 GLY H A 20 GLY HAy 1.0 1.8 5.0 529 384 A 21 LEU H A 20 GLY H 1.0 1.8 3.5 530 385 A 20 GLY H A 22 ASN H 1.0 1.8 5.0 531 386 A 20 GLY H A 23 GLY H 1.0 1.8 5.0 532 387 A 44 TRP HA A 20 GLY H 1.0 1.8 5.0 533 388 A 44 TRP HD1 A 20 GLY H 1.0 1.8 5.0 534 389 A 47 ALA HB% A 20 GLY H 1.0 1.8 5.0 535 390 A 21 LEU H A 20 GLY HAx 1.0 1.8 5.0 536 391 A 21 LEU H A 20 GLY HAy 1.0 1.8 5.0 537 392 A 20 GLY HAx A 23 GLY H 1.0 1.8 5.0 538 393 A 23 GLY H A 20 GLY HAy 1.0 1.8 5.0 539 394 A 24 ARG H A 20 GLY HAy 1.0 1.8 5.0 540 394 A 20 GLY HAx A 24 ARG H 1.0 1.8 5.0 541 395 A 24 ARG HA A 20 GLY HAy 1.0 1.8 5.0 542 395 A 20 GLY HAx A 24 ARG HA 1.0 1.8 5.0 543 396 A 44 TRP HA A 20 GLY HAx 1.0 1.8 5.0 544 397 A 44 TRP HA A 20 GLY HAy 1.0 1.8 5.0 545 398 A 20 GLY HAx A 44 TRP HD1 1.0 1.8 5.0 546 399 A 44 TRP HD1 A 20 GLY HAy 1.0 1.8 5.0 547 400 A 20 GLY HAx A 44 TRP HE1 1.0 1.8 5.0 548 401 A 44 TRP HE1 A 20 GLY HAy 1.0 1.8 5.0 549 402 A 47 ALA HB% A 20 GLY HAx 1.0 1.8 5.0 550 403 A 47 ALA HB% A 20 GLY HAy 1.0 1.8 5.0 551 404 A 21 LEU H A 21 LEU HA 1.0 1.8 3.5 552 405 A 21 LEU H A 21 LEU HBx 1.0 1.8 5.0 553 406 A 21 LEU H A 21 LEU HBy 1.0 1.8 5.0 554 407 A 21 LEU H A 21 LEU HG 1.0 1.8 5.0 555 408 A 21 LEU HD1% A 21 LEU H 1.0 1.8 5.0 556 409 A 21 LEU HD2% A 21 LEU H 1.0 1.8 5.0 557 410 A 21 LEU H A 22 ASN H 1.0 1.8 3.5 558 411 A 21 LEU H A 23 GLY H 1.0 1.8 5.0 559 412 A 21 LEU HD1% A 21 LEU HA 1.0 1.8 5.0 560 413 A 21 LEU HD2% A 21 LEU HA 1.0 1.8 5.0 561 414 A 21 LEU HA A 22 ASN H 1.0 1.8 5.0 562 415 A 21 LEU HA A 23 GLY H 1.0 1.8 5.0 563 416 A 22 ASN H A 21 LEU HBx 1.0 1.8 5.0 564 417 A 21 LEU HBy A 22 ASN H 1.0 1.8 5.0 565 418 A 22 ASN HA A 21 LEU HBx 1.0 1.8 5.0 566 418 A 21 LEU HBy A 22 ASN HA 1.0 1.8 5.0 567 419 A 21 LEU HG A 22 ASN H 1.0 1.8 5.0 568 420 A 21 LEU HD1% A 22 ASN H 1.0 1.8 5.0 569 421 A 21 LEU HD2% A 22 ASN H 1.0 1.8 5.0 570 422 A 22 ASN HA A 22 ASN H 1.0 1.8 3.5 571 423 A 22 ASN HBx A 22 ASN H 1.0 1.8 3.5 572 424 A 22 ASN H A 22 ASN HBy 1.0 1.8 3.5 573 425 A 22 ASN H A 23 GLY H 1.0 1.8 2.9 574 426 A 24 ARG H A 22 ASN H 1.0 1.8 5.0 575 427 A 22 ASN HA A 22 ASN HD2y 1.0 1.8 5.0 576 427 A 22 ASN HA A 22 ASN HD2x 1.0 1.8 5.0 577 428 A 22 ASN HA A 23 GLY H 1.0 1.8 5.0 578 429 A 24 ARG H A 22 ASN HA 1.0 1.8 5.0 579 430 A 22 ASN HBx A 22 ASN HD2x 1.0 1.8 5.0 580 431 A 22 ASN HD2x A 22 ASN HBy 1.0 1.8 5.0 581 432 A 22 ASN HBx A 23 GLY H 1.0 1.8 5.0 582 433 A 23 GLY H A 22 ASN HBy 1.0 1.8 5.0 583 434 A 22 ASN HBx A 24 ARG H 1.0 1.8 5.0 584 435 A 24 ARG H A 22 ASN HBy 1.0 1.8 5.0 585 436 A 23 GLY HAx A 23 GLY H 1.0 1.8 3.5 586 437 A 23 GLY HAy A 23 GLY H 1.0 1.8 3.5 587 438 A 24 ARG H A 23 GLY H 1.0 1.8 3.5 588 439 A 24 ARG H A 23 GLY HAx 1.0 1.8 5.0 589 440 A 24 ARG H A 23 GLY HAy 1.0 1.8 5.0 590 441 A 24 ARG H A 24 ARG HA 1.0 1.8 5.0 591 442 A 24 ARG H A 24 ARG HBx 1.0 1.8 3.5 592 443 A 24 ARG H A 24 ARG HBy 1.0 1.8 3.5 593 444 A 24 ARG H A 24 ARG HGx 1.0 1.8 5.0 594 445 A 24 ARG H A 24 ARG HGy 1.0 1.8 5.0 595 446 A 24 ARG H A 25 SER H 1.0 1.8 5.0 596 447 A 24 ARG HA A 24 ARG HDx 1.0 1.8 5.0 597 447 A 24 ARG HA A 24 ARG HDy 1.0 1.8 5.0 598 448 A 24 ARG HA A 25 SER H 1.0 1.8 3.5 599 449 A 24 ARG HDy A 24 ARG HBy 1.0 1.8 5.0 600 449 A 24 ARG HBy A 24 ARG HDx 1.0 1.8 5.0 601 450 A 25 SER H A 24 ARG HBx 1.0 1.8 5.0 602 451 A 25 SER H A 24 ARG HBy 1.0 1.8 5.0 603 452 A 28 ALA HB% A 24 ARG HBy 1.0 1.8 5.0 604 452 A 24 ARG HBx A 28 ALA HB% 1.0 1.8 5.0 605 453 A 24 ARG HGx A 25 SER H 1.0 1.8 5.0 606 454 A 24 ARG HGy A 25 SER H 1.0 1.8 5.0 607 455 A 25 SER H A 24 ARG HDx 1.0 1.8 5.0 608 455 A 25 SER H A 24 ARG HDy 1.0 1.8 5.0 609 456 A 25 SER H A 25 SER HA 1.0 1.8 3.5 610 457 A 25 SER H A 25 SER HBx 1.0 1.8 5.0 611 458 A 25 SER H A 25 SER HBy 1.0 1.8 5.0 612 459 A 25 SER H A 26 GLN H 1.0 1.8 5.0 613 460 A 25 SER H A 28 ALA H 1.0 1.8 5.0 614 461 A 25 SER H A 28 ALA HB% 1.0 1.8 5.0 615 462 A 25 SER HA A 26 GLN H 1.0 1.8 2.9 616 463 A 25 SER HA A 44 TRP HZ2 1.0 1.8 5.0 617 464 A 26 GLN H A 25 SER HBx 1.0 1.8 5.0 618 465 A 26 GLN H A 25 SER HBy 1.0 1.8 5.0 619 466 A 26 GLN HA A 25 SER HBy 1.0 1.8 5.0 620 466 A 26 GLN HA A 25 SER HBx 1.0 1.8 5.0 621 467 A 25 SER HBx A 26 GLN HGy 1.0 1.8 5.0 622 467 A 25 SER HBx A 26 GLN HGx 1.0 1.8 5.0 623 468 A 26 GLN HGy A 25 SER HBy 1.0 1.8 5.0 624 468 A 25 SER HBy A 26 GLN HGx 1.0 1.8 5.0 625 469 A 25 SER HBx A 27 GLU H 1.0 1.8 5.0 626 470 A 27 GLU H A 25 SER HBy 1.0 1.8 5.0 627 471 A 27 GLU HA A 25 SER HBy 1.0 1.8 5.0 628 471 A 25 SER HBx A 27 GLU HA 1.0 1.8 5.0 629 472 A 25 SER HBx A 27 GLU HBy 1.0 1.8 5.0 630 472 A 25 SER HBx A 27 GLU HBx 1.0 1.8 5.0 631 473 A 27 GLU HBy A 25 SER HBy 1.0 1.8 5.0 632 473 A 25 SER HBy A 27 GLU HBx 1.0 1.8 5.0 633 474 A 25 SER HBx A 27 GLU HGy 1.0 1.8 5.0 634 474 A 25 SER HBx A 27 GLU HGx 1.0 1.8 5.0 635 475 A 27 GLU HGy A 25 SER HBy 1.0 1.8 5.0 636 475 A 25 SER HBy A 27 GLU HGx 1.0 1.8 5.0 637 476 A 28 ALA H A 25 SER HBy 1.0 1.8 5.0 638 476 A 28 ALA H A 25 SER HBx 1.0 1.8 5.0 639 477 A 28 ALA HB% A 25 SER HBx 1.0 1.8 5.0 640 478 A 28 ALA HB% A 25 SER HBy 1.0 1.8 5.0 641 479 A 26 GLN HA A 26 GLN H 1.0 1.8 3.5 642 480 A 26 GLN H A 26 GLN HBx 1.0 1.8 5.0 643 481 A 26 GLN H A 26 GLN HBy 1.0 1.8 5.0 644 482 A 26 GLN H A 26 GLN HGx 1.0 1.8 5.0 645 483 A 26 GLN H A 26 GLN HGy 1.0 1.8 5.0 646 484 A 26 GLN H A 26 GLN HE2y 1.0 1.8 5.0 647 484 A 26 GLN H A 26 GLN HE2x 1.0 1.8 5.0 648 485 A 26 GLN H A 27 GLU H 1.0 1.8 3.5 649 486 A 26 GLN H A 27 GLU HA 1.0 1.8 5.0 650 487 A 26 GLN H A 27 GLU HBx 1.0 1.8 5.0 651 488 A 26 GLN H A 27 GLU HBy 1.0 1.8 5.0 652 489 A 26 GLN H A 28 ALA H 1.0 1.8 5.0 653 490 A 40 TRP HZ3 A 26 GLN H 1.0 1.8 5.0 654 491 A 44 TRP HE1 A 26 GLN H 1.0 1.8 5.0 655 492 A 26 GLN H A 44 TRP HZ2 1.0 1.8 5.0 656 493 A 26 GLN H A 44 TRP HH2 1.0 1.8 5.0 657 494 A 26 GLN HA A 27 GLU H 1.0 1.8 5.0 658 495 A 26 GLN HA A 28 ALA H 1.0 1.8 5.0 659 496 A 26 GLN HA A 28 ALA HB% 1.0 1.8 5.0 660 497 A 26 GLN HA A 29 CYS H 1.0 1.8 5.0 661 498 A 26 GLN HA A 29 CYS HBy 1.0 1.8 5.0 662 499 A 26 GLN HA A 29 CYS HBx 1.0 1.8 5.0 663 500 A 26 GLN HA A 40 TRP HZ2 1.0 1.8 5.0 664 501 A 26 GLN HA A 40 TRP HZ3 1.0 1.8 5.0 665 502 A 40 TRP HH2 A 26 GLN HA 1.0 1.8 5.0 666 503 A 26 GLN HA A 41 LEU HD2% 1.0 1.8 5.0 667 504 A 26 GLN HA A 44 TRP HE1 1.0 1.8 5.0 668 505 A 26 GLN HE2y A 26 GLN HBx 1.0 1.8 5.0 669 506 A 26 GLN HE2x A 26 GLN HBx 1.0 1.8 5.0 670 507 A 26 GLN HE2y A 26 GLN HBy 1.0 1.8 5.0 671 508 A 26 GLN HE2x A 26 GLN HBy 1.0 1.8 5.0 672 509 A 27 GLU H A 26 GLN HBx 1.0 1.8 5.0 673 510 A 27 GLU H A 26 GLN HBy 1.0 1.8 5.0 674 511 A 27 GLU HA A 26 GLN HBx 1.0 1.8 5.0 675 512 A 27 GLU HA A 26 GLN HBy 1.0 1.8 5.0 676 513 A 28 ALA H A 26 GLN HBx 1.0 1.8 5.0 677 514 A 28 ALA H A 26 GLN HBy 1.0 1.8 5.0 678 515 A 29 CYS H A 26 GLN HBx 1.0 1.8 5.0 679 515 A 29 CYS H A 26 GLN HBy 1.0 1.8 5.0 680 516 A 29 CYS HBx A 26 GLN HBx 1.0 1.8 5.0 681 516 A 26 GLN HBx A 29 CYS HBy 1.0 1.8 5.0 682 517 A 26 GLN HBy A 29 CYS HBx 1.0 1.8 5.0 683 517 A 26 GLN HBy A 29 CYS HBy 1.0 1.8 5.0 684 518 A 40 TRP HZ3 A 26 GLN HBx 1.0 1.8 5.0 685 519 A 40 TRP HZ3 A 26 GLN HBy 1.0 1.8 5.0 686 520 A 40 TRP HH2 A 26 GLN HBx 1.0 1.8 5.0 687 520 A 40 TRP HH2 A 26 GLN HBy 1.0 1.8 5.0 688 521 A 41 LEU HG A 26 GLN HBx 1.0 1.8 5.0 689 521 A 26 GLN HBy A 41 LEU HG 1.0 1.8 5.0 690 522 A 41 LEU HD1% A 26 GLN HBx 1.0 1.8 5.0 691 522 A 26 GLN HBy A 41 LEU HD1% 1.0 1.8 5.0 692 523 A 26 GLN HE2y A 26 GLN HGx 1.0 1.8 5.0 693 523 A 26 GLN HE2x A 26 GLN HGx 1.0 1.8 5.0 694 524 A 27 GLU H A 26 GLN HGx 1.0 1.8 5.0 695 525 A 26 GLN HGy A 27 GLU H 1.0 1.8 5.0 696 526 A 40 TRP HZ3 A 26 GLN HGx 1.0 1.8 5.0 697 527 A 40 TRP HZ3 A 26 GLN HGy 1.0 1.8 5.0 698 528 A 41 LEU HD2% A 26 GLN HGx 1.0 1.8 5.0 699 528 A 26 GLN HGy A 41 LEU HD2% 1.0 1.8 5.0 700 529 A 44 TRP HZ2 A 26 GLN HGx 1.0 1.8 5.0 701 529 A 44 TRP HZ2 A 26 GLN HGy 1.0 1.8 5.0 702 530 A 44 TRP HH2 A 26 GLN HGx 1.0 1.8 5.0 703 530 A 26 GLN HGy A 44 TRP HH2 1.0 1.8 5.0 704 531 A 26 GLN HE2y A 41 LEU HD1% 1.0 1.8 5.0 705 532 A 41 LEU HD2% A 26 GLN HE2y 1.0 1.8 5.0 706 533 A 26 GLN HE2x A 41 LEU HD1% 1.0 1.8 5.0 707 534 A 41 LEU HD2% A 26 GLN HE2x 1.0 1.8 5.0 708 535 A 27 GLU H A 27 GLU HA 1.0 1.8 3.5 709 536 A 27 GLU H A 27 GLU HBx 1.0 1.8 5.0 710 537 A 27 GLU H A 27 GLU HBy 1.0 1.8 5.0 711 538 A 27 GLU H A 27 GLU HGy 1.0 1.8 5.0 712 539 A 27 GLU H A 27 GLU HGx 1.0 1.8 5.0 713 540 A 28 ALA H A 27 GLU H 1.0 1.8 3.5 714 541 A 28 ALA HB% A 27 GLU H 1.0 1.8 5.0 715 542 A 27 GLU H A 29 CYS H 1.0 1.8 5.0 716 543 A 28 ALA H A 27 GLU HA 1.0 1.8 5.0 717 544 A 28 ALA HB% A 27 GLU HA 1.0 1.8 5.0 718 545 A 27 GLU HA A 29 CYS H 1.0 1.8 5.0 719 546 A 28 ALA H A 27 GLU HBx 1.0 1.8 5.0 720 547 A 28 ALA H A 27 GLU HBy 1.0 1.8 5.0 721 548 A 28 ALA H A 27 GLU HGx 1.0 1.8 5.0 722 548 A 28 ALA H A 27 GLU HGy 1.0 1.8 5.0 723 549 A 28 ALA H A 28 ALA HA 1.0 1.8 5.0 724 550 A 28 ALA HB% A 28 ALA H 1.0 1.8 5.0 725 551 A 28 ALA H A 29 CYS H 1.0 1.8 3.5 726 552 A 40 TRP HH2 A 28 ALA H 1.0 1.8 5.0 727 553 A 29 CYS H A 28 ALA HA 1.0 1.8 5.0 728 554 A 28 ALA HB% A 29 CYS H 1.0 1.8 5.0 729 555 A 28 ALA HB% A 29 CYS HA 1.0 1.8 5.0 730 556 A 28 ALA HB% A 29 CYS HBy 1.0 1.8 5.0 731 556 A 28 ALA HB% A 29 CYS HBx 1.0 1.8 5.0 732 557 A 30 PRO HDx A 28 ALA HB% 1.0 1.8 5.0 733 558 A 28 ALA HB% A 30 PRO HDy 1.0 1.8 5.0 734 559 A 40 TRP HZ2 A 28 ALA HB% 1.0 1.8 5.0 735 560 A 40 TRP HH2 A 28 ALA HB% 1.0 1.8 5.0 736 561 A 29 CYS H A 29 CYS HA 1.0 1.8 5.0 737 562 A 29 CYS H A 29 CYS HBy 1.0 1.8 3.5 738 563 A 29 CYS H A 29 CYS HBx 1.0 1.8 3.5 739 564 A 30 PRO HDx A 29 CYS H 1.0 1.8 5.0 740 565 A 29 CYS H A 30 PRO HDy 1.0 1.8 5.0 741 566 A 40 TRP HZ2 A 29 CYS H 1.0 1.8 5.0 742 567 A 40 TRP HH2 A 29 CYS H 1.0 1.8 5.0 743 568 A 29 CYS HA A 30 PRO HGx 1.0 1.8 5.0 744 568 A 29 CYS HA A 30 PRO HGy 1.0 1.8 5.0 745 569 A 30 PRO HDx A 29 CYS HA 1.0 1.8 5.0 746 570 A 29 CYS HA A 30 PRO HDy 1.0 1.8 5.0 747 571 A 29 CYS HA A 31 TYR H 1.0 1.8 5.0 748 572 A 31 TYR HD% A 29 CYS HA 1.0 1.8 5.0 749 573 A 40 TRP HD1 A 29 CYS HA 1.0 1.8 5.0 750 574 A 40 TRP HE1 A 29 CYS HA 1.0 1.8 5.0 751 575 A 40 TRP HZ2 A 29 CYS HA 1.0 1.8 5.0 752 576 A 31 TYR H A 29 CYS HBy 1.0 1.8 5.0 753 576 A 29 CYS HBx A 31 TYR H 1.0 1.8 5.0 754 577 A 40 TRP HE3 A 29 CYS HBy 1.0 1.8 5.0 755 577 A 29 CYS HBx A 40 TRP HE3 1.0 1.8 5.0 756 578 A 40 TRP HZ2 A 29 CYS HBy 1.0 1.8 5.0 757 578 A 40 TRP HZ2 A 29 CYS HBx 1.0 1.8 5.0 758 579 A 40 TRP HZ3 A 29 CYS HBy 1.0 1.8 5.0 759 579 A 40 TRP HZ3 A 29 CYS HBx 1.0 1.8 5.0 760 580 A 40 TRP HH2 A 29 CYS HBy 1.0 1.8 5.0 761 580 A 40 TRP HH2 A 29 CYS HBx 1.0 1.8 5.0 762 581 A 31 TYR H A 30 PRO HA 1.0 1.8 5.0 763 582 A 31 TYR H A 30 PRO HBx 1.0 1.8 5.0 764 583 A 31 TYR H A 30 PRO HBy 1.0 1.8 5.0 765 584 A 31 TYR H A 30 PRO HGx 1.0 1.8 5.0 766 584 A 30 PRO HGy A 31 TYR H 1.0 1.8 5.0 767 585 A 31 TYR HD% A 30 PRO HGx 1.0 1.8 5.0 768 585 A 31 TYR HD% A 30 PRO HGy 1.0 1.8 5.0 769 586 A 31 TYR HE% A 30 PRO HGx 1.0 1.8 5.0 770 586 A 31 TYR HE% A 30 PRO HGy 1.0 1.8 5.0 771 587 A 30 PRO HDx A 31 TYR H 1.0 1.8 5.0 772 588 A 31 TYR H A 30 PRO HDy 1.0 1.8 5.0 773 589 A 31 TYR HD% A 30 PRO HDx 1.0 1.8 5.0 774 590 A 31 TYR HD% A 30 PRO HDy 1.0 1.8 5.0 775 591 A 31 TYR HE% A 30 PRO HDy 1.0 1.8 5.0 776 591 A 31 TYR HE% A 30 PRO HDx 1.0 1.8 5.0 777 592 A 40 TRP HE1 A 30 PRO HDx 1.0 1.8 5.0 778 593 A 40 TRP HE1 A 30 PRO HDy 1.0 1.8 5.0 779 594 A 30 PRO HDx A 40 TRP HZ2 1.0 1.8 5.0 780 595 A 40 TRP HZ2 A 30 PRO HDy 1.0 1.8 5.0 781 596 A 31 TYR H A 31 TYR HA 1.0 1.8 5.0 782 597 A 31 TYR H A 31 TYR HBx 1.0 1.8 5.0 783 598 A 31 TYR H A 31 TYR HBy 1.0 1.8 5.0 784 599 A 31 TYR HD% A 31 TYR H 1.0 1.8 5.0 785 600 A 31 TYR H A 32 GLN H 1.0 1.8 5.0 786 601 A 31 TYR HE% A 31 TYR HA 1.0 1.8 5.0 787 602 A 31 TYR HA A 32 GLN H 1.0 1.8 5.0 788 603 A 36 ALA HB% A 31 TYR HA 1.0 1.8 5.0 789 604 A 31 TYR HE% A 31 TYR HBx 1.0 1.8 5.0 790 605 A 31 TYR HE% A 31 TYR HBy 1.0 1.8 5.0 791 606 A 32 GLN H A 31 TYR HBy 1.0 1.8 5.0 792 606 A 32 GLN H A 31 TYR HBx 1.0 1.8 5.0 793 607 A 32 GLN HA A 31 TYR HBy 1.0 1.8 5.0 794 607 A 31 TYR HBx A 32 GLN HA 1.0 1.8 5.0 795 608 A 36 ALA HB% A 31 TYR HBx 1.0 1.8 5.0 796 609 A 36 ALA HB% A 31 TYR HBy 1.0 1.8 5.0 797 610 A 36 ALA HB% A 31 TYR HD% 1.0 1.8 5.0 798 611 A 31 TYR HD% A 40 TRP HBx 1.0 1.8 5.0 799 612 A 31 TYR HD% A 40 TRP HBy 1.0 1.8 5.0 800 613 A 40 TRP HD1 A 31 TYR HD% 1.0 1.8 5.0 801 614 A 31 TYR HD% A 40 TRP HE1 1.0 1.8 5.0 802 615 A 31 TYR HE% A 40 TRP HD1 1.0 1.8 5.0 803 616 A 31 TYR HE% A 40 TRP HE1 1.0 1.8 5.0 804 617 A 32 GLN H A 32 GLN HA 1.0 1.8 5.0 805 618 A 32 GLN H A 32 GLN HBx 1.0 1.8 5.0 806 619 A 32 GLN H A 32 GLN HBy 1.0 1.8 5.0 807 620 A 32 GLN H A 32 GLN HGx 1.0 1.8 5.0 808 620 A 32 GLN H A 32 GLN HGy 1.0 1.8 5.0 809 621 A 32 GLN H A 33 GLN H 1.0 1.8 5.0 810 622 A 36 ALA HB% A 32 GLN H 1.0 1.8 5.0 811 623 A 32 GLN HA A 33 GLN H 1.0 1.8 5.0 812 624 A 32 GLN HBx A 32 GLN HE2y 1.0 1.8 5.0 813 624 A 32 GLN HBy A 32 GLN HE2y 1.0 1.8 5.0 814 624 A 32 GLN HE2x A 32 GLN HBx 1.0 1.8 5.0 815 624 A 32 GLN HBy A 32 GLN HE2x 1.0 1.8 5.0 816 625 A 33 GLN H A 32 GLN HBx 1.0 1.8 5.0 817 625 A 33 GLN H A 32 GLN HBy 1.0 1.8 5.0 818 626 A 35 ASP H A 32 GLN HBx 1.0 1.8 5.0 819 626 A 35 ASP H A 32 GLN HBy 1.0 1.8 5.0 820 627 A 32 GLN HBy A 35 ASP HBy 1.0 1.8 5.0 821 627 A 35 ASP HBx A 32 GLN HBx 1.0 1.8 5.0 822 627 A 35 ASP HBx A 32 GLN HBy 1.0 1.8 5.0 823 627 A 32 GLN HBx A 35 ASP HBy 1.0 1.8 5.0 824 628 A 36 ALA HA A 32 GLN HBx 1.0 1.8 5.0 825 628 A 36 ALA HA A 32 GLN HBy 1.0 1.8 5.0 826 629 A 36 ALA HB% A 32 GLN HBx 1.0 1.8 5.0 827 629 A 36 ALA HB% A 32 GLN HBy 1.0 1.8 5.0 828 630 A 33 GLN H A 32 GLN HGx 1.0 1.8 5.0 829 630 A 32 GLN HGy A 33 GLN H 1.0 1.8 5.0 830 631 A 32 GLN HGx A 33 GLN HGx 1.0 1.8 5.0 831 631 A 32 GLN HGy A 33 GLN HGx 1.0 1.8 5.0 832 631 A 33 GLN HGy A 32 GLN HGx 1.0 1.8 5.0 833 631 A 32 GLN HGy A 33 GLN HGy 1.0 1.8 5.0 834 632 A 34 VAL HG1% A 32 GLN HGx 1.0 1.8 5.0 835 632 A 32 GLN HGy A 34 VAL HG1% 1.0 1.8 5.0 836 633 A 32 GLN HGy A 35 ASP HBy 1.0 1.8 5.0 837 633 A 32 GLN HGx A 35 ASP HBy 1.0 1.8 5.0 838 633 A 35 ASP HBx A 32 GLN HGx 1.0 1.8 5.0 839 633 A 35 ASP HBx A 32 GLN HGy 1.0 1.8 5.0 840 634 A 33 GLN H A 33 GLN HA 1.0 1.8 3.5 841 635 A 33 GLN H A 33 GLN HBx 1.0 1.8 3.5 842 636 A 33 GLN H A 33 GLN HBy 1.0 1.8 3.5 843 637 A 33 GLN H A 33 GLN HGx 1.0 1.8 5.0 844 637 A 33 GLN H A 33 GLN HGy 1.0 1.8 5.0 845 638 A 33 GLN H A 34 VAL H 1.0 1.8 5.0 846 639 A 36 ALA H A 33 GLN H 1.0 1.8 5.0 847 640 A 36 ALA HB% A 33 GLN H 1.0 1.8 5.0 848 641 A 33 GLN HA A 34 VAL H 1.0 1.8 5.0 849 642 A 33 GLN HA A 34 VAL HA 1.0 1.8 5.0 850 643 A 33 GLN HA A 34 VAL HG2% 1.0 1.8 5.0 851 644 A 36 ALA HB% A 33 GLN HA 1.0 1.8 5.0 852 645 A 33 GLN HA A 37 ARG H 1.0 1.8 5.0 853 646 A 34 VAL H A 33 GLN HBx 1.0 1.8 5.0 854 647 A 34 VAL H A 33 GLN HBy 1.0 1.8 5.0 855 648 A 34 VAL HG1% A 33 GLN HBx 1.0 1.8 5.0 856 648 A 34 VAL HG1% A 33 GLN HBy 1.0 1.8 5.0 857 649 A 34 VAL HG2% A 33 GLN HBx 1.0 1.8 5.0 858 649 A 34 VAL HG2% A 33 GLN HBy 1.0 1.8 5.0 859 650 A 35 ASP H A 33 GLN HBx 1.0 1.8 5.0 860 650 A 35 ASP H A 33 GLN HBy 1.0 1.8 5.0 861 651 A 36 ALA HB% A 33 GLN HBx 1.0 1.8 5.0 862 652 A 36 ALA HB% A 33 GLN HBy 1.0 1.8 5.0 863 653 A 34 VAL H A 33 GLN HGx 1.0 1.8 5.0 864 653 A 33 GLN HGy A 34 VAL H 1.0 1.8 5.0 865 654 A 34 VAL HG2% A 33 GLN HGx 1.0 1.8 5.0 866 654 A 33 GLN HGy A 34 VAL HG2% 1.0 1.8 5.0 867 655 A 36 ALA HB% A 33 GLN HGx 1.0 1.8 5.0 868 655 A 36 ALA HB% A 33 GLN HGy 1.0 1.8 5.0 869 656 A 34 VAL H A 34 VAL HA 1.0 1.8 3.5 870 657 A 34 VAL H A 34 VAL HB 1.0 1.8 3.5 871 658 A 34 VAL HG1% A 34 VAL H 1.0 1.8 5.0 872 659 A 34 VAL H A 34 VAL HG2% 1.0 1.8 5.0 873 660 A 35 ASP H A 34 VAL H 1.0 1.8 5.0 874 661 A 35 ASP H A 34 VAL HA 1.0 1.8 5.0 875 662 A 34 VAL HA A 37 ARG H 1.0 1.8 5.0 876 663 A 34 VAL HA A 37 ARG HBx 1.0 1.8 5.0 877 664 A 34 VAL HA A 37 ARG HBy 1.0 1.8 5.0 878 665 A 34 VAL HA A 37 ARG HDx 1.0 1.8 5.0 879 666 A 34 VAL HA A 37 ARG HDy 1.0 1.8 5.0 880 667 A 34 VAL HA A 38 SER H 1.0 1.8 5.0 881 668 A 35 ASP H A 34 VAL HB 1.0 1.8 5.0 882 669 A 35 ASP H A 34 VAL HG1% 1.0 1.8 5.0 883 670 A 35 ASP H A 34 VAL HG2% 1.0 1.8 5.0 884 671 A 35 ASP HA A 34 VAL HG1% 1.0 1.8 5.0 885 672 A 34 VAL HG1% A 37 ARG H 1.0 1.8 5.0 886 673 A 34 VAL HG1% A 37 ARG HBy 1.0 1.8 5.0 887 673 A 34 VAL HG1% A 37 ARG HBx 1.0 1.8 5.0 888 674 A 34 VAL HG1% A 38 SER H 1.0 1.8 5.0 889 675 A 35 ASP H A 35 ASP HA 1.0 1.8 3.5 890 676 A 35 ASP HBx A 35 ASP H 1.0 1.8 5.0 891 677 A 35 ASP H A 35 ASP HBy 1.0 1.8 5.0 892 678 A 35 ASP H A 36 ALA H 1.0 1.8 3.5 893 679 A 36 ALA HB% A 35 ASP H 1.0 1.8 5.0 894 680 A 35 ASP HA A 36 ALA H 1.0 1.8 5.0 895 681 A 35 ASP HA A 38 SER H 1.0 1.8 5.0 896 682 A 35 ASP HA A 39 TYR H 1.0 1.8 5.0 897 683 A 35 ASP HBx A 36 ALA H 1.0 1.8 5.0 898 684 A 36 ALA H A 35 ASP HBy 1.0 1.8 5.0 899 685 A 35 ASP HBx A 36 ALA HA 1.0 1.8 5.0 900 686 A 36 ALA HA A 35 ASP HBy 1.0 1.8 5.0 901 687 A 36 ALA H A 36 ALA HA 1.0 1.8 5.0 902 688 A 36 ALA HB% A 36 ALA H 1.0 1.8 5.0 903 689 A 36 ALA H A 37 ARG H 1.0 1.8 2.9 904 690 A 36 ALA H A 38 SER H 1.0 1.8 5.0 905 691 A 36 ALA HA A 37 ARG H 1.0 1.8 5.0 906 692 A 36 ALA HA A 39 TYR H 1.0 1.8 5.0 907 693 A 39 TYR HBx A 36 ALA HA 1.0 1.8 5.0 908 694 A 36 ALA HA A 39 TYR HBy 1.0 1.8 5.0 909 695 A 36 ALA HA A 40 TRP H 1.0 1.8 5.0 910 696 A 36 ALA HB% A 37 ARG H 1.0 1.8 5.0 911 697 A 36 ALA HB% A 37 ARG HA 1.0 1.8 5.0 912 698 A 36 ALA HB% A 38 SER H 1.0 1.8 5.0 913 699 A 36 ALA HB% A 40 TRP H 1.0 1.8 5.0 914 700 A 36 ALA HB% A 40 TRP HBx 1.0 1.8 5.0 915 701 A 36 ALA HB% A 40 TRP HBy 1.0 1.8 5.0 916 702 A 37 ARG HA A 37 ARG H 1.0 1.8 5.0 917 703 A 37 ARG HBx A 37 ARG H 1.0 1.8 5.0 918 704 A 37 ARG H A 37 ARG HBy 1.0 1.8 5.0 919 705 A 37 ARG HGx A 37 ARG H 1.0 1.8 5.0 920 706 A 37 ARG H A 37 ARG HGy 1.0 1.8 5.0 921 707 A 37 ARG HDx A 37 ARG H 1.0 1.8 5.0 922 708 A 37 ARG H A 37 ARG HDy 1.0 1.8 5.0 923 709 A 37 ARG H A 38 SER H 1.0 1.8 5.0 924 710 A 37 ARG H A 40 TRP H 1.0 1.8 5.0 925 711 A 37 ARG HA A 37 ARG HDx 1.0 1.8 5.0 926 712 A 37 ARG HA A 37 ARG HDy 1.0 1.8 5.0 927 713 A 37 ARG HA A 38 SER H 1.0 1.8 5.0 928 714 A 37 ARG HA A 38 SER HA 1.0 1.8 5.0 929 715 A 37 ARG HA A 40 TRP H 1.0 1.8 5.0 930 716 A 37 ARG HA A 40 TRP HBy 1.0 1.8 5.0 931 716 A 37 ARG HA A 40 TRP HBx 1.0 1.8 5.0 932 717 A 37 ARG HA A 41 LEU H 1.0 1.8 5.0 933 718 A 37 ARG HA A 41 LEU HBx 1.0 1.8 5.0 934 719 A 37 ARG HA A 41 LEU HBy 1.0 1.8 5.0 935 720 A 41 LEU HG A 37 ARG HA 1.0 1.8 5.0 936 721 A 41 LEU HD1% A 37 ARG HA 1.0 1.8 5.0 937 722 A 37 ARG HDx A 37 ARG HBy 1.0 1.8 5.0 938 722 A 37 ARG HBy A 37 ARG HDy 1.0 1.8 5.0 939 723 A 37 ARG HBx A 37 ARG HE 1.0 1.8 5.0 940 724 A 37 ARG HE A 37 ARG HBy 1.0 1.8 5.0 941 725 A 37 ARG HBx A 38 SER H 1.0 1.8 5.0 942 726 A 38 SER H A 37 ARG HBy 1.0 1.8 5.0 943 727 A 41 LEU HD1% A 37 ARG HBy 1.0 1.8 5.0 944 727 A 41 LEU HD1% A 37 ARG HBx 1.0 1.8 5.0 945 728 A 37 ARG HE A 37 ARG HGx 1.0 1.8 5.0 946 729 A 37 ARG HE A 37 ARG HGy 1.0 1.8 5.0 947 730 A 37 ARG HGx A 38 SER H 1.0 1.8 5.0 948 730 A 38 SER H A 37 ARG HGy 1.0 1.8 5.0 949 731 A 37 ARG HGx A 41 LEU H 1.0 1.8 5.0 950 731 A 41 LEU H A 37 ARG HGy 1.0 1.8 5.0 951 732 A 37 ARG HGy A 41 LEU HBx 1.0 1.8 5.0 952 732 A 37 ARG HGx A 41 LEU HBx 1.0 1.8 5.0 953 732 A 41 LEU HBy A 37 ARG HGy 1.0 1.8 5.0 954 732 A 37 ARG HGx A 41 LEU HBy 1.0 1.8 5.0 955 733 A 41 LEU HD1% A 37 ARG HGx 1.0 1.8 5.0 956 734 A 41 LEU HD1% A 37 ARG HGy 1.0 1.8 5.0 957 735 A 37 ARG HDy A 41 LEU HBx 1.0 1.8 5.0 958 735 A 37 ARG HDx A 41 LEU HBx 1.0 1.8 5.0 959 735 A 41 LEU HBy A 37 ARG HDy 1.0 1.8 5.0 960 735 A 37 ARG HDx A 41 LEU HBy 1.0 1.8 5.0 961 736 A 41 LEU HD1% A 37 ARG HDx 1.0 1.8 5.0 962 737 A 41 LEU HD1% A 37 ARG HDy 1.0 1.8 5.0 963 738 A 41 LEU HD1% A 37 ARG HE 1.0 1.8 5.0 964 739 A 38 SER HA A 38 SER H 1.0 1.8 5.0 965 740 A 38 SER H A 39 TYR H 1.0 1.8 5.0 966 741 A 38 SER H A 40 TRP H 1.0 1.8 5.0 967 742 A 41 LEU HBy A 38 SER H 1.0 1.8 5.0 968 742 A 38 SER H A 41 LEU HBx 1.0 1.8 5.0 969 743 A 38 SER HA A 39 TYR H 1.0 1.8 5.0 970 744 A 39 TYR HA A 39 TYR H 1.0 1.8 3.5 971 745 A 39 TYR HBx A 39 TYR H 1.0 1.8 5.0 972 746 A 39 TYR H A 39 TYR HBy 1.0 1.8 5.0 973 747 A 39 TYR HD% A 39 TYR H 1.0 1.8 5.0 974 748 A 39 TYR H A 40 TRP H 1.0 1.8 3.5 975 749 A 39 TYR HE% A 39 TYR HA 1.0 1.8 5.0 976 750 A 39 TYR HA A 40 TRP H 1.0 1.8 5.0 977 751 A 39 TYR HA A 42 GLY H 1.0 1.8 5.0 978 752 A 39 TYR HBx A 39 TYR HE% 1.0 1.8 5.0 979 753 A 39 TYR HE% A 39 TYR HBy 1.0 1.8 5.0 980 754 A 39 TYR HBx A 40 TRP H 1.0 1.8 5.0 981 755 A 40 TRP H A 39 TYR HBy 1.0 1.8 5.0 982 756 A 39 TYR HD% A 40 TRP H 1.0 1.8 5.0 983 757 A 40 TRP HA A 40 TRP H 1.0 1.8 5.0 984 758 A 40 TRP HBx A 40 TRP H 1.0 1.8 5.0 985 759 A 40 TRP H A 40 TRP HBy 1.0 1.8 5.0 986 760 A 40 TRP HD1 A 40 TRP H 1.0 1.8 5.0 987 761 A 40 TRP H A 41 LEU H 1.0 1.8 3.5 988 762 A 41 LEU HBy A 40 TRP H 1.0 1.8 5.0 989 762 A 40 TRP H A 41 LEU HBx 1.0 1.8 5.0 990 763 A 42 GLY H A 40 TRP H 1.0 1.8 5.0 991 764 A 40 TRP HD1 A 40 TRP HA 1.0 1.8 5.0 992 765 A 40 TRP HA A 41 LEU H 1.0 1.8 5.0 993 766 A 40 TRP HA A 42 GLY H 1.0 1.8 5.0 994 767 A 40 TRP HA A 43 GLY H 1.0 1.8 5.0 995 768 A 40 TRP HA A 44 TRP H 1.0 1.8 5.0 996 769 A 40 TRP HD1 A 40 TRP HBx 1.0 1.8 5.0 997 770 A 40 TRP HD1 A 40 TRP HBy 1.0 1.8 5.0 998 771 A 40 TRP HE3 A 40 TRP HBx 1.0 1.8 5.0 999 772 A 40 TRP HE3 A 40 TRP HBy 1.0 1.8 5.0 1000 773 A 40 TRP HBx A 41 LEU H 1.0 1.8 5.0 1001 774 A 41 LEU H A 40 TRP HBy 1.0 1.8 5.0 1002 775 A 40 TRP HE3 A 41 LEU H 1.0 1.8 5.0 1003 776 A 40 TRP HE3 A 41 LEU HA 1.0 1.8 5.0 1004 777 A 40 TRP HE3 A 41 LEU HBx 1.0 1.8 5.0 1005 778 A 40 TRP HE3 A 41 LEU HBy 1.0 1.8 5.0 1006 779 A 41 LEU HG A 40 TRP HE3 1.0 1.8 5.0 1007 780 A 41 LEU HD2% A 40 TRP HE3 1.0 1.8 5.0 1008 781 A 40 TRP HZ3 A 41 LEU HA 1.0 1.8 5.0 1009 782 A 40 TRP HZ3 A 41 LEU HG 1.0 1.8 5.0 1010 783 A 40 TRP HZ3 A 41 LEU HD1% 1.0 1.8 5.0 1011 784 A 40 TRP HZ3 A 41 LEU HD2% 1.0 1.8 5.0 1012 785 A 40 TRP HZ3 A 44 TRP HBy 1.0 1.8 5.0 1013 785 A 40 TRP HZ3 A 44 TRP HBx 1.0 1.8 5.0 1014 786 A 40 TRP HH2 A 44 TRP HD1 1.0 1.8 5.0 1015 787 A 41 LEU HA A 41 LEU H 1.0 1.8 5.0 1016 788 A 41 LEU H A 41 LEU HBx 1.0 1.8 5.0 1017 789 A 41 LEU HBy A 41 LEU H 1.0 1.8 5.0 1018 790 A 41 LEU HG A 41 LEU H 1.0 1.8 5.0 1019 791 A 41 LEU HD1% A 41 LEU H 1.0 1.8 5.0 1020 792 A 41 LEU HD2% A 41 LEU H 1.0 1.8 5.0 1021 793 A 42 GLY H A 41 LEU H 1.0 1.8 3.5 1022 794 A 41 LEU HD1% A 41 LEU HA 1.0 1.8 5.0 1023 795 A 41 LEU HD2% A 41 LEU HA 1.0 1.8 5.0 1024 796 A 42 GLY H A 41 LEU HA 1.0 1.8 5.0 1025 797 A 41 LEU HA A 44 TRP H 1.0 1.8 5.0 1026 798 A 41 LEU HA A 44 TRP HBx 1.0 1.8 5.0 1027 799 A 41 LEU HA A 44 TRP HBy 1.0 1.8 5.0 1028 800 A 41 LEU HA A 44 TRP HE3 1.0 1.8 5.0 1029 801 A 41 LEU HA A 45 ARG H 1.0 1.8 5.0 1030 802 A 42 GLY H A 41 LEU HBx 1.0 1.8 5.0 1031 803 A 41 LEU HBy A 42 GLY H 1.0 1.8 5.0 1032 804 A 41 LEU HD2% A 42 GLY H 1.0 1.8 5.0 1033 805 A 41 LEU HD2% A 42 GLY HAy 1.0 1.8 5.0 1034 805 A 41 LEU HD2% A 42 GLY HAx 1.0 1.8 5.0 1035 806 A 41 LEU HD2% A 44 TRP H 1.0 1.8 5.0 1036 807 A 41 LEU HD2% A 44 TRP HBx 1.0 1.8 5.0 1037 808 A 41 LEU HD2% A 44 TRP HBy 1.0 1.8 5.0 1038 809 A 41 LEU HD2% A 44 TRP HE3 1.0 1.8 5.0 1039 810 A 41 LEU HD2% A 44 TRP HZ3 1.0 1.8 5.0 1040 811 A 41 LEU HD2% A 45 ARG H 1.0 1.8 5.0 1041 812 A 41 LEU HD2% A 45 ARG HGy 1.0 1.8 5.0 1042 813 A 41 LEU HD2% A 45 ARG HGx 1.0 1.8 5.0 1043 814 A 42 GLY H A 42 GLY HAx 1.0 1.8 3.5 1044 815 A 42 GLY H A 42 GLY HAy 1.0 1.8 3.5 1045 816 A 43 GLY H A 42 GLY HAx 1.0 1.8 5.0 1046 817 A 43 GLY H A 42 GLY HAy 1.0 1.8 5.0 1047 818 A 43 GLY HAx A 42 GLY HAx 1.0 1.8 5.0 1048 818 A 42 GLY HAx A 43 GLY HAy 1.0 1.8 5.0 1049 819 A 43 GLY HAx A 42 GLY HAy 1.0 1.8 5.0 1050 819 A 42 GLY HAy A 43 GLY HAy 1.0 1.8 5.0 1051 820 A 42 GLY HAx A 45 ARG H 1.0 1.8 5.0 1052 821 A 45 ARG H A 42 GLY HAy 1.0 1.8 5.0 1053 822 A 42 GLY HAx A 45 ARG HBx 1.0 1.8 5.0 1054 822 A 42 GLY HAx A 45 ARG HBy 1.0 1.8 5.0 1055 823 A 45 ARG HBx A 42 GLY HAy 1.0 1.8 5.0 1056 823 A 42 GLY HAy A 45 ARG HBy 1.0 1.8 5.0 1057 824 A 46 ASP H A 42 GLY HAy 1.0 1.8 5.0 1058 824 A 42 GLY HAx A 46 ASP H 1.0 1.8 5.0 1059 825 A 43 GLY HAx A 43 GLY H 1.0 1.8 5.0 1060 826 A 43 GLY H A 43 GLY HAy 1.0 1.8 5.0 1061 827 A 43 GLY H A 44 TRP H 1.0 1.8 3.5 1062 828 A 43 GLY H A 44 TRP HBy 1.0 1.8 5.0 1063 828 A 43 GLY H A 44 TRP HBx 1.0 1.8 5.0 1064 829 A 43 GLY H A 45 ARG H 1.0 1.8 5.0 1065 830 A 43 GLY HAx A 44 TRP H 1.0 1.8 5.0 1066 831 A 44 TRP H A 43 GLY HAy 1.0 1.8 5.0 1067 832 A 43 GLY HAx A 46 ASP HBx 1.0 1.8 5.0 1068 833 A 43 GLY HAx A 46 ASP HBy 1.0 1.8 5.0 1069 834 A 46 ASP HBx A 43 GLY HAy 1.0 1.8 5.0 1070 835 A 43 GLY HAy A 46 ASP HBy 1.0 1.8 5.0 1071 836 A 44 TRP HA A 44 TRP H 1.0 1.8 3.5 1072 837 A 44 TRP HBx A 44 TRP H 1.0 1.8 5.0 1073 838 A 44 TRP H A 44 TRP HBy 1.0 1.8 5.0 1074 839 A 44 TRP H A 45 ARG H 1.0 1.8 3.5 1075 840 A 44 TRP H A 47 ALA H 1.0 1.8 5.0 1076 841 A 44 TRP HA A 44 TRP HD1 1.0 1.8 5.0 1077 842 A 44 TRP HA A 44 TRP HE3 1.0 1.8 5.0 1078 843 A 44 TRP HA A 45 ARG H 1.0 1.8 5.0 1079 844 A 44 TRP HA A 47 ALA H 1.0 1.8 5.0 1080 845 A 47 ALA HB% A 44 TRP HA 1.0 1.8 5.0 1081 846 A 44 TRP HA A 48 ARG H 1.0 1.8 5.0 1082 847 A 44 TRP HD1 A 44 TRP HBx 1.0 1.8 5.0 1083 848 A 44 TRP HD1 A 44 TRP HBy 1.0 1.8 5.0 1084 849 A 44 TRP HBx A 44 TRP HE3 1.0 1.8 5.0 1085 850 A 44 TRP HE3 A 44 TRP HBy 1.0 1.8 5.0 1086 851 A 44 TRP HBx A 45 ARG H 1.0 1.8 5.0 1087 852 A 45 ARG H A 44 TRP HBy 1.0 1.8 5.0 1088 853 A 44 TRP HE3 A 45 ARG H 1.0 1.8 5.0 1089 854 A 44 TRP HE3 A 45 ARG HA 1.0 1.8 5.0 1090 855 A 44 TRP HE3 A 45 ARG HGy 1.0 1.8 5.0 1091 856 A 44 TRP HE3 A 45 ARG HGx 1.0 1.8 5.0 1092 857 A 44 TRP HZ3 A 45 ARG HGy 1.0 1.8 5.0 1093 858 A 44 TRP HZ3 A 45 ARG HGx 1.0 1.8 5.0 1094 859 A 44 TRP HZ3 A 45 ARG HDy 1.0 1.8 5.0 1095 859 A 44 TRP HZ3 A 45 ARG HDx 1.0 1.8 5.0 1096 860 A 44 TRP HH2 A 48 ARG HGy 1.0 1.8 5.0 1097 860 A 44 TRP HH2 A 48 ARG HGx 1.0 1.8 5.0 1098 861 A 45 ARG HA A 45 ARG H 1.0 1.8 5.0 1099 862 A 45 ARG HBx A 45 ARG H 1.0 1.8 5.0 1100 863 A 45 ARG H A 45 ARG HBy 1.0 1.8 5.0 1101 864 A 45 ARG HGy A 45 ARG H 1.0 1.8 5.0 1102 865 A 45 ARG HGx A 45 ARG H 1.0 1.8 5.0 1103 866 A 45 ARG H A 46 ASP H 1.0 1.8 3.5 1104 867 A 45 ARG H A 47 ALA H 1.0 1.8 5.0 1105 868 A 45 ARG HA A 45 ARG HDx 1.0 1.8 5.0 1106 869 A 45 ARG HA A 45 ARG HDy 1.0 1.8 5.0 1107 870 A 45 ARG HA A 46 ASP H 1.0 1.8 5.0 1108 871 A 45 ARG HA A 48 ARG H 1.0 1.8 5.0 1109 872 A 45 ARG HA A 48 ARG HBx 1.0 1.8 5.0 1110 872 A 45 ARG HA A 48 ARG HBy 1.0 1.8 5.0 1111 873 A 45 ARG HA A 48 ARG HGy 1.0 1.8 5.0 1112 873 A 45 ARG HA A 48 ARG HGx 1.0 1.8 5.0 1113 874 A 45 ARG HA A 49 ASP H 1.0 1.8 5.0 1114 875 A 45 ARG HBx A 45 ARG HDx 1.0 1.8 5.0 1115 876 A 45 ARG HBx A 45 ARG HDy 1.0 1.8 5.0 1116 877 A 45 ARG HDx A 45 ARG HBy 1.0 1.8 5.0 1117 878 A 45 ARG HBy A 45 ARG HDy 1.0 1.8 5.0 1118 879 A 45 ARG HBx A 45 ARG HE 1.0 1.8 5.0 1119 880 A 45 ARG HE A 45 ARG HBy 1.0 1.8 5.0 1120 881 A 45 ARG HBx A 46 ASP H 1.0 1.8 5.0 1121 882 A 46 ASP H A 45 ARG HBy 1.0 1.8 5.0 1122 883 A 45 ARG HGy A 45 ARG HE 1.0 1.8 5.0 1123 884 A 45 ARG HGx A 45 ARG HE 1.0 1.8 5.0 1124 885 A 46 ASP HA A 46 ASP H 1.0 1.8 3.5 1125 886 A 46 ASP HBx A 46 ASP H 1.0 1.8 5.0 1126 887 A 46 ASP H A 46 ASP HBy 1.0 1.8 5.0 1127 888 A 46 ASP H A 47 ALA H 1.0 1.8 3.5 1128 889 A 47 ALA HB% A 46 ASP H 1.0 1.8 5.0 1129 890 A 46 ASP H A 48 ARG H 1.0 1.8 5.0 1130 891 A 46 ASP HA A 47 ALA H 1.0 1.8 5.0 1131 892 A 46 ASP HA A 48 ARG H 1.0 1.8 5.0 1132 893 A 46 ASP HA A 49 ASP H 1.0 1.8 5.0 1133 894 A 46 ASP HA A 49 ASP HBx 1.0 1.8 5.0 1134 894 A 46 ASP HA A 49 ASP HBy 1.0 1.8 5.0 1135 895 A 46 ASP HA A 50 GLU H 1.0 1.8 5.0 1136 896 A 46 ASP HBx A 47 ALA H 1.0 1.8 5.0 1137 897 A 47 ALA H A 46 ASP HBy 1.0 1.8 5.0 1138 898 A 47 ALA HB% A 46 ASP HBy 1.0 1.8 5.0 1139 898 A 47 ALA HB% A 46 ASP HBx 1.0 1.8 5.0 1140 899 A 47 ALA HA A 47 ALA H 1.0 1.8 5.0 1141 900 A 47 ALA HB% A 47 ALA H 1.0 1.8 5.0 1142 901 A 47 ALA H A 48 ARG H 1.0 1.8 3.5 1143 902 A 47 ALA H A 49 ASP H 1.0 1.8 5.0 1144 903 A 47 ALA HA A 48 ARG H 1.0 1.8 5.0 1145 904 A 47 ALA HA A 50 GLU H 1.0 1.8 5.0 1146 905 A 47 ALA HA A 50 GLU HBx 1.0 1.8 5.0 1147 905 A 47 ALA HA A 50 GLU HBy 1.0 1.8 5.0 1148 906 A 47 ALA HA A 50 GLU HGx 1.0 1.8 5.0 1149 906 A 47 ALA HA A 50 GLU HGy 1.0 1.8 5.0 1150 907 A 47 ALA HA A 51 LYS H 1.0 1.8 5.0 1151 908 A 47 ALA HB% A 48 ARG H 1.0 1.8 5.0 1152 909 A 48 ARG HA A 48 ARG H 1.0 1.8 3.5 1153 910 A 48 ARG HBy A 48 ARG H 1.0 1.8 5.0 1154 910 A 48 ARG H A 48 ARG HBx 1.0 1.8 5.0 1155 911 A 48 ARG HGx A 48 ARG H 1.0 1.8 5.0 1156 912 A 48 ARG H A 48 ARG HGy 1.0 1.8 5.0 1157 913 A 48 ARG HDx A 48 ARG H 1.0 1.8 5.0 1158 914 A 48 ARG HDy A 48 ARG H 1.0 1.8 5.0 1159 915 A 48 ARG H A 49 ASP H 1.0 1.8 3.5 1160 916 A 49 ASP HBy A 48 ARG H 1.0 1.8 5.0 1161 916 A 48 ARG H A 49 ASP HBx 1.0 1.8 5.0 1162 917 A 48 ARG H A 50 GLU H 1.0 1.8 5.0 1163 918 A 48 ARG HA A 48 ARG HDx 1.0 1.8 5.0 1164 919 A 48 ARG HA A 48 ARG HDy 1.0 1.8 5.0 1165 920 A 48 ARG HA A 49 ASP H 1.0 1.8 5.0 1166 921 A 48 ARG HA A 51 LYS H 1.0 1.8 5.0 1167 922 A 48 ARG HA A 51 LYS HBx 1.0 1.8 5.0 1168 922 A 48 ARG HA A 51 LYS HBy 1.0 1.8 5.0 1169 923 A 48 ARG HA A 51 LYS HDx 1.0 1.8 5.0 1170 923 A 48 ARG HA A 51 LYS HDy 1.0 1.8 5.0 1171 924 A 48 ARG HA A 52 GLN H 1.0 1.8 5.0 1172 925 A 48 ARG HDx A 48 ARG HBx 1.0 1.8 5.0 1173 925 A 48 ARG HBy A 48 ARG HDx 1.0 1.8 5.0 1174 926 A 48 ARG HDy A 48 ARG HBx 1.0 1.8 5.0 1175 926 A 48 ARG HBy A 48 ARG HDy 1.0 1.8 5.0 1176 927 A 48 ARG HE A 48 ARG HBx 1.0 1.8 5.0 1177 927 A 48 ARG HBy A 48 ARG HE 1.0 1.8 5.0 1178 928 A 48 ARG HBy A 49 ASP H 1.0 1.8 5.0 1179 928 A 49 ASP H A 48 ARG HBx 1.0 1.8 5.0 1180 929 A 48 ARG HGx A 48 ARG HE 1.0 1.8 5.0 1181 930 A 48 ARG HE A 48 ARG HGy 1.0 1.8 5.0 1182 931 A 49 ASP H A 48 ARG HGy 1.0 1.8 5.0 1183 931 A 48 ARG HGx A 49 ASP H 1.0 1.8 5.0 1184 932 A 49 ASP HA A 49 ASP H 1.0 1.8 3.5 1185 933 A 49 ASP HBy A 49 ASP H 1.0 1.8 5.0 1186 933 A 49 ASP H A 49 ASP HBx 1.0 1.8 5.0 1187 934 A 49 ASP H A 50 GLU H 1.0 1.8 5.0 1188 935 A 50 GLU HBy A 49 ASP H 1.0 1.8 5.0 1189 935 A 49 ASP H A 50 GLU HBx 1.0 1.8 5.0 1190 936 A 49 ASP H A 51 LYS H 1.0 1.8 5.0 1191 937 A 49 ASP HA A 50 GLU H 1.0 1.8 5.0 1192 938 A 49 ASP HA A 52 GLN H 1.0 1.8 5.0 1193 939 A 49 ASP HA A 52 GLN HBy 1.0 1.8 5.0 1194 939 A 49 ASP HA A 52 GLN HBx 1.0 1.8 5.0 1195 940 A 49 ASP HA A 53 SER H 1.0 1.8 5.0 1196 941 A 49 ASP HBy A 50 GLU H 1.0 1.8 5.0 1197 941 A 50 GLU H A 49 ASP HBx 1.0 1.8 5.0 1198 942 A 50 GLU HA A 50 GLU H 1.0 1.8 3.5 1199 943 A 50 GLU HBy A 50 GLU H 1.0 1.8 3.5 1200 943 A 50 GLU H A 50 GLU HBx 1.0 1.8 3.5 1201 944 A 50 GLU HGy A 50 GLU H 1.0 1.8 5.0 1202 945 A 50 GLU H A 50 GLU HGx 1.0 1.8 5.0 1203 946 A 50 GLU H A 51 LYS H 1.0 1.8 2.9 1204 947 A 50 GLU H A 52 GLN H 1.0 1.8 2.9 1205 948 A 52 GLN HBx A 50 GLU H 1.0 1.8 5.0 1206 948 A 50 GLU H A 52 GLN HBy 1.0 1.8 5.0 1207 949 A 50 GLU HA A 51 LYS H 1.0 1.8 5.0 1208 950 A 50 GLU HA A 53 SER H 1.0 1.8 5.0 1209 951 A 51 LYS H A 50 GLU HBx 1.0 1.8 3.5 1210 951 A 50 GLU HBy A 51 LYS H 1.0 1.8 3.5 1211 952 A 52 GLN H A 50 GLU HBx 1.0 1.8 5.0 1212 952 A 50 GLU HBy A 52 GLN H 1.0 1.8 5.0 1213 953 A 50 GLU HGy A 51 LYS H 1.0 1.8 5.0 1214 954 A 51 LYS H A 50 GLU HGx 1.0 1.8 5.0 1215 955 A 51 LYS HA A 51 LYS H 1.0 1.8 5.0 1216 956 A 51 LYS HBy A 51 LYS H 1.0 1.8 2.9 1217 956 A 51 LYS H A 51 LYS HBx 1.0 1.8 2.9 1218 957 A 51 LYS HGx A 51 LYS H 1.0 1.8 5.0 1219 958 A 51 LYS H A 51 LYS HGy 1.0 1.8 5.0 1220 959 A 51 LYS HDy A 51 LYS H 1.0 1.8 5.0 1221 959 A 51 LYS H A 51 LYS HDx 1.0 1.8 5.0 1222 960 A 51 LYS H A 52 GLN H 1.0 1.8 2.9 1223 961 A 52 GLN HBx A 51 LYS H 1.0 1.8 3.5 1224 961 A 51 LYS H A 52 GLN HBy 1.0 1.8 3.5 1225 962 A 51 LYS HA A 51 LYS HDx 1.0 1.8 5.0 1226 962 A 51 LYS HDy A 51 LYS HA 1.0 1.8 5.0 1227 963 A 51 LYS HA A 52 GLN H 1.0 1.8 3.5 1228 964 A 51 LYS HEx A 51 LYS HBx 1.0 1.8 5.0 1229 964 A 51 LYS HBy A 51 LYS HEx 1.0 1.8 5.0 1230 965 A 51 LYS HEy A 51 LYS HBx 1.0 1.8 5.0 1231 965 A 51 LYS HBy A 51 LYS HEy 1.0 1.8 5.0 1232 966 A 52 GLN H A 51 LYS HBx 1.0 1.8 3.5 1233 966 A 51 LYS HBy A 52 GLN H 1.0 1.8 3.5 1234 967 A 51 LYS HEy A 51 LYS HGy 1.0 1.8 5.0 1235 967 A 51 LYS HEy A 51 LYS HGx 1.0 1.8 5.0 1236 968 A 51 LYS HGx A 52 GLN H 1.0 1.8 5.0 1237 969 A 52 GLN H A 51 LYS HGy 1.0 1.8 5.0 1238 970 A 52 GLN HA A 52 GLN H 1.0 1.8 3.5 1239 971 A 52 GLN HBx A 52 GLN H 1.0 1.8 3.5 1240 971 A 52 GLN H A 52 GLN HBy 1.0 1.8 3.5 1241 972 A 52 GLN HGy A 52 GLN H 1.0 1.8 5.0 1242 972 A 52 GLN H A 52 GLN HGx 1.0 1.8 5.0 1243 973 A 52 GLN H A 53 SER H 1.0 1.8 2.9 1244 974 A 54 GLY H A 52 GLN H 1.0 1.8 5.0 1245 975 A 52 GLN HA A 53 SER H 1.0 1.8 3.5 1246 976 A 52 GLN HA A 54 GLY H 1.0 1.8 5.0 1247 977 A 53 SER H A 52 GLN HBy 1.0 1.8 3.5 1248 977 A 52 GLN HBx A 53 SER H 1.0 1.8 3.5 1249 978 A 52 GLN HBx A 53 SER HBx 1.0 1.8 5.0 1250 978 A 52 GLN HBy A 53 SER HBx 1.0 1.8 5.0 1251 978 A 53 SER HBy A 52 GLN HBy 1.0 1.8 5.0 1252 978 A 52 GLN HBx A 53 SER HBy 1.0 1.8 5.0 1253 979 A 53 SER H A 52 GLN HGx 1.0 1.8 5.0 1254 979 A 52 GLN HGy A 53 SER H 1.0 1.8 5.0 1255 980 A 53 SER HA A 53 SER H 1.0 1.8 3.5 1256 981 A 53 SER HBy A 53 SER H 1.0 1.8 3.5 1257 981 A 53 SER H A 53 SER HBx 1.0 1.8 3.5 1258 982 A 54 GLY H A 53 SER H 1.0 1.8 5.0 1259 983 A 54 GLY H A 53 SER HA 1.0 1.8 3.5 1260 984 A 53 SER HA A 55 LEU H 1.0 1.8 5.0 1261 985 A 54 GLY H A 53 SER HBx 1.0 1.8 5.0 1262 985 A 54 GLY H A 53 SER HBy 1.0 1.8 5.0 1263 986 A 55 LEU H A 53 SER HBx 1.0 1.8 5.0 1264 986 A 53 SER HBy A 55 LEU H 1.0 1.8 5.0 1265 987 A 54 GLY H A 54 GLY HAy 1.0 1.8 5.0 1266 987 A 54 GLY H A 54 GLY HAx 1.0 1.8 5.0 1267 988 A 54 GLY H A 55 LEU H 1.0 1.8 3.5 1268 989 A 54 GLY H A 56 TYR H 1.0 1.8 5.0 1269 990 A 55 LEU H A 54 GLY HAy 1.0 1.8 5.0 1270 990 A 55 LEU H A 54 GLY HAx 1.0 1.8 5.0 1271 991 A 55 LEU HD1% A 54 GLY HAy 1.0 1.8 5.0 1272 991 A 54 GLY HAx A 55 LEU HD1% 1.0 1.8 5.0 1273 992 A 56 TYR H A 54 GLY HAy 1.0 1.8 5.0 1274 992 A 54 GLY HAx A 56 TYR H 1.0 1.8 5.0 1275 993 A 55 LEU H A 55 LEU HA 1.0 1.8 3.5 1276 994 A 55 LEU H A 55 LEU HBx 1.0 1.8 5.0 1277 995 A 55 LEU H A 55 LEU HBy 1.0 1.8 5.0 1278 996 A 55 LEU H A 55 LEU HG 1.0 1.8 5.0 1279 997 A 55 LEU H A 55 LEU HD1% 1.0 1.8 5.0 1280 998 A 55 LEU H A 55 LEU HD2% 1.0 1.8 5.0 1281 999 A 55 LEU H A 56 TYR H 1.0 1.8 3.5 1282 1000 A 55 LEU HD1% A 55 LEU HA 1.0 1.8 5.0 1283 1001 A 55 LEU HA A 55 LEU HD2% 1.0 1.8 5.0 1284 1002 A 56 TYR H A 55 LEU HA 1.0 1.8 3.5 1285 1003 A 56 TYR H A 55 LEU HBx 1.0 1.8 5.0 1286 1004 A 56 TYR H A 55 LEU HBy 1.0 1.8 5.0 1287 1005 A 57 LYS H A 55 LEU HBx 1.0 1.8 3.5 1288 1005 A 55 LEU HBy A 57 LYS H 1.0 1.8 3.5 1289 1006 A 56 TYR H A 55 LEU HD2% 1.0 1.8 5.0 1290 1007 A 56 TYR H A 56 TYR HA 1.0 1.8 3.5 1291 1008 A 56 TYR H A 56 TYR HBx 1.0 1.8 3.5 1292 1009 A 56 TYR H A 56 TYR HBy 1.0 1.8 3.5 1293 1010 A 56 TYR H A 56 TYR HD% 1.0 1.8 5.0 1294 1011 A 57 LYS H A 56 TYR HA 1.0 1.8 3.5 1295 1012 A 56 TYR HBx A 56 TYR HE% 1.0 1.8 5.0 1296 1013 A 56 TYR HBy A 56 TYR HE% 1.0 1.8 5.0 1297 1014 A 57 LYS H A 56 TYR HBx 1.0 1.8 5.0 1298 1015 A 57 LYS H A 56 TYR HBy 1.0 1.8 5.0 1299 1016 A 57 LYS H A 56 TYR HD% 1.0 1.8 5.0 1300 1017 A 56 TYR HD% A 57 LYS HA 1.0 1.8 5.0 1301 1018 A 57 LYS H A 57 LYS HA 1.0 1.8 5.0 1302 1019 A 57 LYS H A 57 LYS HBx 1.0 1.8 5.0 1303 1020 A 57 LYS H A 57 LYS HBy 1.0 1.8 5.0 1304 1021 A 57 LYS H A 57 LYS HGy 1.0 1.8 5.0 1305 1021 A 57 LYS H A 57 LYS HGx 1.0 1.8 5.0 1306 1022 A 57 LYS H A 58 LEU H 1.0 1.8 2.9 1307 1023 A 57 LYS HA A 57 LYS HDx 1.0 1.8 5.0 1308 1023 A 57 LYS HA A 57 LYS HDy 1.0 1.8 5.0 1309 1024 A 57 LYS HA A 57 LYS HEx 1.0 1.8 5.0 1310 1024 A 57 LYS HA A 57 LYS HEy 1.0 1.8 5.0 1311 1025 A 57 LYS HA A 58 LEU H 1.0 1.8 5.0 1312 1026 A 57 LYS HBx A 57 LYS HEx 1.0 1.8 5.0 1313 1026 A 57 LYS HBx A 57 LYS HEy 1.0 1.8 5.0 1314 1027 A 57 LYS HBy A 57 LYS HEx 1.0 1.8 5.0 1315 1027 A 57 LYS HBy A 57 LYS HEy 1.0 1.8 5.0 1316 1028 A 57 LYS HBx A 58 LEU H 1.0 1.8 5.0 1317 1029 A 57 LYS HBy A 58 LEU H 1.0 1.8 5.0 1318 1030 A 58 LEU H A 57 LYS HGy 1.0 1.8 5.0 1319 1030 A 57 LYS HGx A 58 LEU H 1.0 1.8 5.0 1320 1031 A 58 LEU H A 58 LEU HA 1.0 1.8 5.0 1321 1032 A 58 LEU H A 58 LEU HBx 1.0 1.8 3.5 1322 1033 A 58 LEU H A 58 LEU HBy 1.0 1.8 3.5 1323 1034 A 58 LEU H A 58 LEU HG 1.0 1.8 5.0 1324 1035 A 58 LEU H A 58 LEU HD1% 1.0 1.8 5.0 1325 1036 A 58 LEU H A 58 LEU HD2% 1.0 1.8 5.0 1326 1037 A 58 LEU H A 59 GLU H 1.0 1.8 5.0 1327 1038 A 58 LEU HA A 58 LEU HD1% 1.0 1.8 5.0 1328 1039 A 58 LEU HA A 58 LEU HD2% 1.0 1.8 5.0 1329 1040 A 58 LEU HA A 59 GLU H 1.0 1.8 3.5 1330 1041 A 58 LEU HBx A 59 GLU H 1.0 1.8 3.5 1331 1042 A 58 LEU HBy A 59 GLU H 1.0 1.8 3.5 1332 1043 A 58 LEU HG A 59 GLU H 1.0 1.8 5.0 1333 1044 A 58 LEU HD2% A 59 GLU H 1.0 1.8 5.0 1334 1045 A 59 GLU H A 59 GLU HA 1.0 1.8 3.5 1335 1046 A 59 GLU H A 59 GLU HBx 1.0 1.8 3.5 1336 1046 A 59 GLU H A 59 GLU HBy 1.0 1.8 3.5 1337 1047 A 59 GLU H A 59 GLU HGx 1.0 1.8 5.0 1338 1047 A 59 GLU H A 59 GLU HGy 1.0 1.8 5.0 1339 1048 A 59 GLU HA A 60 HIS H 1.0 1.8 5.0 1340 1049 A 60 HIS H A 59 GLU HBx 1.0 1.8 5.0 1341 1049 A 59 GLU HBy A 60 HIS H 1.0 1.8 5.0 1342 1050 A 40 TRP HD1 A 15 GLN HBx 1.0 1.8 5.0 1343 1051 A 15 GLN HBy A 40 TRP HD1 1.0 1.8 5.0 1344 1052 A 40 TRP HE1 A 15 GLN HBx 1.0 1.8 5.0 1345 1053 A 15 GLN HBy A 40 TRP HE1 1.0 1.8 5.0 1346 1054 A 17 TYR H A 13 GLN HGx 1.0 1.8 5.0 1347 1054 A 13 GLN HGy A 17 TYR H 1.0 1.8 5.0 1348 1055 A 39 TYR HA A 38 SER H 1.0 1.8 5.0 1349 1056 A 35 ASP H A 33 GLN HA 1.0 1.8 5.0 1350 1057 A 21 LEU HD2% A 19 ALA H 1.0 1.8 5.0 1351 1058 A 47 ALA HB% A 48 ARG HA 1.0 1.8 5.0 1352 1059 A 21 LEU HD2% A 47 ALA HA 1.0 1.8 5.0 1353 1060 A 40 TRP HD1 A 30 PRO HDx 1.0 1.8 5.0 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 1 MET HA A 2 LYS H 1.0 1.8 5.0 2 2 A 2 LYS H A 1 MET HBx 1.0 1.8 5.0 3 2 A 2 LYS H A 1 MET HBy 1.0 1.8 5.0 4 3 A 2 LYS H A 2 LYS HGy 1.0 1.8 5.0 5 3 A 2 LYS H A 2 LYS HGx 1.0 1.8 5.0 6 4 A 2 LYS HA A 2 LYS HDx 1.0 1.8 5.0 7 4 A 2 LYS HA A 2 LYS HDy 1.0 1.8 5.0 8 5 A 2 LYS HA A 3 ARG H 1.0 1.8 5.0 9 6 A 2 LYS HBx A 2 LYS HEx 1.0 1.8 5.0 10 6 A 2 LYS HEy A 2 LYS HBx 1.0 1.8 5.0 11 6 A 2 LYS HBy A 2 LYS HEy 1.0 1.8 5.0 12 6 A 2 LYS HBy A 2 LYS HEx 1.0 1.8 5.0 13 7 A 3 ARG H A 2 LYS HBx 1.0 1.8 5.0 14 8 A 3 ARG H A 2 LYS HBy 1.0 1.8 5.0 15 9 A 2 LYS HGx A 2 LYS HEx 1.0 1.8 5.0 16 9 A 2 LYS HGx A 2 LYS HEy 1.0 1.8 5.0 17 10 A 2 LYS HEx A 2 LYS HGy 1.0 1.8 5.0 18 10 A 2 LYS HEy A 2 LYS HGy 1.0 1.8 5.0 19 11 A 3 ARG H A 3 ARG HA 1.0 1.8 5.0 20 12 A 3 ARG H A 3 ARG HBx 1.0 1.8 5.0 21 12 A 3 ARG H A 3 ARG HBy 1.0 1.8 5.0 22 13 A 3 ARG H A 3 ARG HGx 1.0 1.8 5.0 23 13 A 3 ARG H A 3 ARG HGy 1.0 1.8 5.0 24 14 A 3 ARG H A 4 GLN H 1.0 1.8 3.5 25 15 A 3 ARG HA A 3 ARG HDx 1.0 1.8 5.0 26 15 A 3 ARG HA A 3 ARG HDy 1.0 1.8 5.0 27 16 A 3 ARG HA A 4 GLN H 1.0 1.8 5.0 28 17 A 4 GLN H A 3 ARG HBx 1.0 1.8 5.0 29 17 A 3 ARG HBy A 4 GLN H 1.0 1.8 5.0 30 18 A 4 GLN H A 3 ARG HGx 1.0 1.8 5.0 31 18 A 3 ARG HGy A 4 GLN H 1.0 1.8 5.0 32 19 A 4 GLN H A 4 GLN HA 1.0 1.8 5.0 33 20 A 4 GLN H A 4 GLN HBx 1.0 1.8 5.0 34 21 A 4 GLN H A 4 GLN HBy 1.0 1.8 5.0 35 22 A 4 GLN H A 4 GLN HGx 1.0 1.8 5.0 36 22 A 4 GLN H A 4 GLN HGy 1.0 1.8 5.0 37 23 A 4 GLN H A 5 LYS H 1.0 1.8 5.0 38 24 A 4 GLN HA A 5 LYS H 1.0 1.8 3.5 39 25 A 4 GLN HA A 7 ASP HBx 1.0 1.8 5.0 40 26 A 4 GLN HA A 7 ASP HBy 1.0 1.8 5.0 41 27 A 5 LYS H A 4 GLN HBx 1.0 1.8 5.0 42 27 A 5 LYS H A 4 GLN HBy 1.0 1.8 5.0 43 28 A 4 GLN HBy A 5 LYS HGx 1.0 1.8 5.0 44 28 A 4 GLN HBx A 5 LYS HGx 1.0 1.8 5.0 45 28 A 5 LYS HGy A 4 GLN HBx 1.0 1.8 5.0 46 28 A 4 GLN HBy A 5 LYS HGy 1.0 1.8 5.0 47 29 A 7 ASP H A 4 GLN HBx 1.0 1.8 5.0 48 29 A 4 GLN HBy A 7 ASP H 1.0 1.8 5.0 49 30 A 4 GLN HBy A 7 ASP HBx 1.0 1.8 5.0 50 30 A 7 ASP HBx A 4 GLN HBx 1.0 1.8 5.0 51 31 A 4 GLN HBx A 7 ASP HBy 1.0 1.8 5.0 52 31 A 4 GLN HBy A 7 ASP HBy 1.0 1.8 5.0 53 32 A 5 LYS H A 5 LYS HA 1.0 1.8 5.0 54 33 A 5 LYS H A 5 LYS HBx 1.0 1.8 3.5 55 33 A 5 LYS H A 5 LYS HBy 1.0 1.8 3.5 56 34 A 5 LYS H A 6 ARG H 1.0 1.8 5.0 57 35 A 5 LYS H A 7 ASP HBy 1.0 1.8 5.0 58 35 A 5 LYS H A 7 ASP HBx 1.0 1.8 5.0 59 36 A 5 LYS HA A 5 LYS HDx 1.0 1.8 5.0 60 36 A 5 LYS HA A 5 LYS HDy 1.0 1.8 5.0 61 37 A 5 LYS HA A 6 ARG H 1.0 1.8 3.5 62 38 A 5 LYS HA A 8 ARG HGy 1.0 1.8 5.0 63 38 A 5 LYS HA A 8 ARG HGx 1.0 1.8 5.0 64 39 A 5 LYS HBx A 5 LYS HEx 1.0 1.8 5.0 65 39 A 5 LYS HEy A 5 LYS HBx 1.0 1.8 5.0 66 39 A 5 LYS HBy A 5 LYS HEy 1.0 1.8 5.0 67 39 A 5 LYS HBy A 5 LYS HEx 1.0 1.8 5.0 68 40 A 6 ARG H A 5 LYS HBx 1.0 1.8 5.0 69 40 A 5 LYS HBy A 6 ARG H 1.0 1.8 5.0 70 41 A 9 LEU HD1% A 5 LYS HBx 1.0 1.8 5.0 71 41 A 5 LYS HBy A 9 LEU HD1% 1.0 1.8 5.0 72 42 A 6 ARG H A 5 LYS HDx 1.0 1.8 5.0 73 42 A 6 ARG H A 5 LYS HDy 1.0 1.8 5.0 74 43 A 9 LEU HD1% A 5 LYS HEx 1.0 1.8 5.0 75 43 A 5 LYS HEy A 9 LEU HD1% 1.0 1.8 5.0 76 44 A 6 ARG H A 6 ARG HA 1.0 1.8 3.5 77 45 A 6 ARG H A 6 ARG HBx 1.0 1.8 5.0 78 45 A 6 ARG H A 6 ARG HBy 1.0 1.8 5.0 79 46 A 6 ARG H A 9 LEU HD1% 1.0 1.8 5.0 80 47 A 6 ARG HA A 6 ARG HDy 1.0 1.8 5.0 81 47 A 6 ARG HA A 6 ARG HDx 1.0 1.8 5.0 82 48 A 7 ASP H A 6 ARG HA 1.0 1.8 3.5 83 49 A 6 ARG HA A 9 LEU HBx 1.0 1.8 5.0 84 50 A 6 ARG HA A 9 LEU HBy 1.0 1.8 5.0 85 51 A 9 LEU HD1% A 6 ARG HA 1.0 1.8 5.0 86 52 A 7 ASP H A 6 ARG HBx 1.0 1.8 3.5 87 52 A 7 ASP H A 6 ARG HBy 1.0 1.8 3.5 88 53 A 7 ASP H A 6 ARG HGx 1.0 1.8 5.0 89 53 A 7 ASP H A 6 ARG HGy 1.0 1.8 5.0 90 54 A 6 ARG HGx A 9 LEU HBx 1.0 1.8 5.0 91 54 A 6 ARG HGy A 9 LEU HBx 1.0 1.8 5.0 92 55 A 9 LEU HBy A 6 ARG HGx 1.0 1.8 5.0 93 55 A 6 ARG HGy A 9 LEU HBy 1.0 1.8 5.0 94 56 A 9 LEU HD1% A 6 ARG HGx 1.0 1.8 5.0 95 56 A 9 LEU HD1% A 6 ARG HGy 1.0 1.8 5.0 96 57 A 6 ARG HGy A 10 GLU HGx 1.0 1.8 5.0 97 57 A 6 ARG HGx A 10 GLU HGx 1.0 1.8 5.0 98 57 A 10 GLU HGy A 6 ARG HGx 1.0 1.8 5.0 99 57 A 6 ARG HGy A 10 GLU HGy 1.0 1.8 5.0 100 58 A 6 ARG HDy A 10 GLU HBx 1.0 1.8 5.0 101 58 A 6 ARG HDx A 10 GLU HBx 1.0 1.8 5.0 102 58 A 10 GLU HBy A 6 ARG HDy 1.0 1.8 5.0 103 58 A 6 ARG HDx A 10 GLU HBy 1.0 1.8 5.0 104 59 A 7 ASP H A 7 ASP HA 1.0 1.8 5.0 105 60 A 7 ASP H A 7 ASP HBx 1.0 1.8 5.0 106 61 A 7 ASP H A 7 ASP HBy 1.0 1.8 5.0 107 62 A 7 ASP H A 8 ARG H 1.0 1.8 5.0 108 63 A 7 ASP HA A 8 ARG H 1.0 1.8 5.0 109 64 A 7 ASP HA A 10 GLU H 1.0 1.8 5.0 110 65 A 7 ASP HA A 10 GLU HBx 1.0 1.8 5.0 111 65 A 10 GLU HBy A 7 ASP HA 1.0 1.8 5.0 112 66 A 7 ASP HA A 11 ARG H 1.0 1.8 5.0 113 67 A 7 ASP HBx A 8 ARG H 1.0 1.8 5.0 114 68 A 8 ARG H A 7 ASP HBy 1.0 1.8 5.0 115 69 A 7 ASP HBx A 8 ARG HBy 1.0 1.8 5.0 116 69 A 7 ASP HBx A 8 ARG HBx 1.0 1.8 5.0 117 70 A 8 ARG HBy A 7 ASP HBy 1.0 1.8 5.0 118 70 A 7 ASP HBy A 8 ARG HBx 1.0 1.8 5.0 119 71 A 8 ARG H A 8 ARG HA 1.0 1.8 5.0 120 72 A 8 ARG HGx A 8 ARG H 1.0 1.8 5.0 121 73 A 8 ARG H A 8 ARG HGy 1.0 1.8 5.0 122 74 A 8 ARG H A 9 LEU H 1.0 1.8 5.0 123 75 A 8 ARG HA A 8 ARG HDx 1.0 1.8 5.0 124 75 A 8 ARG HA A 8 ARG HDy 1.0 1.8 5.0 125 76 A 8 ARG HA A 9 LEU H 1.0 1.8 5.0 126 77 A 8 ARG HA A 11 ARG HBx 1.0 1.8 5.0 127 77 A 8 ARG HA A 11 ARG HBy 1.0 1.8 5.0 128 78 A 8 ARG HA A 11 ARG HDy 1.0 1.8 5.0 129 78 A 8 ARG HA A 11 ARG HDx 1.0 1.8 5.0 130 79 A 8 ARG HA A 12 ALA H 1.0 1.8 5.0 131 80 A 9 LEU H A 8 ARG HBx 1.0 1.8 5.0 132 80 A 8 ARG HBy A 9 LEU H 1.0 1.8 5.0 133 81 A 9 LEU HD2% A 8 ARG HBx 1.0 1.8 5.0 134 81 A 8 ARG HBy A 9 LEU HD2% 1.0 1.8 5.0 135 82 A 9 LEU H A 8 ARG HGy 1.0 1.8 5.0 136 82 A 8 ARG HGx A 9 LEU H 1.0 1.8 5.0 137 83 A 9 LEU HG A 8 ARG HGy 1.0 1.8 5.0 138 83 A 8 ARG HGx A 9 LEU HG 1.0 1.8 5.0 139 84 A 8 ARG HGx A 9 LEU HD2% 1.0 1.8 5.0 140 85 A 9 LEU HD1% A 8 ARG HGy 1.0 1.8 5.0 141 86 A 9 LEU HD2% A 8 ARG HGy 1.0 1.8 5.0 142 87 A 9 LEU H A 9 LEU HA 1.0 1.8 5.0 143 88 A 9 LEU H A 9 LEU HBx 1.0 1.8 5.0 144 89 A 9 LEU H A 9 LEU HBy 1.0 1.8 5.0 145 90 A 9 LEU H A 9 LEU HG 1.0 1.8 5.0 146 91 A 9 LEU HD1% A 9 LEU H 1.0 1.8 5.0 147 92 A 9 LEU H A 9 LEU HD2% 1.0 1.8 5.0 148 93 A 10 GLU H A 9 LEU H 1.0 1.8 5.0 149 94 A 9 LEU H A 10 GLU HBx 1.0 1.8 5.0 150 94 A 10 GLU HBy A 9 LEU H 1.0 1.8 5.0 151 95 A 9 LEU H A 11 ARG H 1.0 1.8 5.0 152 96 A 9 LEU HD1% A 9 LEU HA 1.0 1.8 5.0 153 97 A 9 LEU HD2% A 9 LEU HA 1.0 1.8 5.0 154 98 A 10 GLU H A 9 LEU HA 1.0 1.8 5.0 155 99 A 9 LEU HA A 11 ARG H 1.0 1.8 5.0 156 100 A 9 LEU HA A 12 ALA H 1.0 1.8 5.0 157 101 A 9 LEU HA A 12 ALA HB% 1.0 1.8 5.0 158 102 A 9 LEU HA A 13 GLN H 1.0 1.8 5.0 159 103 A 10 GLU H A 9 LEU HBx 1.0 1.8 5.0 160 104 A 10 GLU H A 9 LEU HBy 1.0 1.8 5.0 161 105 A 9 LEU HBy A 39 TYR HBy 1.0 1.8 5.0 162 105 A 9 LEU HBx A 39 TYR HBy 1.0 1.8 5.0 163 105 A 39 TYR HBx A 9 LEU HBx 1.0 1.8 5.0 164 105 A 9 LEU HBy A 39 TYR HBx 1.0 1.8 5.0 165 106 A 39 TYR HD% A 9 LEU HBx 1.0 1.8 5.0 166 106 A 9 LEU HBy A 39 TYR HD% 1.0 1.8 5.0 167 107 A 39 TYR HE% A 9 LEU HBx 1.0 1.8 5.0 168 108 A 9 LEU HBy A 39 TYR HE% 1.0 1.8 5.0 169 109 A 10 GLU H A 9 LEU HG 1.0 1.8 5.0 170 110 A 9 LEU HG A 35 ASP HBy 1.0 1.8 5.0 171 110 A 9 LEU HG A 35 ASP HBx 1.0 1.8 5.0 172 111 A 9 LEU HG A 36 ALA HB% 1.0 1.8 5.0 173 112 A 9 LEU HG A 39 TYR HBy 1.0 1.8 5.0 174 112 A 9 LEU HG A 39 TYR HBx 1.0 1.8 5.0 175 113 A 9 LEU HD1% A 10 GLU H 1.0 1.8 5.0 176 114 A 10 GLU H A 9 LEU HD2% 1.0 1.8 5.0 177 115 A 9 LEU HD2% A 12 ALA HB% 1.0 1.8 5.0 178 116 A 9 LEU HD1% A 35 ASP H 1.0 1.8 5.0 179 117 A 9 LEU HD2% A 35 ASP HA 1.0 1.8 5.0 180 118 A 9 LEU HD1% A 35 ASP HBx 1.0 1.8 5.0 181 119 A 9 LEU HD1% A 35 ASP HBy 1.0 1.8 5.0 182 120 A 9 LEU HD2% A 35 ASP HBx 1.0 1.8 5.0 183 121 A 9 LEU HD2% A 35 ASP HBy 1.0 1.8 5.0 184 122 A 9 LEU HD2% A 36 ALA H 1.0 1.8 5.0 185 123 A 9 LEU HD2% A 36 ALA HA 1.0 1.8 5.0 186 124 A 9 LEU HD2% A 36 ALA HB% 1.0 1.8 5.0 187 125 A 9 LEU HD2% A 39 TYR H 1.0 1.8 5.0 188 126 A 9 LEU HD2% A 39 TYR HA 1.0 1.8 5.0 189 127 A 9 LEU HD1% A 39 TYR HBy 1.0 1.8 5.0 190 127 A 9 LEU HD1% A 39 TYR HBx 1.0 1.8 5.0 191 128 A 9 LEU HD2% A 39 TYR HBy 1.0 1.8 5.0 192 128 A 9 LEU HD2% A 39 TYR HBx 1.0 1.8 5.0 193 129 A 9 LEU HD1% A 39 TYR HD% 1.0 1.8 5.0 194 130 A 9 LEU HD2% A 39 TYR HD% 1.0 1.8 5.0 195 131 A 9 LEU HD1% A 39 TYR HE% 1.0 1.8 5.0 196 132 A 9 LEU HD2% A 39 TYR HE% 1.0 1.8 5.0 197 133 A 10 GLU H A 10 GLU HA 1.0 1.8 3.5 198 134 A 10 GLU H A 10 GLU HBx 1.0 1.8 2.9 199 134 A 10 GLU HBy A 10 GLU H 1.0 1.8 2.9 200 135 A 10 GLU HGy A 10 GLU H 1.0 1.8 5.0 201 136 A 10 GLU H A 10 GLU HGx 1.0 1.8 5.0 202 137 A 10 GLU H A 11 ARG H 1.0 1.8 2.9 203 138 A 10 GLU H A 12 ALA H 1.0 1.8 5.0 204 139 A 10 GLU HA A 11 ARG H 1.0 1.8 5.0 205 140 A 10 GLU HA A 13 GLN H 1.0 1.8 5.0 206 141 A 10 GLU HA A 13 GLN HBx 1.0 1.8 5.0 207 142 A 10 GLU HA A 13 GLN HBy 1.0 1.8 5.0 208 143 A 11 ARG H A 10 GLU HBx 1.0 1.8 3.5 209 143 A 10 GLU HBy A 11 ARG H 1.0 1.8 3.5 210 144 A 10 GLU HGy A 11 ARG H 1.0 1.8 5.0 211 145 A 11 ARG H A 10 GLU HGx 1.0 1.8 5.0 212 146 A 11 ARG HA A 11 ARG H 1.0 1.8 3.5 213 147 A 11 ARG HBy A 11 ARG H 1.0 1.8 2.9 214 147 A 11 ARG H A 11 ARG HBx 1.0 1.8 2.9 215 148 A 11 ARG HGx A 11 ARG H 1.0 1.8 5.0 216 149 A 11 ARG H A 11 ARG HGy 1.0 1.8 5.0 217 150 A 11 ARG HDx A 11 ARG H 1.0 1.8 5.0 218 150 A 11 ARG H A 11 ARG HDy 1.0 1.8 5.0 219 151 A 11 ARG H A 12 ALA H 1.0 1.8 5.0 220 152 A 11 ARG H A 13 GLN H 1.0 1.8 3.5 221 153 A 11 ARG HDx A 11 ARG HA 1.0 1.8 5.0 222 154 A 11 ARG HA A 11 ARG HDy 1.0 1.8 5.0 223 155 A 11 ARG HA A 12 ALA H 1.0 1.8 5.0 224 156 A 11 ARG HA A 14 SER H 1.0 1.8 5.0 225 157 A 11 ARG HA A 14 SER HBx 1.0 1.8 3.5 226 157 A 11 ARG HA A 14 SER HBy 1.0 1.8 3.5 227 158 A 11 ARG HA A 15 GLN H 1.0 1.8 5.0 228 159 A 11 ARG HBy A 12 ALA H 1.0 1.8 3.5 229 159 A 12 ALA H A 11 ARG HBx 1.0 1.8 3.5 230 160 A 12 ALA HB% A 11 ARG HBx 1.0 1.8 5.0 231 160 A 11 ARG HBy A 12 ALA HB% 1.0 1.8 5.0 232 161 A 13 GLN H A 11 ARG HBx 1.0 1.8 5.0 233 161 A 11 ARG HBy A 13 GLN H 1.0 1.8 5.0 234 162 A 14 SER H A 11 ARG HBx 1.0 1.8 5.0 235 162 A 11 ARG HBy A 14 SER H 1.0 1.8 5.0 236 163 A 11 ARG HBx A 14 SER HBx 1.0 1.8 5.0 237 163 A 11 ARG HBy A 14 SER HBx 1.0 1.8 5.0 238 163 A 14 SER HBy A 11 ARG HBx 1.0 1.8 5.0 239 163 A 11 ARG HBy A 14 SER HBy 1.0 1.8 5.0 240 164 A 11 ARG HBy A 15 GLN H 1.0 1.8 5.0 241 164 A 15 GLN H A 11 ARG HBx 1.0 1.8 5.0 242 165 A 11 ARG HBy A 15 GLN HBx 1.0 1.8 5.0 243 165 A 11 ARG HBx A 15 GLN HBx 1.0 1.8 5.0 244 165 A 15 GLN HBy A 11 ARG HBx 1.0 1.8 5.0 245 165 A 11 ARG HBy A 15 GLN HBy 1.0 1.8 5.0 246 166 A 11 ARG HGx A 12 ALA H 1.0 1.8 5.0 247 167 A 12 ALA H A 11 ARG HGy 1.0 1.8 5.0 248 168 A 11 ARG HGx A 14 SER HBx 1.0 1.8 5.0 249 168 A 11 ARG HGy A 14 SER HBx 1.0 1.8 5.0 250 168 A 14 SER HBy A 11 ARG HGy 1.0 1.8 5.0 251 168 A 14 SER HBy A 11 ARG HGx 1.0 1.8 5.0 252 169 A 12 ALA HA A 12 ALA H 1.0 1.8 5.0 253 170 A 12 ALA HB% A 12 ALA H 1.0 1.8 5.0 254 171 A 12 ALA H A 13 GLN H 1.0 1.8 5.0 255 172 A 14 SER H A 12 ALA H 1.0 1.8 5.0 256 173 A 12 ALA H A 15 GLN H 1.0 1.8 5.0 257 174 A 12 ALA H A 15 GLN HBx 1.0 1.8 5.0 258 175 A 15 GLN HBy A 12 ALA H 1.0 1.8 5.0 259 176 A 12 ALA HA A 13 GLN H 1.0 1.8 5.0 260 177 A 14 SER H A 12 ALA HA 1.0 1.8 5.0 261 178 A 12 ALA HA A 15 GLN H 1.0 1.8 5.0 262 179 A 12 ALA HA A 15 GLN HBx 1.0 1.8 5.0 263 180 A 15 GLN HBy A 12 ALA HA 1.0 1.8 5.0 264 181 A 12 ALA HA A 16 GLY H 1.0 1.8 5.0 265 182 A 12 ALA HA A 31 TYR HE% 1.0 1.8 5.0 266 183 A 12 ALA HA A 40 TRP HD1 1.0 1.8 5.0 267 184 A 12 ALA HB% A 13 GLN H 1.0 1.8 5.0 268 185 A 12 ALA HB% A 13 GLN HA 1.0 1.8 5.0 269 186 A 12 ALA HB% A 13 GLN HBx 1.0 1.8 5.0 270 186 A 12 ALA HB% A 13 GLN HBy 1.0 1.8 5.0 271 187 A 12 ALA HB% A 14 SER H 1.0 1.8 5.0 272 188 A 12 ALA HB% A 15 GLN H 1.0 1.8 5.0 273 189 A 12 ALA HB% A 15 GLN HBx 1.0 1.8 5.0 274 189 A 12 ALA HB% A 15 GLN HBy 1.0 1.8 5.0 275 190 A 12 ALA HB% A 31 TYR HBx 1.0 1.8 5.0 276 191 A 12 ALA HB% A 31 TYR HBy 1.0 1.8 5.0 277 192 A 12 ALA HB% A 31 TYR HD% 1.0 1.8 5.0 278 193 A 12 ALA HB% A 31 TYR HE% 1.0 1.8 5.0 279 194 A 12 ALA HB% A 36 ALA HA 1.0 1.8 5.0 280 195 A 12 ALA HB% A 36 ALA HB% 1.0 1.8 5.0 281 196 A 12 ALA HB% A 39 TYR H 1.0 1.8 5.0 282 197 A 12 ALA HB% A 39 TYR HA 1.0 1.8 5.0 283 198 A 12 ALA HB% A 39 TYR HBx 1.0 1.8 5.0 284 199 A 12 ALA HB% A 39 TYR HBy 1.0 1.8 5.0 285 200 A 12 ALA HB% A 39 TYR HD% 1.0 1.8 5.0 286 201 A 12 ALA HB% A 40 TRP H 1.0 1.8 5.0 287 202 A 12 ALA HB% A 40 TRP HA 1.0 1.8 5.0 288 203 A 12 ALA HB% A 40 TRP HBx 1.0 1.8 5.0 289 204 A 12 ALA HB% A 40 TRP HBy 1.0 1.8 5.0 290 205 A 12 ALA HB% A 40 TRP HD1 1.0 1.8 5.0 291 206 A 13 GLN HA A 13 GLN H 1.0 1.8 3.5 292 207 A 13 GLN H A 13 GLN HBx 1.0 1.8 3.5 293 208 A 13 GLN HBy A 13 GLN H 1.0 1.8 3.5 294 209 A 14 SER H A 13 GLN H 1.0 1.8 3.5 295 210 A 13 GLN H A 15 GLN H 1.0 1.8 5.0 296 211 A 39 TYR HBx A 13 GLN H 1.0 1.8 5.0 297 212 A 13 GLN H A 39 TYR HBy 1.0 1.8 5.0 298 213 A 39 TYR HD% A 13 GLN H 1.0 1.8 5.0 299 214 A 14 SER H A 13 GLN HA 1.0 1.8 5.0 300 215 A 13 GLN HA A 16 GLY H 1.0 1.8 5.0 301 216 A 39 TYR HBx A 13 GLN HA 1.0 1.8 5.0 302 217 A 13 GLN HA A 39 TYR HBy 1.0 1.8 5.0 303 218 A 13 GLN HA A 40 TRP HA 1.0 1.8 3.5 304 219 A 13 GLN HE2y A 13 GLN HBx 1.0 1.8 5.0 305 219 A 13 GLN HBy A 13 GLN HE2y 1.0 1.8 5.0 306 220 A 13 GLN HE2x A 13 GLN HBx 1.0 1.8 5.0 307 220 A 13 GLN HBy A 13 GLN HE2x 1.0 1.8 5.0 308 221 A 13 GLN HBy A 13 GLN HE2y 1.0 1.8 5.0 309 221 A 13 GLN HBy A 13 GLN HE2x 1.0 1.8 5.0 310 222 A 14 SER H A 13 GLN HBx 1.0 1.8 5.0 311 223 A 14 SER H A 13 GLN HBy 1.0 1.8 5.0 312 224 A 13 GLN HBy A 14 SER HBx 1.0 1.8 5.0 313 224 A 13 GLN HBx A 14 SER HBx 1.0 1.8 5.0 314 224 A 14 SER HBy A 13 GLN HBx 1.0 1.8 5.0 315 224 A 14 SER HBy A 13 GLN HBy 1.0 1.8 5.0 316 225 A 39 TYR HBx A 13 GLN HBx 1.0 1.8 5.0 317 225 A 39 TYR HBx A 13 GLN HBy 1.0 1.8 5.0 318 226 A 13 GLN HBy A 39 TYR HBy 1.0 1.8 5.0 319 226 A 13 GLN HBx A 39 TYR HBy 1.0 1.8 5.0 320 227 A 39 TYR HD% A 13 GLN HBx 1.0 1.8 5.0 321 228 A 39 TYR HD% A 13 GLN HBy 1.0 1.8 5.0 322 229 A 39 TYR HE% A 13 GLN HBx 1.0 1.8 5.0 323 229 A 39 TYR HE% A 13 GLN HBy 1.0 1.8 5.0 324 230 A 14 SER H A 13 GLN HGx 1.0 1.8 5.0 325 230 A 14 SER H A 13 GLN HGy 1.0 1.8 5.0 326 231 A 39 TYR HA A 13 GLN HGx 1.0 1.8 5.0 327 231 A 39 TYR HA A 13 GLN HGy 1.0 1.8 5.0 328 232 A 39 TYR HD% A 13 GLN HGx 1.0 1.8 5.0 329 232 A 39 TYR HD% A 13 GLN HGy 1.0 1.8 5.0 330 233 A 13 GLN HGy A 43 GLY HAx 1.0 1.8 5.0 331 233 A 43 GLY HAx A 13 GLN HGx 1.0 1.8 5.0 332 234 A 13 GLN HGy A 43 GLY HAy 1.0 1.8 5.0 333 234 A 13 GLN HGx A 43 GLY HAy 1.0 1.8 5.0 334 235 A 39 TYR HE% A 13 GLN HE2y 1.0 1.8 5.0 335 235 A 39 TYR HE% A 13 GLN HE2x 1.0 1.8 5.0 336 236 A 14 SER H A 14 SER HA 1.0 1.8 3.5 337 237 A 14 SER H A 14 SER HBx 1.0 1.8 3.5 338 237 A 14 SER H A 14 SER HBy 1.0 1.8 3.5 339 238 A 14 SER H A 15 GLN H 1.0 1.8 5.0 340 239 A 14 SER H A 15 GLN HBx 1.0 1.8 5.0 341 239 A 14 SER H A 15 GLN HBy 1.0 1.8 5.0 342 240 A 14 SER H A 16 GLY H 1.0 1.8 5.0 343 241 A 14 SER HA A 15 GLN H 1.0 1.8 5.0 344 242 A 14 SER HA A 15 GLN HA 1.0 1.8 5.0 345 243 A 14 SER HA A 17 TYR H 1.0 1.8 3.5 346 244 A 14 SER HA A 17 TYR HBx 1.0 1.8 5.0 347 245 A 14 SER HA A 17 TYR HBy 1.0 1.8 5.0 348 246 A 14 SER HA A 17 TYR HD% 1.0 1.8 5.0 349 247 A 14 SER HA A 18 LYS H 1.0 1.8 5.0 350 248 A 14 SER HBy A 15 GLN H 1.0 1.8 5.0 351 248 A 15 GLN H A 14 SER HBx 1.0 1.8 5.0 352 249 A 14 SER HBy A 15 GLN HBx 1.0 1.8 5.0 353 249 A 15 GLN HBy A 14 SER HBx 1.0 1.8 5.0 354 249 A 14 SER HBy A 15 GLN HBy 1.0 1.8 5.0 355 249 A 14 SER HBx A 15 GLN HBx 1.0 1.8 5.0 356 250 A 14 SER HBy A 17 TYR HBy 1.0 1.8 5.0 357 250 A 14 SER HBx A 17 TYR HBy 1.0 1.8 5.0 358 250 A 17 TYR HBx A 14 SER HBx 1.0 1.8 5.0 359 250 A 14 SER HBy A 17 TYR HBx 1.0 1.8 5.0 360 251 A 15 GLN HA A 15 GLN H 1.0 1.8 5.0 361 252 A 15 GLN H A 15 GLN HBx 1.0 1.8 5.0 362 253 A 15 GLN HBy A 15 GLN H 1.0 1.8 5.0 363 254 A 15 GLN HGx A 15 GLN H 1.0 1.8 5.0 364 255 A 15 GLN HGy A 15 GLN H 1.0 1.8 5.0 365 256 A 15 GLN H A 16 GLY H 1.0 1.8 3.5 366 257 A 17 TYR H A 15 GLN H 1.0 1.8 5.0 367 258 A 15 GLN HA A 16 GLY H 1.0 1.8 5.0 368 259 A 15 GLN HA A 18 LYS H 1.0 1.8 5.0 369 260 A 15 GLN HA A 18 LYS HBx 1.0 1.8 5.0 370 261 A 15 GLN HA A 18 LYS HBy 1.0 1.8 5.0 371 262 A 16 GLY H A 15 GLN HBx 1.0 1.8 5.0 372 263 A 15 GLN HBy A 16 GLY H 1.0 1.8 5.0 373 264 A 15 GLN HBy A 16 GLY HAy 1.0 1.8 5.0 374 264 A 15 GLN HBx A 16 GLY HAy 1.0 1.8 5.0 375 264 A 16 GLY HAx A 15 GLN HBx 1.0 1.8 5.0 376 264 A 15 GLN HBy A 16 GLY HAx 1.0 1.8 5.0 377 265 A 31 TYR HE% A 15 GLN HBx 1.0 1.8 5.0 378 266 A 15 GLN HBy A 31 TYR HE% 1.0 1.8 5.0 379 267 A 16 GLY HAx A 16 GLY H 1.0 1.8 5.0 380 268 A 16 GLY H A 16 GLY HAy 1.0 1.8 5.0 381 269 A 17 TYR H A 16 GLY H 1.0 1.8 3.5 382 270 A 17 TYR HBx A 16 GLY H 1.0 1.8 5.0 383 270 A 16 GLY H A 17 TYR HBy 1.0 1.8 5.0 384 271 A 16 GLY H A 18 LYS H 1.0 1.8 5.0 385 272 A 19 ALA HB% A 16 GLY H 1.0 1.8 5.0 386 273 A 40 TRP HA A 16 GLY H 1.0 1.8 5.0 387 274 A 40 TRP HD1 A 16 GLY H 1.0 1.8 5.0 388 275 A 40 TRP HE1 A 16 GLY H 1.0 1.8 5.0 389 276 A 17 TYR H A 16 GLY HAx 1.0 1.8 5.0 390 277 A 17 TYR H A 16 GLY HAy 1.0 1.8 5.0 391 278 A 16 GLY HAx A 19 ALA H 1.0 1.8 5.0 392 278 A 19 ALA H A 16 GLY HAy 1.0 1.8 5.0 393 279 A 16 GLY HAx A 19 ALA HB% 1.0 1.8 5.0 394 280 A 19 ALA HB% A 16 GLY HAy 1.0 1.8 5.0 395 281 A 16 GLY HAx A 20 GLY H 1.0 1.8 5.0 396 281 A 20 GLY H A 16 GLY HAy 1.0 1.8 5.0 397 282 A 40 TRP HA A 16 GLY HAx 1.0 1.8 5.0 398 283 A 40 TRP HA A 16 GLY HAy 1.0 1.8 5.0 399 284 A 40 TRP HD1 A 16 GLY HAy 1.0 1.8 5.0 400 284 A 40 TRP HD1 A 16 GLY HAx 1.0 1.8 5.0 401 285 A 40 TRP HE1 A 16 GLY HAy 1.0 1.8 5.0 402 285 A 16 GLY HAx A 40 TRP HE1 1.0 1.8 5.0 403 286 A 40 TRP HH2 A 16 GLY HAy 1.0 1.8 5.0 404 286 A 16 GLY HAx A 40 TRP HH2 1.0 1.8 5.0 405 287 A 16 GLY HAx A 44 TRP H 1.0 1.8 5.0 406 288 A 44 TRP H A 16 GLY HAy 1.0 1.8 5.0 407 289 A 17 TYR H A 17 TYR HA 1.0 1.8 5.0 408 290 A 17 TYR H A 17 TYR HBx 1.0 1.8 5.0 409 291 A 17 TYR H A 17 TYR HBy 1.0 1.8 5.0 410 292 A 17 TYR H A 17 TYR HD% 1.0 1.8 5.0 411 293 A 17 TYR H A 18 LYS H 1.0 1.8 3.5 412 294 A 17 TYR H A 19 ALA HB% 1.0 1.8 5.0 413 295 A 17 TYR H A 47 ALA HB% 1.0 1.8 5.0 414 296 A 17 TYR HA A 20 GLY H 1.0 1.8 5.0 415 297 A 17 TYR HA A 21 LEU HD2% 1.0 1.8 5.0 416 298 A 17 TYR HA A 44 TRP HA 1.0 1.8 5.0 417 299 A 17 TYR HA A 47 ALA H 1.0 1.8 5.0 418 300 A 17 TYR HA A 47 ALA HB% 1.0 1.8 5.0 419 301 A 17 TYR HBx A 17 TYR HE% 1.0 1.8 5.0 420 302 A 17 TYR HE% A 17 TYR HBy 1.0 1.8 5.0 421 303 A 17 TYR HBx A 18 LYS H 1.0 1.8 5.0 422 304 A 18 LYS H A 17 TYR HBy 1.0 1.8 5.0 423 305 A 21 LEU HD2% A 17 TYR HBy 1.0 1.8 5.0 424 305 A 17 TYR HBx A 21 LEU HD2% 1.0 1.8 5.0 425 306 A 17 TYR HBx A 43 GLY HAx 1.0 1.8 5.0 426 306 A 43 GLY HAx A 17 TYR HBy 1.0 1.8 5.0 427 307 A 17 TYR HBx A 43 GLY HAy 1.0 1.8 5.0 428 307 A 17 TYR HBy A 43 GLY HAy 1.0 1.8 5.0 429 308 A 47 ALA HB% A 17 TYR HBy 1.0 1.8 5.0 430 308 A 17 TYR HBx A 47 ALA HB% 1.0 1.8 5.0 431 309 A 17 TYR HD% A 18 LYS H 1.0 1.8 5.0 432 310 A 17 TYR HD% A 18 LYS HA 1.0 1.8 5.0 433 311 A 17 TYR HD% A 21 LEU HD1% 1.0 1.8 5.0 434 312 A 17 TYR HD% A 21 LEU HD2% 1.0 1.8 5.0 435 313 A 17 TYR HD% A 43 GLY HAy 1.0 1.8 5.0 436 313 A 17 TYR HD% A 43 GLY HAx 1.0 1.8 5.0 437 314 A 17 TYR HD% A 46 ASP HBx 1.0 1.8 5.0 438 315 A 17 TYR HD% A 46 ASP HBy 1.0 1.8 5.0 439 316 A 17 TYR HD% A 47 ALA H 1.0 1.8 5.0 440 317 A 17 TYR HD% A 47 ALA HA 1.0 1.8 5.0 441 318 A 17 TYR HD% A 47 ALA HB% 1.0 1.8 5.0 442 319 A 17 TYR HE% A 21 LEU HD1% 1.0 1.8 5.0 443 320 A 21 LEU HD2% A 17 TYR HE% 1.0 1.8 5.0 444 321 A 17 TYR HE% A 46 ASP HBx 1.0 1.8 5.0 445 322 A 17 TYR HE% A 46 ASP HBy 1.0 1.8 5.0 446 323 A 17 TYR HE% A 47 ALA H 1.0 1.8 5.0 447 324 A 17 TYR HE% A 47 ALA HA 1.0 1.8 5.0 448 325 A 47 ALA HB% A 17 TYR HE% 1.0 1.8 5.0 449 326 A 18 LYS HA A 18 LYS H 1.0 1.8 3.5 450 327 A 18 LYS H A 18 LYS HBx 1.0 1.8 5.0 451 328 A 18 LYS HBy A 18 LYS H 1.0 1.8 5.0 452 329 A 18 LYS HGx A 18 LYS H 1.0 1.8 5.0 453 330 A 18 LYS H A 18 LYS HGy 1.0 1.8 5.0 454 331 A 18 LYS HDy A 18 LYS H 1.0 1.8 5.0 455 331 A 18 LYS H A 18 LYS HDx 1.0 1.8 5.0 456 332 A 19 ALA HB% A 18 LYS H 1.0 1.8 5.0 457 333 A 18 LYS HA A 18 LYS HDx 1.0 1.8 5.0 458 333 A 18 LYS HA A 18 LYS HDy 1.0 1.8 5.0 459 334 A 18 LYS HA A 19 ALA H 1.0 1.8 5.0 460 335 A 18 LYS HA A 20 GLY H 1.0 1.8 5.0 461 336 A 18 LYS HA A 21 LEU H 1.0 1.8 5.0 462 337 A 18 LYS HA A 21 LEU HBx 1.0 1.8 5.0 463 338 A 18 LYS HA A 21 LEU HBy 1.0 1.8 5.0 464 339 A 18 LYS HA A 21 LEU HD1% 1.0 1.8 5.0 465 340 A 21 LEU HD2% A 18 LYS HA 1.0 1.8 5.0 466 341 A 18 LYS HA A 22 ASN H 1.0 1.8 5.0 467 342 A 18 LYS HEy A 18 LYS HBx 1.0 1.8 5.0 468 342 A 18 LYS HBx A 18 LYS HEx 1.0 1.8 5.0 469 343 A 18 LYS HEy A 18 LYS HBy 1.0 1.8 5.0 470 343 A 18 LYS HBy A 18 LYS HEx 1.0 1.8 5.0 471 344 A 18 LYS HBy A 19 ALA H 1.0 1.8 5.0 472 344 A 19 ALA H A 18 LYS HBx 1.0 1.8 5.0 473 345 A 19 ALA HA A 18 LYS HBx 1.0 1.8 5.0 474 345 A 18 LYS HBy A 19 ALA HA 1.0 1.8 5.0 475 346 A 22 ASN HBx A 18 LYS HBx 1.0 1.8 5.0 476 346 A 18 LYS HBx A 22 ASN HBy 1.0 1.8 5.0 477 347 A 18 LYS HBy A 22 ASN HBx 1.0 1.8 5.0 478 347 A 18 LYS HBy A 22 ASN HBy 1.0 1.8 5.0 479 348 A 18 LYS HGx A 18 LYS HEx 1.0 1.8 5.0 480 348 A 18 LYS HEy A 18 LYS HGx 1.0 1.8 5.0 481 349 A 18 LYS HEy A 18 LYS HGy 1.0 1.8 5.0 482 349 A 18 LYS HEx A 18 LYS HGy 1.0 1.8 5.0 483 350 A 21 LEU HBy A 18 LYS HGx 1.0 1.8 5.0 484 350 A 18 LYS HGx A 21 LEU HBx 1.0 1.8 5.0 485 351 A 21 LEU HBy A 18 LYS HGy 1.0 1.8 5.0 486 351 A 18 LYS HGy A 21 LEU HBx 1.0 1.8 5.0 487 352 A 21 LEU HD2% A 18 LYS HGy 1.0 1.8 5.0 488 352 A 21 LEU HD2% A 18 LYS HGx 1.0 1.8 5.0 489 353 A 22 ASN HBx A 18 LYS HGx 1.0 1.8 5.0 490 353 A 18 LYS HGx A 22 ASN HBy 1.0 1.8 5.0 491 354 A 22 ASN HBx A 18 LYS HGy 1.0 1.8 5.0 492 354 A 18 LYS HGy A 22 ASN HBy 1.0 1.8 5.0 493 355 A 18 LYS HGx A 22 ASN HD2y 1.0 1.8 5.0 494 355 A 18 LYS HGx A 22 ASN HD2x 1.0 1.8 5.0 495 356 A 22 ASN HD2x A 18 LYS HGy 1.0 1.8 5.0 496 356 A 18 LYS HGy A 22 ASN HD2y 1.0 1.8 5.0 497 356 A 18 LYS HGx A 22 ASN HD2y 1.0 1.8 5.0 498 356 A 18 LYS HGx A 22 ASN HD2x 1.0 1.8 5.0 499 357 A 18 LYS HGy A 22 ASN HD2y 1.0 1.8 5.0 500 357 A 22 ASN HD2x A 18 LYS HGy 1.0 1.8 5.0 501 358 A 19 ALA HA A 19 ALA H 1.0 1.8 5.0 502 359 A 19 ALA HB% A 19 ALA H 1.0 1.8 5.0 503 360 A 19 ALA H A 20 GLY H 1.0 1.8 3.5 504 361 A 21 LEU H A 19 ALA H 1.0 1.8 5.0 505 362 A 19 ALA HA A 20 GLY H 1.0 1.8 5.0 506 363 A 19 ALA HA A 20 GLY HAy 1.0 1.8 5.0 507 363 A 19 ALA HA A 20 GLY HAx 1.0 1.8 5.0 508 364 A 21 LEU H A 19 ALA HA 1.0 1.8 5.0 509 365 A 19 ALA HA A 22 ASN H 1.0 1.8 5.0 510 366 A 19 ALA HA A 22 ASN HBx 1.0 1.8 5.0 511 367 A 19 ALA HA A 22 ASN HBy 1.0 1.8 5.0 512 368 A 19 ALA HA A 23 GLY H 1.0 1.8 5.0 513 369 A 19 ALA HB% A 20 GLY H 1.0 1.8 5.0 514 370 A 19 ALA HB% A 20 GLY HAx 1.0 1.8 5.0 515 371 A 19 ALA HB% A 20 GLY HAy 1.0 1.8 5.0 516 372 A 19 ALA HB% A 23 GLY H 1.0 1.8 5.0 517 373 A 19 ALA HB% A 24 ARG H 1.0 1.8 5.0 518 374 A 19 ALA HB% A 26 GLN HA 1.0 1.8 5.0 519 375 A 19 ALA HB% A 30 PRO HDy 1.0 1.8 5.0 520 375 A 19 ALA HB% A 30 PRO HDx 1.0 1.8 5.0 521 376 A 19 ALA HB% A 40 TRP HE1 1.0 1.8 5.0 522 377 A 19 ALA HB% A 40 TRP HZ2 1.0 1.8 5.0 523 378 A 19 ALA HB% A 40 TRP HZ3 1.0 1.8 5.0 524 379 A 19 ALA HB% A 40 TRP HH2 1.0 1.8 5.0 525 380 A 19 ALA HB% A 44 TRP HD1 1.0 1.8 5.0 526 381 A 19 ALA HB% A 44 TRP HE1 1.0 1.8 5.0 527 382 A 20 GLY HAx A 20 GLY H 1.0 1.8 5.0 528 383 A 20 GLY H A 20 GLY HAy 1.0 1.8 5.0 529 384 A 21 LEU H A 20 GLY H 1.0 1.8 3.5 530 385 A 20 GLY H A 22 ASN H 1.0 1.8 5.0 531 386 A 20 GLY H A 23 GLY H 1.0 1.8 5.0 532 387 A 44 TRP HA A 20 GLY H 1.0 1.8 5.0 533 388 A 44 TRP HD1 A 20 GLY H 1.0 1.8 5.0 534 389 A 47 ALA HB% A 20 GLY H 1.0 1.8 5.0 535 390 A 21 LEU H A 20 GLY HAx 1.0 1.8 5.0 536 391 A 21 LEU H A 20 GLY HAy 1.0 1.8 5.0 537 392 A 20 GLY HAx A 23 GLY H 1.0 1.8 5.0 538 393 A 23 GLY H A 20 GLY HAy 1.0 1.8 5.0 539 394 A 24 ARG H A 20 GLY HAy 1.0 1.8 5.0 540 394 A 20 GLY HAx A 24 ARG H 1.0 1.8 5.0 541 395 A 24 ARG HA A 20 GLY HAy 1.0 1.8 5.0 542 395 A 20 GLY HAx A 24 ARG HA 1.0 1.8 5.0 543 396 A 44 TRP HA A 20 GLY HAx 1.0 1.8 5.0 544 397 A 44 TRP HA A 20 GLY HAy 1.0 1.8 5.0 545 398 A 20 GLY HAx A 44 TRP HD1 1.0 1.8 5.0 546 399 A 44 TRP HD1 A 20 GLY HAy 1.0 1.8 5.0 547 400 A 20 GLY HAx A 44 TRP HE1 1.0 1.8 5.0 548 401 A 44 TRP HE1 A 20 GLY HAy 1.0 1.8 5.0 549 402 A 47 ALA HB% A 20 GLY HAx 1.0 1.8 5.0 550 403 A 47 ALA HB% A 20 GLY HAy 1.0 1.8 5.0 551 404 A 21 LEU H A 21 LEU HA 1.0 1.8 3.5 552 405 A 21 LEU H A 21 LEU HBx 1.0 1.8 5.0 553 406 A 21 LEU H A 21 LEU HBy 1.0 1.8 5.0 554 407 A 21 LEU H A 21 LEU HG 1.0 1.8 5.0 555 408 A 21 LEU HD1% A 21 LEU H 1.0 1.8 5.0 556 409 A 21 LEU HD2% A 21 LEU H 1.0 1.8 5.0 557 410 A 21 LEU H A 22 ASN H 1.0 1.8 3.5 558 411 A 21 LEU H A 23 GLY H 1.0 1.8 5.0 559 412 A 21 LEU HD1% A 21 LEU HA 1.0 1.8 5.0 560 413 A 21 LEU HD2% A 21 LEU HA 1.0 1.8 5.0 561 414 A 21 LEU HA A 22 ASN H 1.0 1.8 5.0 562 415 A 21 LEU HA A 23 GLY H 1.0 1.8 5.0 563 416 A 22 ASN H A 21 LEU HBx 1.0 1.8 5.0 564 417 A 21 LEU HBy A 22 ASN H 1.0 1.8 5.0 565 418 A 22 ASN HA A 21 LEU HBx 1.0 1.8 5.0 566 418 A 21 LEU HBy A 22 ASN HA 1.0 1.8 5.0 567 419 A 21 LEU HG A 22 ASN H 1.0 1.8 5.0 568 420 A 21 LEU HD1% A 22 ASN H 1.0 1.8 5.0 569 421 A 21 LEU HD2% A 22 ASN H 1.0 1.8 5.0 570 422 A 22 ASN HA A 22 ASN H 1.0 1.8 3.5 571 423 A 22 ASN HBx A 22 ASN H 1.0 1.8 3.5 572 424 A 22 ASN H A 22 ASN HBy 1.0 1.8 3.5 573 425 A 22 ASN H A 23 GLY H 1.0 1.8 2.9 574 426 A 24 ARG H A 22 ASN H 1.0 1.8 5.0 575 427 A 22 ASN HA A 22 ASN HD2y 1.0 1.8 5.0 576 427 A 22 ASN HA A 22 ASN HD2x 1.0 1.8 5.0 577 428 A 22 ASN HA A 23 GLY H 1.0 1.8 5.0 578 429 A 24 ARG H A 22 ASN HA 1.0 1.8 5.0 579 430 A 22 ASN HBx A 22 ASN HD2x 1.0 1.8 5.0 580 431 A 22 ASN HD2x A 22 ASN HBy 1.0 1.8 5.0 581 432 A 22 ASN HBx A 23 GLY H 1.0 1.8 5.0 582 433 A 23 GLY H A 22 ASN HBy 1.0 1.8 5.0 583 434 A 22 ASN HBx A 24 ARG H 1.0 1.8 5.0 584 435 A 24 ARG H A 22 ASN HBy 1.0 1.8 5.0 585 436 A 23 GLY HAx A 23 GLY H 1.0 1.8 3.5 586 437 A 23 GLY HAy A 23 GLY H 1.0 1.8 3.5 587 438 A 24 ARG H A 23 GLY H 1.0 1.8 3.5 588 439 A 24 ARG H A 23 GLY HAx 1.0 1.8 5.0 589 440 A 24 ARG H A 23 GLY HAy 1.0 1.8 5.0 590 441 A 24 ARG H A 24 ARG HA 1.0 1.8 5.0 591 442 A 24 ARG H A 24 ARG HBx 1.0 1.8 3.5 592 443 A 24 ARG H A 24 ARG HBy 1.0 1.8 3.5 593 444 A 24 ARG H A 24 ARG HGx 1.0 1.8 5.0 594 445 A 24 ARG H A 24 ARG HGy 1.0 1.8 5.0 595 446 A 24 ARG H A 25 SER H 1.0 1.8 5.0 596 447 A 24 ARG HA A 24 ARG HDx 1.0 1.8 5.0 597 447 A 24 ARG HA A 24 ARG HDy 1.0 1.8 5.0 598 448 A 24 ARG HA A 25 SER H 1.0 1.8 3.5 599 449 A 24 ARG HDy A 24 ARG HBy 1.0 1.8 5.0 600 449 A 24 ARG HBy A 24 ARG HDx 1.0 1.8 5.0 601 450 A 25 SER H A 24 ARG HBx 1.0 1.8 5.0 602 451 A 25 SER H A 24 ARG HBy 1.0 1.8 5.0 603 452 A 28 ALA HB% A 24 ARG HBy 1.0 1.8 5.0 604 452 A 24 ARG HBx A 28 ALA HB% 1.0 1.8 5.0 605 453 A 24 ARG HGx A 25 SER H 1.0 1.8 5.0 606 454 A 24 ARG HGy A 25 SER H 1.0 1.8 5.0 607 455 A 25 SER H A 24 ARG HDx 1.0 1.8 5.0 608 455 A 25 SER H A 24 ARG HDy 1.0 1.8 5.0 609 456 A 25 SER H A 25 SER HA 1.0 1.8 3.5 610 457 A 25 SER H A 25 SER HBx 1.0 1.8 5.0 611 458 A 25 SER H A 25 SER HBy 1.0 1.8 5.0 612 459 A 25 SER H A 26 GLN H 1.0 1.8 5.0 613 460 A 25 SER H A 28 ALA H 1.0 1.8 5.0 614 461 A 25 SER H A 28 ALA HB% 1.0 1.8 5.0 615 462 A 25 SER HA A 26 GLN H 1.0 1.8 2.9 616 463 A 25 SER HA A 44 TRP HZ2 1.0 1.8 5.0 617 464 A 26 GLN H A 25 SER HBx 1.0 1.8 5.0 618 465 A 26 GLN H A 25 SER HBy 1.0 1.8 5.0 619 466 A 26 GLN HA A 25 SER HBy 1.0 1.8 5.0 620 466 A 26 GLN HA A 25 SER HBx 1.0 1.8 5.0 621 467 A 25 SER HBx A 26 GLN HGy 1.0 1.8 5.0 622 467 A 25 SER HBx A 26 GLN HGx 1.0 1.8 5.0 623 468 A 26 GLN HGy A 25 SER HBy 1.0 1.8 5.0 624 468 A 25 SER HBy A 26 GLN HGx 1.0 1.8 5.0 625 469 A 25 SER HBx A 27 GLU H 1.0 1.8 5.0 626 470 A 27 GLU H A 25 SER HBy 1.0 1.8 5.0 627 471 A 27 GLU HA A 25 SER HBy 1.0 1.8 5.0 628 471 A 25 SER HBx A 27 GLU HA 1.0 1.8 5.0 629 472 A 25 SER HBx A 27 GLU HBy 1.0 1.8 5.0 630 472 A 25 SER HBx A 27 GLU HBx 1.0 1.8 5.0 631 473 A 27 GLU HBy A 25 SER HBy 1.0 1.8 5.0 632 473 A 25 SER HBy A 27 GLU HBx 1.0 1.8 5.0 633 474 A 25 SER HBx A 27 GLU HGy 1.0 1.8 5.0 634 474 A 25 SER HBx A 27 GLU HGx 1.0 1.8 5.0 635 475 A 27 GLU HGy A 25 SER HBy 1.0 1.8 5.0 636 475 A 25 SER HBy A 27 GLU HGx 1.0 1.8 5.0 637 476 A 28 ALA H A 25 SER HBy 1.0 1.8 5.0 638 476 A 28 ALA H A 25 SER HBx 1.0 1.8 5.0 639 477 A 28 ALA HB% A 25 SER HBx 1.0 1.8 5.0 640 478 A 28 ALA HB% A 25 SER HBy 1.0 1.8 5.0 641 479 A 26 GLN HA A 26 GLN H 1.0 1.8 3.5 642 480 A 26 GLN H A 26 GLN HBx 1.0 1.8 5.0 643 481 A 26 GLN H A 26 GLN HBy 1.0 1.8 5.0 644 482 A 26 GLN H A 26 GLN HGx 1.0 1.8 5.0 645 483 A 26 GLN H A 26 GLN HGy 1.0 1.8 5.0 646 484 A 26 GLN H A 26 GLN HE2y 1.0 1.8 5.0 647 484 A 26 GLN H A 26 GLN HE2x 1.0 1.8 5.0 648 485 A 26 GLN H A 27 GLU H 1.0 1.8 3.5 649 486 A 26 GLN H A 27 GLU HA 1.0 1.8 5.0 650 487 A 26 GLN H A 27 GLU HBx 1.0 1.8 5.0 651 488 A 26 GLN H A 27 GLU HBy 1.0 1.8 5.0 652 489 A 26 GLN H A 28 ALA H 1.0 1.8 5.0 653 490 A 40 TRP HZ3 A 26 GLN H 1.0 1.8 5.0 654 491 A 44 TRP HE1 A 26 GLN H 1.0 1.8 5.0 655 492 A 26 GLN H A 44 TRP HZ2 1.0 1.8 5.0 656 493 A 26 GLN H A 44 TRP HH2 1.0 1.8 5.0 657 494 A 26 GLN HA A 27 GLU H 1.0 1.8 5.0 658 495 A 26 GLN HA A 28 ALA H 1.0 1.8 5.0 659 496 A 26 GLN HA A 28 ALA HB% 1.0 1.8 5.0 660 497 A 26 GLN HA A 29 CYS H 1.0 1.8 5.0 661 498 A 26 GLN HA A 29 CYS HBy 1.0 1.8 5.0 662 499 A 26 GLN HA A 29 CYS HBx 1.0 1.8 5.0 663 500 A 26 GLN HA A 40 TRP HZ2 1.0 1.8 5.0 664 501 A 26 GLN HA A 40 TRP HZ3 1.0 1.8 5.0 665 502 A 40 TRP HH2 A 26 GLN HA 1.0 1.8 5.0 666 503 A 26 GLN HA A 41 LEU HD2% 1.0 1.8 5.0 667 504 A 26 GLN HA A 44 TRP HE1 1.0 1.8 5.0 668 505 A 26 GLN HE2y A 26 GLN HBx 1.0 1.8 5.0 669 506 A 26 GLN HE2x A 26 GLN HBx 1.0 1.8 5.0 670 507 A 26 GLN HE2y A 26 GLN HBy 1.0 1.8 5.0 671 508 A 26 GLN HE2x A 26 GLN HBy 1.0 1.8 5.0 672 509 A 27 GLU H A 26 GLN HBx 1.0 1.8 5.0 673 510 A 27 GLU H A 26 GLN HBy 1.0 1.8 5.0 674 511 A 27 GLU HA A 26 GLN HBx 1.0 1.8 5.0 675 512 A 27 GLU HA A 26 GLN HBy 1.0 1.8 5.0 676 513 A 28 ALA H A 26 GLN HBx 1.0 1.8 5.0 677 514 A 28 ALA H A 26 GLN HBy 1.0 1.8 5.0 678 515 A 29 CYS H A 26 GLN HBx 1.0 1.8 5.0 679 515 A 29 CYS H A 26 GLN HBy 1.0 1.8 5.0 680 516 A 29 CYS HBx A 26 GLN HBx 1.0 1.8 5.0 681 516 A 26 GLN HBx A 29 CYS HBy 1.0 1.8 5.0 682 517 A 26 GLN HBy A 29 CYS HBx 1.0 1.8 5.0 683 517 A 26 GLN HBy A 29 CYS HBy 1.0 1.8 5.0 684 518 A 40 TRP HZ3 A 26 GLN HBx 1.0 1.8 5.0 685 519 A 40 TRP HZ3 A 26 GLN HBy 1.0 1.8 5.0 686 520 A 40 TRP HH2 A 26 GLN HBx 1.0 1.8 5.0 687 520 A 40 TRP HH2 A 26 GLN HBy 1.0 1.8 5.0 688 521 A 41 LEU HG A 26 GLN HBx 1.0 1.8 5.0 689 521 A 26 GLN HBy A 41 LEU HG 1.0 1.8 5.0 690 522 A 41 LEU HD1% A 26 GLN HBx 1.0 1.8 5.0 691 522 A 26 GLN HBy A 41 LEU HD1% 1.0 1.8 5.0 692 523 A 26 GLN HE2y A 26 GLN HGx 1.0 1.8 5.0 693 523 A 26 GLN HE2x A 26 GLN HGx 1.0 1.8 5.0 694 524 A 27 GLU H A 26 GLN HGx 1.0 1.8 5.0 695 525 A 26 GLN HGy A 27 GLU H 1.0 1.8 5.0 696 526 A 40 TRP HZ3 A 26 GLN HGx 1.0 1.8 5.0 697 527 A 40 TRP HZ3 A 26 GLN HGy 1.0 1.8 5.0 698 528 A 41 LEU HD2% A 26 GLN HGx 1.0 1.8 5.0 699 528 A 26 GLN HGy A 41 LEU HD2% 1.0 1.8 5.0 700 529 A 44 TRP HZ2 A 26 GLN HGx 1.0 1.8 5.0 701 529 A 44 TRP HZ2 A 26 GLN HGy 1.0 1.8 5.0 702 530 A 44 TRP HH2 A 26 GLN HGx 1.0 1.8 5.0 703 530 A 26 GLN HGy A 44 TRP HH2 1.0 1.8 5.0 704 531 A 26 GLN HE2y A 41 LEU HD1% 1.0 1.8 5.0 705 532 A 41 LEU HD2% A 26 GLN HE2y 1.0 1.8 5.0 706 533 A 26 GLN HE2x A 41 LEU HD1% 1.0 1.8 5.0 707 534 A 41 LEU HD2% A 26 GLN HE2x 1.0 1.8 5.0 708 535 A 27 GLU H A 27 GLU HA 1.0 1.8 3.5 709 536 A 27 GLU H A 27 GLU HBx 1.0 1.8 5.0 710 537 A 27 GLU H A 27 GLU HBy 1.0 1.8 5.0 711 538 A 27 GLU H A 27 GLU HGy 1.0 1.8 5.0 712 539 A 27 GLU H A 27 GLU HGx 1.0 1.8 5.0 713 540 A 28 ALA H A 27 GLU H 1.0 1.8 3.5 714 541 A 28 ALA HB% A 27 GLU H 1.0 1.8 5.0 715 542 A 27 GLU H A 29 CYS H 1.0 1.8 5.0 716 543 A 28 ALA H A 27 GLU HA 1.0 1.8 5.0 717 544 A 28 ALA HB% A 27 GLU HA 1.0 1.8 5.0 718 545 A 27 GLU HA A 29 CYS H 1.0 1.8 5.0 719 546 A 28 ALA H A 27 GLU HBx 1.0 1.8 5.0 720 547 A 28 ALA H A 27 GLU HBy 1.0 1.8 5.0 721 548 A 28 ALA H A 27 GLU HGx 1.0 1.8 5.0 722 548 A 28 ALA H A 27 GLU HGy 1.0 1.8 5.0 723 549 A 28 ALA H A 28 ALA HA 1.0 1.8 5.0 724 550 A 28 ALA HB% A 28 ALA H 1.0 1.8 5.0 725 551 A 28 ALA H A 29 CYS H 1.0 1.8 3.5 726 552 A 40 TRP HH2 A 28 ALA H 1.0 1.8 5.0 727 553 A 29 CYS H A 28 ALA HA 1.0 1.8 5.0 728 554 A 28 ALA HB% A 29 CYS H 1.0 1.8 5.0 729 555 A 28 ALA HB% A 29 CYS HA 1.0 1.8 5.0 730 556 A 28 ALA HB% A 29 CYS HBy 1.0 1.8 5.0 731 556 A 28 ALA HB% A 29 CYS HBx 1.0 1.8 5.0 732 557 A 30 PRO HDx A 28 ALA HB% 1.0 1.8 5.0 733 558 A 28 ALA HB% A 30 PRO HDy 1.0 1.8 5.0 734 559 A 40 TRP HZ2 A 28 ALA HB% 1.0 1.8 5.0 735 560 A 40 TRP HH2 A 28 ALA HB% 1.0 1.8 5.0 736 561 A 29 CYS H A 29 CYS HA 1.0 1.8 5.0 737 562 A 29 CYS H A 29 CYS HBy 1.0 1.8 3.5 738 563 A 29 CYS H A 29 CYS HBx 1.0 1.8 3.5 739 564 A 30 PRO HDx A 29 CYS H 1.0 1.8 5.0 740 565 A 29 CYS H A 30 PRO HDy 1.0 1.8 5.0 741 566 A 40 TRP HZ2 A 29 CYS H 1.0 1.8 5.0 742 567 A 40 TRP HH2 A 29 CYS H 1.0 1.8 5.0 743 568 A 29 CYS HA A 30 PRO HGx 1.0 1.8 5.0 744 568 A 29 CYS HA A 30 PRO HGy 1.0 1.8 5.0 745 569 A 30 PRO HDx A 29 CYS HA 1.0 1.8 5.0 746 570 A 29 CYS HA A 30 PRO HDy 1.0 1.8 5.0 747 571 A 29 CYS HA A 31 TYR H 1.0 1.8 5.0 748 572 A 31 TYR HD% A 29 CYS HA 1.0 1.8 5.0 749 573 A 40 TRP HD1 A 29 CYS HA 1.0 1.8 5.0 750 574 A 40 TRP HE1 A 29 CYS HA 1.0 1.8 5.0 751 575 A 40 TRP HZ2 A 29 CYS HA 1.0 1.8 5.0 752 576 A 31 TYR H A 29 CYS HBy 1.0 1.8 5.0 753 576 A 29 CYS HBx A 31 TYR H 1.0 1.8 5.0 754 577 A 40 TRP HE3 A 29 CYS HBy 1.0 1.8 5.0 755 577 A 29 CYS HBx A 40 TRP HE3 1.0 1.8 5.0 756 578 A 40 TRP HZ2 A 29 CYS HBy 1.0 1.8 5.0 757 578 A 40 TRP HZ2 A 29 CYS HBx 1.0 1.8 5.0 758 579 A 40 TRP HZ3 A 29 CYS HBy 1.0 1.8 5.0 759 579 A 40 TRP HZ3 A 29 CYS HBx 1.0 1.8 5.0 760 580 A 40 TRP HH2 A 29 CYS HBy 1.0 1.8 5.0 761 580 A 40 TRP HH2 A 29 CYS HBx 1.0 1.8 5.0 762 581 A 31 TYR H A 30 PRO HA 1.0 1.8 5.0 763 582 A 31 TYR H A 30 PRO HBx 1.0 1.8 5.0 764 583 A 31 TYR H A 30 PRO HBy 1.0 1.8 5.0 765 584 A 31 TYR H A 30 PRO HGx 1.0 1.8 5.0 766 584 A 30 PRO HGy A 31 TYR H 1.0 1.8 5.0 767 585 A 31 TYR HD% A 30 PRO HGx 1.0 1.8 5.0 768 585 A 31 TYR HD% A 30 PRO HGy 1.0 1.8 5.0 769 586 A 31 TYR HE% A 30 PRO HGx 1.0 1.8 5.0 770 586 A 31 TYR HE% A 30 PRO HGy 1.0 1.8 5.0 771 587 A 30 PRO HDx A 31 TYR H 1.0 1.8 5.0 772 588 A 31 TYR H A 30 PRO HDy 1.0 1.8 5.0 773 589 A 31 TYR HD% A 30 PRO HDx 1.0 1.8 5.0 774 590 A 31 TYR HD% A 30 PRO HDy 1.0 1.8 5.0 775 591 A 31 TYR HE% A 30 PRO HDy 1.0 1.8 5.0 776 591 A 31 TYR HE% A 30 PRO HDx 1.0 1.8 5.0 777 592 A 40 TRP HE1 A 30 PRO HDx 1.0 1.8 5.0 778 593 A 40 TRP HE1 A 30 PRO HDy 1.0 1.8 5.0 779 594 A 30 PRO HDx A 40 TRP HZ2 1.0 1.8 5.0 780 595 A 40 TRP HZ2 A 30 PRO HDy 1.0 1.8 5.0 781 596 A 31 TYR H A 31 TYR HA 1.0 1.8 5.0 782 597 A 31 TYR H A 31 TYR HBx 1.0 1.8 5.0 783 598 A 31 TYR H A 31 TYR HBy 1.0 1.8 5.0 784 599 A 31 TYR HD% A 31 TYR H 1.0 1.8 5.0 785 600 A 31 TYR H A 32 GLN H 1.0 1.8 5.0 786 601 A 31 TYR HE% A 31 TYR HA 1.0 1.8 5.0 787 602 A 31 TYR HA A 32 GLN H 1.0 1.8 5.0 788 603 A 36 ALA HB% A 31 TYR HA 1.0 1.8 5.0 789 604 A 31 TYR HE% A 31 TYR HBx 1.0 1.8 5.0 790 605 A 31 TYR HE% A 31 TYR HBy 1.0 1.8 5.0 791 606 A 32 GLN H A 31 TYR HBy 1.0 1.8 5.0 792 606 A 32 GLN H A 31 TYR HBx 1.0 1.8 5.0 793 607 A 32 GLN HA A 31 TYR HBy 1.0 1.8 5.0 794 607 A 31 TYR HBx A 32 GLN HA 1.0 1.8 5.0 795 608 A 36 ALA HB% A 31 TYR HBx 1.0 1.8 5.0 796 609 A 36 ALA HB% A 31 TYR HBy 1.0 1.8 5.0 797 610 A 36 ALA HB% A 31 TYR HD% 1.0 1.8 5.0 798 611 A 31 TYR HD% A 40 TRP HBx 1.0 1.8 5.0 799 612 A 31 TYR HD% A 40 TRP HBy 1.0 1.8 5.0 800 613 A 40 TRP HD1 A 31 TYR HD% 1.0 1.8 5.0 801 614 A 31 TYR HD% A 40 TRP HE1 1.0 1.8 5.0 802 615 A 31 TYR HE% A 40 TRP HD1 1.0 1.8 5.0 803 616 A 31 TYR HE% A 40 TRP HE1 1.0 1.8 5.0 804 617 A 32 GLN H A 32 GLN HA 1.0 1.8 5.0 805 618 A 32 GLN H A 32 GLN HBx 1.0 1.8 5.0 806 619 A 32 GLN H A 32 GLN HBy 1.0 1.8 5.0 807 620 A 32 GLN H A 32 GLN HGx 1.0 1.8 5.0 808 620 A 32 GLN H A 32 GLN HGy 1.0 1.8 5.0 809 621 A 32 GLN H A 33 GLN H 1.0 1.8 5.0 810 622 A 36 ALA HB% A 32 GLN H 1.0 1.8 5.0 811 623 A 32 GLN HA A 33 GLN H 1.0 1.8 5.0 812 624 A 32 GLN HBx A 32 GLN HE2y 1.0 1.8 5.0 813 624 A 32 GLN HBy A 32 GLN HE2y 1.0 1.8 5.0 814 624 A 32 GLN HE2x A 32 GLN HBx 1.0 1.8 5.0 815 624 A 32 GLN HBy A 32 GLN HE2x 1.0 1.8 5.0 816 625 A 33 GLN H A 32 GLN HBx 1.0 1.8 5.0 817 625 A 33 GLN H A 32 GLN HBy 1.0 1.8 5.0 818 626 A 35 ASP H A 32 GLN HBx 1.0 1.8 5.0 819 626 A 35 ASP H A 32 GLN HBy 1.0 1.8 5.0 820 627 A 32 GLN HBy A 35 ASP HBy 1.0 1.8 5.0 821 627 A 35 ASP HBx A 32 GLN HBx 1.0 1.8 5.0 822 627 A 35 ASP HBx A 32 GLN HBy 1.0 1.8 5.0 823 627 A 32 GLN HBx A 35 ASP HBy 1.0 1.8 5.0 824 628 A 36 ALA HA A 32 GLN HBx 1.0 1.8 5.0 825 628 A 36 ALA HA A 32 GLN HBy 1.0 1.8 5.0 826 629 A 36 ALA HB% A 32 GLN HBx 1.0 1.8 5.0 827 629 A 36 ALA HB% A 32 GLN HBy 1.0 1.8 5.0 828 630 A 33 GLN H A 32 GLN HGx 1.0 1.8 5.0 829 630 A 32 GLN HGy A 33 GLN H 1.0 1.8 5.0 830 631 A 32 GLN HGx A 33 GLN HGx 1.0 1.8 5.0 831 631 A 32 GLN HGy A 33 GLN HGx 1.0 1.8 5.0 832 631 A 33 GLN HGy A 32 GLN HGx 1.0 1.8 5.0 833 631 A 32 GLN HGy A 33 GLN HGy 1.0 1.8 5.0 834 632 A 34 VAL HG1% A 32 GLN HGx 1.0 1.8 5.0 835 632 A 32 GLN HGy A 34 VAL HG1% 1.0 1.8 5.0 836 633 A 32 GLN HGy A 35 ASP HBy 1.0 1.8 5.0 837 633 A 32 GLN HGx A 35 ASP HBy 1.0 1.8 5.0 838 633 A 35 ASP HBx A 32 GLN HGx 1.0 1.8 5.0 839 633 A 35 ASP HBx A 32 GLN HGy 1.0 1.8 5.0 840 634 A 33 GLN H A 33 GLN HA 1.0 1.8 3.5 841 635 A 33 GLN H A 33 GLN HBx 1.0 1.8 3.5 842 636 A 33 GLN H A 33 GLN HBy 1.0 1.8 3.5 843 637 A 33 GLN H A 33 GLN HGx 1.0 1.8 5.0 844 637 A 33 GLN H A 33 GLN HGy 1.0 1.8 5.0 845 638 A 33 GLN H A 34 VAL H 1.0 1.8 5.0 846 639 A 36 ALA H A 33 GLN H 1.0 1.8 5.0 847 640 A 36 ALA HB% A 33 GLN H 1.0 1.8 5.0 848 641 A 33 GLN HA A 34 VAL H 1.0 1.8 5.0 849 642 A 33 GLN HA A 34 VAL HA 1.0 1.8 5.0 850 643 A 33 GLN HA A 34 VAL HG2% 1.0 1.8 5.0 851 644 A 36 ALA HB% A 33 GLN HA 1.0 1.8 5.0 852 645 A 33 GLN HA A 37 ARG H 1.0 1.8 5.0 853 646 A 34 VAL H A 33 GLN HBx 1.0 1.8 5.0 854 647 A 34 VAL H A 33 GLN HBy 1.0 1.8 5.0 855 648 A 34 VAL HG1% A 33 GLN HBx 1.0 1.8 5.0 856 648 A 34 VAL HG1% A 33 GLN HBy 1.0 1.8 5.0 857 649 A 34 VAL HG2% A 33 GLN HBx 1.0 1.8 5.0 858 649 A 34 VAL HG2% A 33 GLN HBy 1.0 1.8 5.0 859 650 A 35 ASP H A 33 GLN HBx 1.0 1.8 5.0 860 650 A 35 ASP H A 33 GLN HBy 1.0 1.8 5.0 861 651 A 36 ALA HB% A 33 GLN HBx 1.0 1.8 5.0 862 652 A 36 ALA HB% A 33 GLN HBy 1.0 1.8 5.0 863 653 A 34 VAL H A 33 GLN HGx 1.0 1.8 5.0 864 653 A 33 GLN HGy A 34 VAL H 1.0 1.8 5.0 865 654 A 34 VAL HG2% A 33 GLN HGx 1.0 1.8 5.0 866 654 A 33 GLN HGy A 34 VAL HG2% 1.0 1.8 5.0 867 655 A 36 ALA HB% A 33 GLN HGx 1.0 1.8 5.0 868 655 A 36 ALA HB% A 33 GLN HGy 1.0 1.8 5.0 869 656 A 34 VAL H A 34 VAL HA 1.0 1.8 3.5 870 657 A 34 VAL H A 34 VAL HB 1.0 1.8 3.5 871 658 A 34 VAL HG1% A 34 VAL H 1.0 1.8 5.0 872 659 A 34 VAL H A 34 VAL HG2% 1.0 1.8 5.0 873 660 A 35 ASP H A 34 VAL H 1.0 1.8 5.0 874 661 A 35 ASP H A 34 VAL HA 1.0 1.8 5.0 875 662 A 34 VAL HA A 37 ARG H 1.0 1.8 5.0 876 663 A 34 VAL HA A 37 ARG HBx 1.0 1.8 5.0 877 664 A 34 VAL HA A 37 ARG HBy 1.0 1.8 5.0 878 665 A 34 VAL HA A 37 ARG HDx 1.0 1.8 5.0 879 666 A 34 VAL HA A 37 ARG HDy 1.0 1.8 5.0 880 667 A 34 VAL HA A 38 SER H 1.0 1.8 5.0 881 668 A 35 ASP H A 34 VAL HB 1.0 1.8 5.0 882 669 A 35 ASP H A 34 VAL HG1% 1.0 1.8 5.0 883 670 A 35 ASP H A 34 VAL HG2% 1.0 1.8 5.0 884 671 A 35 ASP HA A 34 VAL HG1% 1.0 1.8 5.0 885 672 A 34 VAL HG1% A 37 ARG H 1.0 1.8 5.0 886 673 A 34 VAL HG1% A 37 ARG HBy 1.0 1.8 5.0 887 673 A 34 VAL HG1% A 37 ARG HBx 1.0 1.8 5.0 888 674 A 34 VAL HG1% A 38 SER H 1.0 1.8 5.0 889 675 A 35 ASP H A 35 ASP HA 1.0 1.8 3.5 890 676 A 35 ASP HBx A 35 ASP H 1.0 1.8 5.0 891 677 A 35 ASP H A 35 ASP HBy 1.0 1.8 5.0 892 678 A 35 ASP H A 36 ALA H 1.0 1.8 3.5 893 679 A 36 ALA HB% A 35 ASP H 1.0 1.8 5.0 894 680 A 35 ASP HA A 36 ALA H 1.0 1.8 5.0 895 681 A 35 ASP HA A 38 SER H 1.0 1.8 5.0 896 682 A 35 ASP HA A 39 TYR H 1.0 1.8 5.0 897 683 A 35 ASP HBx A 36 ALA H 1.0 1.8 5.0 898 684 A 36 ALA H A 35 ASP HBy 1.0 1.8 5.0 899 685 A 35 ASP HBx A 36 ALA HA 1.0 1.8 5.0 900 686 A 36 ALA HA A 35 ASP HBy 1.0 1.8 5.0 901 687 A 36 ALA H A 36 ALA HA 1.0 1.8 5.0 902 688 A 36 ALA HB% A 36 ALA H 1.0 1.8 5.0 903 689 A 36 ALA H A 37 ARG H 1.0 1.8 2.9 904 690 A 36 ALA H A 38 SER H 1.0 1.8 5.0 905 691 A 36 ALA HA A 37 ARG H 1.0 1.8 5.0 906 692 A 36 ALA HA A 39 TYR H 1.0 1.8 5.0 907 693 A 39 TYR HBx A 36 ALA HA 1.0 1.8 5.0 908 694 A 36 ALA HA A 39 TYR HBy 1.0 1.8 5.0 909 695 A 36 ALA HA A 40 TRP H 1.0 1.8 5.0 910 696 A 36 ALA HB% A 37 ARG H 1.0 1.8 5.0 911 697 A 36 ALA HB% A 37 ARG HA 1.0 1.8 5.0 912 698 A 36 ALA HB% A 38 SER H 1.0 1.8 5.0 913 699 A 36 ALA HB% A 40 TRP H 1.0 1.8 5.0 914 700 A 36 ALA HB% A 40 TRP HBx 1.0 1.8 5.0 915 701 A 36 ALA HB% A 40 TRP HBy 1.0 1.8 5.0 916 702 A 37 ARG HA A 37 ARG H 1.0 1.8 5.0 917 703 A 37 ARG HBx A 37 ARG H 1.0 1.8 5.0 918 704 A 37 ARG H A 37 ARG HBy 1.0 1.8 5.0 919 705 A 37 ARG HGx A 37 ARG H 1.0 1.8 5.0 920 706 A 37 ARG H A 37 ARG HGy 1.0 1.8 5.0 921 707 A 37 ARG HDx A 37 ARG H 1.0 1.8 5.0 922 708 A 37 ARG H A 37 ARG HDy 1.0 1.8 5.0 923 709 A 37 ARG H A 38 SER H 1.0 1.8 5.0 924 710 A 37 ARG H A 40 TRP H 1.0 1.8 5.0 925 711 A 37 ARG HA A 37 ARG HDx 1.0 1.8 5.0 926 712 A 37 ARG HA A 37 ARG HDy 1.0 1.8 5.0 927 713 A 37 ARG HA A 38 SER H 1.0 1.8 5.0 928 714 A 37 ARG HA A 38 SER HA 1.0 1.8 5.0 929 715 A 37 ARG HA A 40 TRP H 1.0 1.8 5.0 930 716 A 37 ARG HA A 40 TRP HBy 1.0 1.8 5.0 931 716 A 37 ARG HA A 40 TRP HBx 1.0 1.8 5.0 932 717 A 37 ARG HA A 41 LEU H 1.0 1.8 5.0 933 718 A 37 ARG HA A 41 LEU HBx 1.0 1.8 5.0 934 719 A 37 ARG HA A 41 LEU HBy 1.0 1.8 5.0 935 720 A 41 LEU HG A 37 ARG HA 1.0 1.8 5.0 936 721 A 41 LEU HD1% A 37 ARG HA 1.0 1.8 5.0 937 722 A 37 ARG HDx A 37 ARG HBy 1.0 1.8 5.0 938 722 A 37 ARG HBy A 37 ARG HDy 1.0 1.8 5.0 939 723 A 37 ARG HBx A 37 ARG HE 1.0 1.8 5.0 940 724 A 37 ARG HE A 37 ARG HBy 1.0 1.8 5.0 941 725 A 37 ARG HBx A 38 SER H 1.0 1.8 5.0 942 726 A 38 SER H A 37 ARG HBy 1.0 1.8 5.0 943 727 A 41 LEU HD1% A 37 ARG HBy 1.0 1.8 5.0 944 727 A 41 LEU HD1% A 37 ARG HBx 1.0 1.8 5.0 945 728 A 37 ARG HE A 37 ARG HGx 1.0 1.8 5.0 946 729 A 37 ARG HE A 37 ARG HGy 1.0 1.8 5.0 947 730 A 37 ARG HGx A 38 SER H 1.0 1.8 5.0 948 730 A 38 SER H A 37 ARG HGy 1.0 1.8 5.0 949 731 A 41 LEU H A 37 ARG HGy 1.0 1.8 5.0 950 731 A 37 ARG HGx A 41 LEU H 1.0 1.8 5.0 951 732 A 37 ARG HGy A 41 LEU HBx 1.0 1.8 5.0 952 732 A 37 ARG HGx A 41 LEU HBx 1.0 1.8 5.0 953 732 A 41 LEU HBy A 37 ARG HGy 1.0 1.8 5.0 954 732 A 37 ARG HGx A 41 LEU HBy 1.0 1.8 5.0 955 733 A 41 LEU HD1% A 37 ARG HGx 1.0 1.8 5.0 956 734 A 41 LEU HD1% A 37 ARG HGy 1.0 1.8 5.0 957 735 A 37 ARG HDy A 41 LEU HBx 1.0 1.8 5.0 958 735 A 37 ARG HDx A 41 LEU HBx 1.0 1.8 5.0 959 735 A 41 LEU HBy A 37 ARG HDy 1.0 1.8 5.0 960 735 A 37 ARG HDx A 41 LEU HBy 1.0 1.8 5.0 961 736 A 41 LEU HD1% A 37 ARG HDx 1.0 1.8 5.0 962 737 A 41 LEU HD1% A 37 ARG HDy 1.0 1.8 5.0 963 738 A 41 LEU HD1% A 37 ARG HE 1.0 1.8 5.0 964 739 A 38 SER HA A 38 SER H 1.0 1.8 5.0 965 740 A 38 SER H A 39 TYR H 1.0 1.8 5.0 966 741 A 38 SER H A 40 TRP H 1.0 1.8 5.0 967 742 A 41 LEU HBy A 38 SER H 1.0 1.8 5.0 968 742 A 38 SER H A 41 LEU HBx 1.0 1.8 5.0 969 743 A 38 SER HA A 39 TYR H 1.0 1.8 5.0 970 744 A 39 TYR HA A 39 TYR H 1.0 1.8 3.5 971 745 A 39 TYR HBx A 39 TYR H 1.0 1.8 5.0 972 746 A 39 TYR H A 39 TYR HBy 1.0 1.8 5.0 973 747 A 39 TYR HD% A 39 TYR H 1.0 1.8 5.0 974 748 A 39 TYR H A 40 TRP H 1.0 1.8 3.5 975 749 A 39 TYR HE% A 39 TYR HA 1.0 1.8 5.0 976 750 A 39 TYR HA A 40 TRP H 1.0 1.8 5.0 977 751 A 39 TYR HA A 42 GLY H 1.0 1.8 5.0 978 752 A 39 TYR HBx A 39 TYR HE% 1.0 1.8 5.0 979 753 A 39 TYR HE% A 39 TYR HBy 1.0 1.8 5.0 980 754 A 39 TYR HBx A 40 TRP H 1.0 1.8 5.0 981 755 A 40 TRP H A 39 TYR HBy 1.0 1.8 5.0 982 756 A 39 TYR HD% A 40 TRP H 1.0 1.8 5.0 983 757 A 40 TRP HA A 40 TRP H 1.0 1.8 5.0 984 758 A 40 TRP HBx A 40 TRP H 1.0 1.8 5.0 985 759 A 40 TRP H A 40 TRP HBy 1.0 1.8 5.0 986 760 A 40 TRP HD1 A 40 TRP H 1.0 1.8 5.0 987 761 A 40 TRP H A 41 LEU H 1.0 1.8 3.5 988 762 A 41 LEU HBy A 40 TRP H 1.0 1.8 5.0 989 762 A 40 TRP H A 41 LEU HBx 1.0 1.8 5.0 990 763 A 42 GLY H A 40 TRP H 1.0 1.8 5.0 991 764 A 40 TRP HD1 A 40 TRP HA 1.0 1.8 5.0 992 765 A 40 TRP HA A 41 LEU H 1.0 1.8 5.0 993 766 A 40 TRP HA A 42 GLY H 1.0 1.8 5.0 994 767 A 40 TRP HA A 43 GLY H 1.0 1.8 5.0 995 768 A 40 TRP HA A 44 TRP H 1.0 1.8 5.0 996 769 A 40 TRP HD1 A 40 TRP HBx 1.0 1.8 5.0 997 770 A 40 TRP HD1 A 40 TRP HBy 1.0 1.8 5.0 998 771 A 40 TRP HE3 A 40 TRP HBx 1.0 1.8 5.0 999 772 A 40 TRP HE3 A 40 TRP HBy 1.0 1.8 5.0 1000 773 A 40 TRP HBx A 41 LEU H 1.0 1.8 5.0 1001 774 A 41 LEU H A 40 TRP HBy 1.0 1.8 5.0 1002 775 A 40 TRP HE3 A 41 LEU H 1.0 1.8 5.0 1003 776 A 40 TRP HE3 A 41 LEU HA 1.0 1.8 5.0 1004 777 A 40 TRP HE3 A 41 LEU HBx 1.0 1.8 5.0 1005 778 A 40 TRP HE3 A 41 LEU HBy 1.0 1.8 5.0 1006 779 A 41 LEU HG A 40 TRP HE3 1.0 1.8 5.0 1007 780 A 41 LEU HD2% A 40 TRP HE3 1.0 1.8 5.0 1008 781 A 40 TRP HZ3 A 41 LEU HA 1.0 1.8 5.0 1009 782 A 40 TRP HZ3 A 41 LEU HG 1.0 1.8 5.0 1010 783 A 40 TRP HZ3 A 41 LEU HD1% 1.0 1.8 5.0 1011 784 A 40 TRP HZ3 A 41 LEU HD2% 1.0 1.8 5.0 1012 785 A 40 TRP HZ3 A 44 TRP HBy 1.0 1.8 5.0 1013 785 A 40 TRP HZ3 A 44 TRP HBx 1.0 1.8 5.0 1014 786 A 40 TRP HH2 A 44 TRP HD1 1.0 1.8 5.0 1015 787 A 41 LEU HA A 41 LEU H 1.0 1.8 5.0 1016 788 A 41 LEU H A 41 LEU HBx 1.0 1.8 5.0 1017 789 A 41 LEU HBy A 41 LEU H 1.0 1.8 5.0 1018 790 A 41 LEU HG A 41 LEU H 1.0 1.8 5.0 1019 791 A 41 LEU HD1% A 41 LEU H 1.0 1.8 5.0 1020 792 A 41 LEU HD2% A 41 LEU H 1.0 1.8 5.0 1021 793 A 42 GLY H A 41 LEU H 1.0 1.8 3.5 1022 794 A 41 LEU HD1% A 41 LEU HA 1.0 1.8 5.0 1023 795 A 41 LEU HD2% A 41 LEU HA 1.0 1.8 5.0 1024 796 A 42 GLY H A 41 LEU HA 1.0 1.8 5.0 1025 797 A 41 LEU HA A 44 TRP H 1.0 1.8 5.0 1026 798 A 41 LEU HA A 44 TRP HBx 1.0 1.8 5.0 1027 799 A 41 LEU HA A 44 TRP HBy 1.0 1.8 5.0 1028 800 A 41 LEU HA A 44 TRP HE3 1.0 1.8 5.0 1029 801 A 41 LEU HA A 45 ARG H 1.0 1.8 5.0 1030 802 A 42 GLY H A 41 LEU HBx 1.0 1.8 5.0 1031 803 A 41 LEU HBy A 42 GLY H 1.0 1.8 5.0 1032 804 A 41 LEU HD2% A 42 GLY H 1.0 1.8 5.0 1033 805 A 41 LEU HD2% A 42 GLY HAy 1.0 1.8 5.0 1034 805 A 41 LEU HD2% A 42 GLY HAx 1.0 1.8 5.0 1035 806 A 41 LEU HD2% A 44 TRP H 1.0 1.8 5.0 1036 807 A 41 LEU HD2% A 44 TRP HBx 1.0 1.8 5.0 1037 808 A 41 LEU HD2% A 44 TRP HBy 1.0 1.8 5.0 1038 809 A 41 LEU HD2% A 44 TRP HE3 1.0 1.8 5.0 1039 810 A 41 LEU HD2% A 44 TRP HZ3 1.0 1.8 5.0 1040 811 A 41 LEU HD2% A 45 ARG H 1.0 1.8 5.0 1041 812 A 41 LEU HD2% A 45 ARG HGy 1.0 1.8 5.0 1042 813 A 41 LEU HD2% A 45 ARG HGx 1.0 1.8 5.0 1043 814 A 42 GLY H A 42 GLY HAx 1.0 1.8 3.5 1044 815 A 42 GLY H A 42 GLY HAy 1.0 1.8 3.5 1045 816 A 43 GLY H A 42 GLY HAx 1.0 1.8 5.0 1046 817 A 43 GLY H A 42 GLY HAy 1.0 1.8 5.0 1047 818 A 43 GLY HAx A 42 GLY HAx 1.0 1.8 5.0 1048 818 A 42 GLY HAx A 43 GLY HAy 1.0 1.8 5.0 1049 819 A 43 GLY HAx A 42 GLY HAy 1.0 1.8 5.0 1050 819 A 42 GLY HAy A 43 GLY HAy 1.0 1.8 5.0 1051 820 A 42 GLY HAx A 45 ARG H 1.0 1.8 5.0 1052 821 A 45 ARG H A 42 GLY HAy 1.0 1.8 5.0 1053 822 A 42 GLY HAx A 45 ARG HBx 1.0 1.8 5.0 1054 822 A 42 GLY HAx A 45 ARG HBy 1.0 1.8 5.0 1055 823 A 45 ARG HBx A 42 GLY HAy 1.0 1.8 5.0 1056 823 A 42 GLY HAy A 45 ARG HBy 1.0 1.8 5.0 1057 824 A 46 ASP H A 42 GLY HAy 1.0 1.8 5.0 1058 824 A 42 GLY HAx A 46 ASP H 1.0 1.8 5.0 1059 825 A 43 GLY HAx A 43 GLY H 1.0 1.8 5.0 1060 826 A 43 GLY H A 43 GLY HAy 1.0 1.8 5.0 1061 827 A 43 GLY H A 44 TRP H 1.0 1.8 3.5 1062 828 A 43 GLY H A 44 TRP HBy 1.0 1.8 5.0 1063 828 A 43 GLY H A 44 TRP HBx 1.0 1.8 5.0 1064 829 A 43 GLY H A 45 ARG H 1.0 1.8 5.0 1065 830 A 43 GLY HAx A 44 TRP H 1.0 1.8 5.0 1066 831 A 44 TRP H A 43 GLY HAy 1.0 1.8 5.0 1067 832 A 43 GLY HAx A 46 ASP HBx 1.0 1.8 5.0 1068 833 A 43 GLY HAx A 46 ASP HBy 1.0 1.8 5.0 1069 834 A 46 ASP HBx A 43 GLY HAy 1.0 1.8 5.0 1070 835 A 43 GLY HAy A 46 ASP HBy 1.0 1.8 5.0 1071 836 A 44 TRP HA A 44 TRP H 1.0 1.8 3.5 1072 837 A 44 TRP HBx A 44 TRP H 1.0 1.8 5.0 1073 838 A 44 TRP H A 44 TRP HBy 1.0 1.8 5.0 1074 839 A 44 TRP H A 45 ARG H 1.0 1.8 3.5 1075 840 A 44 TRP H A 47 ALA H 1.0 1.8 5.0 1076 841 A 44 TRP HA A 44 TRP HD1 1.0 1.8 5.0 1077 842 A 44 TRP HA A 44 TRP HE3 1.0 1.8 5.0 1078 843 A 44 TRP HA A 45 ARG H 1.0 1.8 5.0 1079 844 A 44 TRP HA A 47 ALA H 1.0 1.8 5.0 1080 845 A 47 ALA HB% A 44 TRP HA 1.0 1.8 5.0 1081 846 A 44 TRP HA A 48 ARG H 1.0 1.8 5.0 1082 847 A 44 TRP HD1 A 44 TRP HBx 1.0 1.8 5.0 1083 848 A 44 TRP HD1 A 44 TRP HBy 1.0 1.8 5.0 1084 849 A 44 TRP HBx A 44 TRP HE3 1.0 1.8 5.0 1085 850 A 44 TRP HE3 A 44 TRP HBy 1.0 1.8 5.0 1086 851 A 44 TRP HBx A 45 ARG H 1.0 1.8 5.0 1087 852 A 45 ARG H A 44 TRP HBy 1.0 1.8 5.0 1088 853 A 44 TRP HE3 A 45 ARG H 1.0 1.8 5.0 1089 854 A 44 TRP HE3 A 45 ARG HA 1.0 1.8 5.0 1090 855 A 44 TRP HE3 A 45 ARG HGy 1.0 1.8 5.0 1091 856 A 44 TRP HE3 A 45 ARG HGx 1.0 1.8 5.0 1092 857 A 44 TRP HZ3 A 45 ARG HGy 1.0 1.8 5.0 1093 858 A 44 TRP HZ3 A 45 ARG HGx 1.0 1.8 5.0 1094 859 A 44 TRP HZ3 A 45 ARG HDy 1.0 1.8 5.0 1095 859 A 44 TRP HZ3 A 45 ARG HDx 1.0 1.8 5.0 1096 860 A 44 TRP HH2 A 48 ARG HGy 1.0 1.8 5.0 1097 860 A 44 TRP HH2 A 48 ARG HGx 1.0 1.8 5.0 1098 861 A 45 ARG HA A 45 ARG H 1.0 1.8 5.0 1099 862 A 45 ARG HBx A 45 ARG H 1.0 1.8 5.0 1100 863 A 45 ARG H A 45 ARG HBy 1.0 1.8 5.0 1101 864 A 45 ARG HGy A 45 ARG H 1.0 1.8 5.0 1102 865 A 45 ARG HGx A 45 ARG H 1.0 1.8 5.0 1103 866 A 45 ARG H A 46 ASP H 1.0 1.8 3.5 1104 867 A 45 ARG H A 47 ALA H 1.0 1.8 5.0 1105 868 A 45 ARG HA A 45 ARG HDx 1.0 1.8 5.0 1106 869 A 45 ARG HA A 45 ARG HDy 1.0 1.8 5.0 1107 870 A 45 ARG HA A 46 ASP H 1.0 1.8 5.0 1108 871 A 45 ARG HA A 48 ARG H 1.0 1.8 5.0 1109 872 A 45 ARG HA A 48 ARG HBx 1.0 1.8 5.0 1110 872 A 45 ARG HA A 48 ARG HBy 1.0 1.8 5.0 1111 873 A 45 ARG HA A 48 ARG HGy 1.0 1.8 5.0 1112 873 A 45 ARG HA A 48 ARG HGx 1.0 1.8 5.0 1113 874 A 45 ARG HA A 49 ASP H 1.0 1.8 5.0 1114 875 A 45 ARG HBx A 45 ARG HDx 1.0 1.8 5.0 1115 876 A 45 ARG HBx A 45 ARG HDy 1.0 1.8 5.0 1116 877 A 45 ARG HDx A 45 ARG HBy 1.0 1.8 5.0 1117 878 A 45 ARG HBy A 45 ARG HDy 1.0 1.8 5.0 1118 879 A 45 ARG HBx A 45 ARG HE 1.0 1.8 5.0 1119 880 A 45 ARG HE A 45 ARG HBy 1.0 1.8 5.0 1120 881 A 45 ARG HBx A 46 ASP H 1.0 1.8 5.0 1121 882 A 46 ASP H A 45 ARG HBy 1.0 1.8 5.0 1122 883 A 45 ARG HGy A 45 ARG HE 1.0 1.8 5.0 1123 884 A 45 ARG HGx A 45 ARG HE 1.0 1.8 5.0 1124 885 A 46 ASP HA A 46 ASP H 1.0 1.8 3.5 1125 886 A 46 ASP HBx A 46 ASP H 1.0 1.8 5.0 1126 887 A 46 ASP H A 46 ASP HBy 1.0 1.8 5.0 1127 888 A 46 ASP H A 47 ALA H 1.0 1.8 3.5 1128 889 A 47 ALA HB% A 46 ASP H 1.0 1.8 5.0 1129 890 A 46 ASP H A 48 ARG H 1.0 1.8 5.0 1130 891 A 46 ASP HA A 47 ALA H 1.0 1.8 5.0 1131 892 A 46 ASP HA A 48 ARG H 1.0 1.8 5.0 1132 893 A 46 ASP HA A 49 ASP H 1.0 1.8 5.0 1133 894 A 46 ASP HA A 49 ASP HBx 1.0 1.8 5.0 1134 894 A 46 ASP HA A 49 ASP HBy 1.0 1.8 5.0 1135 895 A 46 ASP HA A 50 GLU H 1.0 1.8 5.0 1136 896 A 46 ASP HBx A 47 ALA H 1.0 1.8 5.0 1137 897 A 47 ALA H A 46 ASP HBy 1.0 1.8 5.0 1138 898 A 47 ALA HB% A 46 ASP HBy 1.0 1.8 5.0 1139 898 A 47 ALA HB% A 46 ASP HBx 1.0 1.8 5.0 1140 899 A 47 ALA HA A 47 ALA H 1.0 1.8 5.0 1141 900 A 47 ALA HB% A 47 ALA H 1.0 1.8 5.0 1142 901 A 47 ALA H A 48 ARG H 1.0 1.8 3.5 1143 902 A 47 ALA H A 49 ASP H 1.0 1.8 5.0 1144 903 A 47 ALA HA A 48 ARG H 1.0 1.8 5.0 1145 904 A 47 ALA HA A 50 GLU H 1.0 1.8 5.0 1146 905 A 47 ALA HA A 50 GLU HBx 1.0 1.8 5.0 1147 905 A 47 ALA HA A 50 GLU HBy 1.0 1.8 5.0 1148 906 A 47 ALA HA A 50 GLU HGx 1.0 1.8 5.0 1149 906 A 47 ALA HA A 50 GLU HGy 1.0 1.8 5.0 1150 907 A 47 ALA HA A 51 LYS H 1.0 1.8 5.0 1151 908 A 47 ALA HB% A 48 ARG H 1.0 1.8 5.0 1152 909 A 48 ARG HA A 48 ARG H 1.0 1.8 3.5 1153 910 A 48 ARG HBy A 48 ARG H 1.0 1.8 5.0 1154 910 A 48 ARG H A 48 ARG HBx 1.0 1.8 5.0 1155 911 A 48 ARG HGx A 48 ARG H 1.0 1.8 5.0 1156 912 A 48 ARG H A 48 ARG HGy 1.0 1.8 5.0 1157 913 A 48 ARG HDx A 48 ARG H 1.0 1.8 5.0 1158 914 A 48 ARG HDy A 48 ARG H 1.0 1.8 5.0 1159 915 A 48 ARG H A 49 ASP H 1.0 1.8 3.5 1160 916 A 49 ASP HBy A 48 ARG H 1.0 1.8 5.0 1161 916 A 48 ARG H A 49 ASP HBx 1.0 1.8 5.0 1162 917 A 48 ARG H A 50 GLU H 1.0 1.8 5.0 1163 918 A 48 ARG HA A 48 ARG HDx 1.0 1.8 5.0 1164 919 A 48 ARG HA A 48 ARG HDy 1.0 1.8 5.0 1165 920 A 48 ARG HA A 49 ASP H 1.0 1.8 5.0 1166 921 A 48 ARG HA A 51 LYS H 1.0 1.8 5.0 1167 922 A 48 ARG HA A 51 LYS HBx 1.0 1.8 5.0 1168 922 A 48 ARG HA A 51 LYS HBy 1.0 1.8 5.0 1169 923 A 48 ARG HA A 51 LYS HDx 1.0 1.8 5.0 1170 923 A 48 ARG HA A 51 LYS HDy 1.0 1.8 5.0 1171 924 A 48 ARG HA A 52 GLN H 1.0 1.8 5.0 1172 925 A 48 ARG HDx A 48 ARG HBx 1.0 1.8 5.0 1173 925 A 48 ARG HBy A 48 ARG HDx 1.0 1.8 5.0 1174 926 A 48 ARG HDy A 48 ARG HBx 1.0 1.8 5.0 1175 926 A 48 ARG HBy A 48 ARG HDy 1.0 1.8 5.0 1176 927 A 48 ARG HE A 48 ARG HBx 1.0 1.8 5.0 1177 927 A 48 ARG HBy A 48 ARG HE 1.0 1.8 5.0 1178 928 A 49 ASP H A 48 ARG HBx 1.0 1.8 5.0 1179 928 A 48 ARG HBy A 49 ASP H 1.0 1.8 5.0 1180 929 A 48 ARG HGx A 48 ARG HE 1.0 1.8 5.0 1181 930 A 48 ARG HE A 48 ARG HGy 1.0 1.8 5.0 1182 931 A 49 ASP H A 48 ARG HGy 1.0 1.8 5.0 1183 931 A 48 ARG HGx A 49 ASP H 1.0 1.8 5.0 1184 932 A 49 ASP HA A 49 ASP H 1.0 1.8 3.5 1185 933 A 49 ASP HBy A 49 ASP H 1.0 1.8 5.0 1186 933 A 49 ASP H A 49 ASP HBx 1.0 1.8 5.0 1187 934 A 49 ASP H A 50 GLU H 1.0 1.8 5.0 1188 935 A 50 GLU HBy A 49 ASP H 1.0 1.8 5.0 1189 935 A 49 ASP H A 50 GLU HBx 1.0 1.8 5.0 1190 936 A 49 ASP H A 51 LYS H 1.0 1.8 5.0 1191 937 A 49 ASP HA A 50 GLU H 1.0 1.8 5.0 1192 938 A 49 ASP HA A 52 GLN H 1.0 1.8 5.0 1193 939 A 49 ASP HA A 52 GLN HBy 1.0 1.8 5.0 1194 939 A 49 ASP HA A 52 GLN HBx 1.0 1.8 5.0 1195 940 A 49 ASP HA A 53 SER H 1.0 1.8 5.0 1196 941 A 49 ASP HBy A 50 GLU H 1.0 1.8 5.0 1197 941 A 50 GLU H A 49 ASP HBx 1.0 1.8 5.0 1198 942 A 50 GLU HA A 50 GLU H 1.0 1.8 3.5 1199 943 A 50 GLU HBy A 50 GLU H 1.0 1.8 3.5 1200 943 A 50 GLU H A 50 GLU HBx 1.0 1.8 3.5 1201 944 A 50 GLU HGy A 50 GLU H 1.0 1.8 5.0 1202 945 A 50 GLU H A 50 GLU HGx 1.0 1.8 5.0 1203 946 A 50 GLU H A 51 LYS H 1.0 1.8 2.9 1204 947 A 50 GLU H A 52 GLN H 1.0 1.8 2.9 1205 948 A 52 GLN HBx A 50 GLU H 1.0 1.8 5.0 1206 948 A 50 GLU H A 52 GLN HBy 1.0 1.8 5.0 1207 949 A 50 GLU HA A 51 LYS H 1.0 1.8 5.0 1208 950 A 50 GLU HA A 53 SER H 1.0 1.8 5.0 1209 951 A 50 GLU HBy A 51 LYS H 1.0 1.8 3.5 1210 951 A 51 LYS H A 50 GLU HBx 1.0 1.8 3.5 1211 952 A 50 GLU HBy A 52 GLN H 1.0 1.8 5.0 1212 952 A 52 GLN H A 50 GLU HBx 1.0 1.8 5.0 1213 953 A 50 GLU HGy A 51 LYS H 1.0 1.8 5.0 1214 954 A 51 LYS H A 50 GLU HGx 1.0 1.8 5.0 1215 955 A 51 LYS HA A 51 LYS H 1.0 1.8 5.0 1216 956 A 51 LYS HBy A 51 LYS H 1.0 1.8 2.9 1217 956 A 51 LYS H A 51 LYS HBx 1.0 1.8 2.9 1218 957 A 51 LYS HGx A 51 LYS H 1.0 1.8 5.0 1219 958 A 51 LYS H A 51 LYS HGy 1.0 1.8 5.0 1220 959 A 51 LYS HDy A 51 LYS H 1.0 1.8 5.0 1221 959 A 51 LYS H A 51 LYS HDx 1.0 1.8 5.0 1222 960 A 51 LYS H A 52 GLN H 1.0 1.8 2.9 1223 961 A 52 GLN HBx A 51 LYS H 1.0 1.8 3.5 1224 961 A 51 LYS H A 52 GLN HBy 1.0 1.8 3.5 1225 962 A 51 LYS HA A 51 LYS HDx 1.0 1.8 5.0 1226 962 A 51 LYS HDy A 51 LYS HA 1.0 1.8 5.0 1227 963 A 51 LYS HA A 52 GLN H 1.0 1.8 3.5 1228 964 A 51 LYS HEx A 51 LYS HBx 1.0 1.8 5.0 1229 964 A 51 LYS HBy A 51 LYS HEx 1.0 1.8 5.0 1230 965 A 51 LYS HEy A 51 LYS HBx 1.0 1.8 5.0 1231 965 A 51 LYS HBy A 51 LYS HEy 1.0 1.8 5.0 1232 966 A 52 GLN H A 51 LYS HBx 1.0 1.8 3.5 1233 966 A 51 LYS HBy A 52 GLN H 1.0 1.8 3.5 1234 967 A 51 LYS HEy A 51 LYS HGy 1.0 1.8 5.0 1235 967 A 51 LYS HEy A 51 LYS HGx 1.0 1.8 5.0 1236 968 A 51 LYS HGx A 52 GLN H 1.0 1.8 5.0 1237 969 A 52 GLN H A 51 LYS HGy 1.0 1.8 5.0 1238 970 A 52 GLN HA A 52 GLN H 1.0 1.8 3.5 1239 971 A 52 GLN HBx A 52 GLN H 1.0 1.8 3.5 1240 971 A 52 GLN H A 52 GLN HBy 1.0 1.8 3.5 1241 972 A 52 GLN HGy A 52 GLN H 1.0 1.8 5.0 1242 972 A 52 GLN H A 52 GLN HGx 1.0 1.8 5.0 1243 973 A 52 GLN H A 53 SER H 1.0 1.8 2.9 1244 974 A 54 GLY H A 52 GLN H 1.0 1.8 5.0 1245 975 A 52 GLN HA A 53 SER H 1.0 1.8 3.5 1246 976 A 52 GLN HA A 54 GLY H 1.0 1.8 5.0 1247 977 A 52 GLN HBx A 53 SER H 1.0 1.8 3.5 1248 977 A 53 SER H A 52 GLN HBy 1.0 1.8 3.5 1249 978 A 52 GLN HBx A 53 SER HBx 1.0 1.8 5.0 1250 978 A 52 GLN HBy A 53 SER HBx 1.0 1.8 5.0 1251 978 A 53 SER HBy A 52 GLN HBy 1.0 1.8 5.0 1252 978 A 52 GLN HBx A 53 SER HBy 1.0 1.8 5.0 1253 979 A 53 SER H A 52 GLN HGx 1.0 1.8 5.0 1254 979 A 52 GLN HGy A 53 SER H 1.0 1.8 5.0 1255 980 A 53 SER HA A 53 SER H 1.0 1.8 3.5 1256 981 A 53 SER HBy A 53 SER H 1.0 1.8 3.5 1257 981 A 53 SER H A 53 SER HBx 1.0 1.8 3.5 1258 982 A 54 GLY H A 53 SER H 1.0 1.8 5.0 1259 983 A 54 GLY H A 53 SER HA 1.0 1.8 3.5 1260 984 A 53 SER HA A 55 LEU H 1.0 1.8 5.0 1261 985 A 54 GLY H A 53 SER HBx 1.0 1.8 5.0 1262 985 A 54 GLY H A 53 SER HBy 1.0 1.8 5.0 1263 986 A 55 LEU H A 53 SER HBx 1.0 1.8 5.0 1264 986 A 53 SER HBy A 55 LEU H 1.0 1.8 5.0 1265 987 A 54 GLY H A 54 GLY HAy 1.0 1.8 5.0 1266 987 A 54 GLY H A 54 GLY HAx 1.0 1.8 5.0 1267 988 A 54 GLY H A 55 LEU H 1.0 1.8 3.5 1268 989 A 54 GLY H A 56 TYR H 1.0 1.8 5.0 1269 990 A 55 LEU H A 54 GLY HAy 1.0 1.8 5.0 1270 990 A 55 LEU H A 54 GLY HAx 1.0 1.8 5.0 1271 991 A 55 LEU HD1% A 54 GLY HAy 1.0 1.8 5.0 1272 991 A 54 GLY HAx A 55 LEU HD1% 1.0 1.8 5.0 1273 992 A 56 TYR H A 54 GLY HAy 1.0 1.8 5.0 1274 992 A 54 GLY HAx A 56 TYR H 1.0 1.8 5.0 1275 993 A 55 LEU H A 55 LEU HA 1.0 1.8 3.5 1276 994 A 55 LEU H A 55 LEU HBx 1.0 1.8 5.0 1277 995 A 55 LEU H A 55 LEU HBy 1.0 1.8 5.0 1278 996 A 55 LEU H A 55 LEU HG 1.0 1.8 5.0 1279 997 A 55 LEU H A 55 LEU HD1% 1.0 1.8 5.0 1280 998 A 55 LEU H A 55 LEU HD2% 1.0 1.8 5.0 1281 999 A 55 LEU H A 56 TYR H 1.0 1.8 3.5 1282 1000 A 55 LEU HD1% A 55 LEU HA 1.0 1.8 5.0 1283 1001 A 55 LEU HA A 55 LEU HD2% 1.0 1.8 5.0 1284 1002 A 56 TYR H A 55 LEU HA 1.0 1.8 3.5 1285 1003 A 56 TYR H A 55 LEU HBx 1.0 1.8 5.0 1286 1004 A 56 TYR H A 55 LEU HBy 1.0 1.8 5.0 1287 1005 A 57 LYS H A 55 LEU HBx 1.0 1.8 3.5 1288 1005 A 55 LEU HBy A 57 LYS H 1.0 1.8 3.5 1289 1006 A 56 TYR H A 55 LEU HD2% 1.0 1.8 5.0 1290 1007 A 56 TYR H A 56 TYR HA 1.0 1.8 3.5 1291 1008 A 56 TYR H A 56 TYR HBx 1.0 1.8 3.5 1292 1009 A 56 TYR H A 56 TYR HBy 1.0 1.8 3.5 1293 1010 A 56 TYR H A 56 TYR HD% 1.0 1.8 5.0 1294 1011 A 57 LYS H A 56 TYR HA 1.0 1.8 3.5 1295 1012 A 56 TYR HBx A 56 TYR HE% 1.0 1.8 5.0 1296 1013 A 56 TYR HBy A 56 TYR HE% 1.0 1.8 5.0 1297 1014 A 57 LYS H A 56 TYR HBx 1.0 1.8 5.0 1298 1015 A 57 LYS H A 56 TYR HBy 1.0 1.8 5.0 1299 1016 A 57 LYS H A 56 TYR HD% 1.0 1.8 5.0 1300 1017 A 56 TYR HD% A 57 LYS HA 1.0 1.8 5.0 1301 1018 A 57 LYS H A 57 LYS HA 1.0 1.8 5.0 1302 1019 A 57 LYS H A 57 LYS HBx 1.0 1.8 5.0 1303 1020 A 57 LYS H A 57 LYS HBy 1.0 1.8 5.0 1304 1021 A 57 LYS H A 57 LYS HGy 1.0 1.8 5.0 1305 1021 A 57 LYS H A 57 LYS HGx 1.0 1.8 5.0 1306 1022 A 57 LYS H A 58 LEU H 1.0 1.8 2.9 1307 1023 A 57 LYS HA A 57 LYS HDx 1.0 1.8 5.0 1308 1023 A 57 LYS HA A 57 LYS HDy 1.0 1.8 5.0 1309 1024 A 57 LYS HA A 57 LYS HEx 1.0 1.8 5.0 1310 1024 A 57 LYS HA A 57 LYS HEy 1.0 1.8 5.0 1311 1025 A 57 LYS HA A 58 LEU H 1.0 1.8 5.0 1312 1026 A 57 LYS HBx A 57 LYS HEx 1.0 1.8 5.0 1313 1026 A 57 LYS HBx A 57 LYS HEy 1.0 1.8 5.0 1314 1027 A 57 LYS HBy A 57 LYS HEx 1.0 1.8 5.0 1315 1027 A 57 LYS HBy A 57 LYS HEy 1.0 1.8 5.0 1316 1028 A 57 LYS HBx A 58 LEU H 1.0 1.8 5.0 1317 1029 A 57 LYS HBy A 58 LEU H 1.0 1.8 5.0 1318 1030 A 58 LEU H A 57 LYS HGy 1.0 1.8 5.0 1319 1030 A 57 LYS HGx A 58 LEU H 1.0 1.8 5.0 1320 1031 A 58 LEU H A 58 LEU HA 1.0 1.8 5.0 1321 1032 A 58 LEU H A 58 LEU HBx 1.0 1.8 3.5 1322 1033 A 58 LEU H A 58 LEU HBy 1.0 1.8 3.5 1323 1034 A 58 LEU H A 58 LEU HG 1.0 1.8 5.0 1324 1035 A 58 LEU H A 58 LEU HD1% 1.0 1.8 5.0 1325 1036 A 58 LEU H A 58 LEU HD2% 1.0 1.8 5.0 1326 1037 A 58 LEU H A 59 GLU H 1.0 1.8 5.0 1327 1038 A 58 LEU HA A 58 LEU HD1% 1.0 1.8 5.0 1328 1039 A 58 LEU HA A 58 LEU HD2% 1.0 1.8 5.0 1329 1040 A 58 LEU HA A 59 GLU H 1.0 1.8 3.5 1330 1041 A 58 LEU HBx A 59 GLU H 1.0 1.8 3.5 1331 1042 A 58 LEU HBy A 59 GLU H 1.0 1.8 3.5 1332 1043 A 58 LEU HG A 59 GLU H 1.0 1.8 5.0 1333 1044 A 58 LEU HD2% A 59 GLU H 1.0 1.8 5.0 1334 1045 A 59 GLU H A 59 GLU HA 1.0 1.8 3.5 1335 1046 A 59 GLU H A 59 GLU HBx 1.0 1.8 3.5 1336 1046 A 59 GLU H A 59 GLU HBy 1.0 1.8 3.5 1337 1047 A 59 GLU H A 59 GLU HGx 1.0 1.8 5.0 1338 1047 A 59 GLU H A 59 GLU HGy 1.0 1.8 5.0 1339 1048 A 59 GLU HA A 60 HIS H 1.0 1.8 5.0 1340 1049 A 60 HIS H A 59 GLU HBx 1.0 1.8 5.0 1341 1049 A 59 GLU HBy A 60 HIS H 1.0 1.8 5.0 1342 1050 A 40 TRP HD1 A 15 GLN HBx 1.0 1.8 5.0 1343 1051 A 15 GLN HBy A 40 TRP HD1 1.0 1.8 5.0 1344 1052 A 40 TRP HE1 A 15 GLN HBx 1.0 1.8 5.0 1345 1053 A 15 GLN HBy A 40 TRP HE1 1.0 1.8 5.0 1346 1054 A 17 TYR H A 13 GLN HGx 1.0 1.8 5.0 1347 1054 A 13 GLN HGy A 17 TYR H 1.0 1.8 5.0 1348 1055 A 39 TYR HA A 38 SER H 1.0 1.8 5.0 1349 1056 A 35 ASP H A 33 GLN HA 1.0 1.8 5.0 1350 1057 A 21 LEU HD2% A 19 ALA H 1.0 1.8 5.0 1351 1058 A 47 ALA HB% A 48 ARG HA 1.0 1.8 5.0 1352 1059 A 21 LEU HD2% A 47 ALA HA 1.0 1.8 5.0 1353 1060 A 40 TRP HD1 A 30 PRO HDx 1.0 1.8 5.0 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 7 ASP O A 11 ARG N 1.0 2.4 3.3 2 2 A 7 ASP O A 11 ARG H 1.0 1.5 2.3 3 3 A 8 ARG O A 12 ALA N 1.0 2.4 3.3 4 4 A 8 ARG O A 12 ALA H 1.0 1.5 2.3 5 5 A 9 LEU O A 13 GLN N 1.0 2.4 3.3 6 6 A 9 LEU O A 13 GLN H 1.0 1.5 2.3 7 7 A 11 ARG O A 15 GLN N 1.0 2.4 3.3 8 8 A 11 ARG O A 15 GLN H 1.0 1.5 2.3 9 9 A 12 ALA O A 16 GLY N 1.0 2.4 3.3 10 10 A 12 ALA O A 16 GLY H 1.0 1.5 2.3 11 11 A 14 SER O A 18 LYS N 1.0 2.4 3.3 12 12 A 14 SER O A 18 LYS H 1.0 1.5 2.3 13 13 A 15 GLN O A 19 ALA N 1.0 2.4 3.3 14 14 A 15 GLN O A 19 ALA H 1.0 1.5 2.3 15 15 A 16 GLY O A 20 GLY N 1.0 2.4 3.3 16 16 A 16 GLY O A 20 GLY H 1.0 1.5 2.3 17 17 A 18 LYS O A 22 ASN N 1.0 2.4 3.3 18 18 A 18 LYS O A 22 ASN H 1.0 1.5 2.3 19 19 A 19 ALA O A 23 GLY N 1.0 2.4 3.3 20 20 A 19 ALA O A 23 GLY H 1.0 1.5 2.3 21 21 A 33 GLN O A 37 ARG N 1.0 2.4 3.3 22 22 A 33 GLN O A 37 ARG H 1.0 1.5 2.3 23 23 A 34 VAL O A 38 SER N 1.0 2.4 3.3 24 24 A 34 VAL O A 38 SER H 1.0 1.5 2.3 25 25 A 35 ASP O A 39 TYR N 1.0 2.4 3.3 26 26 A 35 ASP O A 39 TYR H 1.0 1.5 2.3 27 27 A 36 ALA O A 40 TRP N 1.0 2.4 3.3 28 28 A 36 ALA O A 40 TRP H 1.0 1.5 2.3 29 29 A 37 ARG O A 41 LEU N 1.0 2.4 3.3 30 30 A 37 ARG O A 41 LEU H 1.0 1.5 2.3 31 31 A 40 TRP O A 44 TRP N 1.0 2.4 3.3 32 32 A 40 TRP O A 44 TRP H 1.0 1.5 2.3 33 33 A 41 LEU O A 45 ARG N 1.0 2.4 3.3 34 34 A 41 LEU O A 45 ARG H 1.0 1.5 2.3 35 35 A 42 GLY O A 46 ASP N 1.0 2.4 3.3 36 36 A 42 GLY O A 46 ASP H 1.0 1.5 2.3 37 37 A 43 GLY O A 47 ALA N 1.0 2.4 3.3 38 38 A 43 GLY O A 47 ALA H 1.0 1.5 2.3 39 39 A 44 TRP O A 48 ARG N 1.0 2.4 3.3 40 40 A 44 TRP O A 48 ARG H 1.0 1.5 2.3 41 41 A 45 ARG O A 49 ASP N 1.0 2.4 3.3 42 42 A 45 ARG O A 49 ASP H 1.0 1.5 2.3 43 43 A 46 ASP O A 50 GLU N 1.0 2.4 3.3 44 44 A 46 ASP O A 50 GLU H 1.0 1.5 2.3 45 45 A 47 ALA O A 51 LYS N 1.0 2.4 3.3 46 46 A 47 ALA O A 51 LYS H 1.0 1.5 2.3 47 47 A 48 ARG O A 52 GLN N 1.0 2.4 3.3 48 48 A 48 ARG O A 52 GLN H 1.0 1.5 2.3 49 49 A 49 ASP O A 53 SER N 1.0 2.4 3.3 50 50 A 49 ASP O A 53 SER H 1.0 1.5 2.3 stop_ save_ save_CNS/XPLOR_distance_constraints_7 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_7 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 7 ASP O A 11 ARG N 1.0 2.4 3.3 2 2 A 7 ASP O A 11 ARG H 1.0 1.5 2.3 3 3 A 8 ARG O A 12 ALA N 1.0 2.4 3.3 4 4 A 8 ARG O A 12 ALA H 1.0 1.5 2.3 5 5 A 9 LEU O A 13 GLN N 1.0 2.4 3.3 6 6 A 9 LEU O A 13 GLN H 1.0 1.5 2.3 7 7 A 11 ARG O A 15 GLN N 1.0 2.4 3.3 8 8 A 11 ARG O A 15 GLN H 1.0 1.5 2.3 9 9 A 12 ALA O A 16 GLY N 1.0 2.4 3.3 10 10 A 12 ALA O A 16 GLY H 1.0 1.5 2.3 11 11 A 14 SER O A 18 LYS N 1.0 2.4 3.3 12 12 A 14 SER O A 18 LYS H 1.0 1.5 2.3 13 13 A 15 GLN O A 19 ALA N 1.0 2.4 3.3 14 14 A 15 GLN O A 19 ALA H 1.0 1.5 2.3 15 15 A 16 GLY O A 20 GLY N 1.0 2.4 3.3 16 16 A 16 GLY O A 20 GLY H 1.0 1.5 2.3 17 17 A 18 LYS O A 22 ASN N 1.0 2.4 3.3 18 18 A 18 LYS O A 22 ASN H 1.0 1.5 2.3 19 19 A 19 ALA O A 23 GLY N 1.0 2.4 3.3 20 20 A 19 ALA O A 23 GLY H 1.0 1.5 2.3 21 21 A 33 GLN O A 37 ARG N 1.0 2.4 3.3 22 22 A 33 GLN O A 37 ARG H 1.0 1.5 2.3 23 23 A 34 VAL O A 38 SER N 1.0 2.4 3.3 24 24 A 34 VAL O A 38 SER H 1.0 1.5 2.3 25 25 A 35 ASP O A 39 TYR N 1.0 2.4 3.3 26 26 A 35 ASP O A 39 TYR H 1.0 1.5 2.3 27 27 A 36 ALA O A 40 TRP N 1.0 2.4 3.3 28 28 A 36 ALA O A 40 TRP H 1.0 1.5 2.3 29 29 A 37 ARG O A 41 LEU N 1.0 2.4 3.3 30 30 A 37 ARG O A 41 LEU H 1.0 1.5 2.3 31 31 A 40 TRP O A 44 TRP N 1.0 2.4 3.3 32 32 A 40 TRP O A 44 TRP H 1.0 1.5 2.3 33 33 A 41 LEU O A 45 ARG N 1.0 2.4 3.3 34 34 A 41 LEU O A 45 ARG H 1.0 1.5 2.3 35 35 A 42 GLY O A 46 ASP N 1.0 2.4 3.3 36 36 A 42 GLY O A 46 ASP H 1.0 1.5 2.3 37 37 A 43 GLY O A 47 ALA N 1.0 2.4 3.3 38 38 A 43 GLY O A 47 ALA H 1.0 1.5 2.3 39 39 A 44 TRP O A 48 ARG N 1.0 2.4 3.3 40 40 A 44 TRP O A 48 ARG H 1.0 1.5 2.3 41 41 A 45 ARG O A 49 ASP N 1.0 2.4 3.3 42 42 A 45 ARG O A 49 ASP H 1.0 1.5 2.3 43 43 A 46 ASP O A 50 GLU N 1.0 2.4 3.3 44 44 A 46 ASP O A 50 GLU H 1.0 1.5 2.3 45 45 A 47 ALA O A 51 LYS N 1.0 2.4 3.3 46 46 A 47 ALA O A 51 LYS H 1.0 1.5 2.3 47 47 A 48 ARG O A 52 GLN N 1.0 2.4 3.3 48 48 A 48 ARG O A 52 GLN H 1.0 1.5 2.3 49 49 A 49 ASP O A 53 SER N 1.0 2.4 3.3 50 50 A 49 ASP O A 53 SER H 1.0 1.5 2.3 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 53 SER C A 54 GLY N A 54 GLY CA A 54 GLY C 1.0 -100.00 -30.00 PHI 2 2 A 54 GLY N A 54 GLY CA A 54 GLY C A 55 LEU N 1.0 -75.00 5.00 PSI 3 3 A 4 GLN C A 5 LYS N A 5 LYS CA A 5 LYS C 1.0 -106.71 -26.71 PHI 4 4 A 5 LYS N A 5 LYS CA A 5 LYS C A 6 ARG N 1.0 -84.09 15.91 PSI 5 5 A 5 LYS C A 6 ARG N A 6 ARG CA A 6 ARG C 1.0 -105.88 -25.88 PHI 6 6 A 6 ARG N A 6 ARG CA A 6 ARG C A 7 ASP N 1.0 -85.56 14.44 PSI 7 7 A 6 ARG C A 7 ASP N A 7 ASP CA A 7 ASP C 1.0 -101.74 -21.74 PHI 8 8 A 7 ASP N A 7 ASP CA A 7 ASP C A 8 ARG N 1.0 -92.77 7.23 PSI 9 9 A 7 ASP C A 8 ARG N A 8 ARG CA A 8 ARG C 1.0 -103.53 -23.53 PHI 10 10 A 8 ARG N A 8 ARG CA A 8 ARG C A 9 LEU N 1.0 -93.14 6.86 PSI 11 11 A 8 ARG C A 9 LEU N A 9 LEU CA A 9 LEU C 1.0 -106.32 -26.32 PHI 12 12 A 9 LEU N A 9 LEU CA A 9 LEU C A 10 GLU N 1.0 -88.65 11.35 PSI 13 13 A 9 LEU C A 10 GLU N A 10 GLU CA A 10 GLU C 1.0 -101.52 -21.52 PHI 14 14 A 10 GLU N A 10 GLU CA A 10 GLU C A 11 ARG N 1.0 -91.60 8.40 PSI 15 15 A 10 GLU C A 11 ARG N A 11 ARG CA A 11 ARG C 1.0 -105.31 -25.31 PHI 16 16 A 11 ARG N A 11 ARG CA A 11 ARG C A 12 ALA N 1.0 -90.02 9.98 PSI 17 17 A 11 ARG C A 12 ALA N A 12 ALA CA A 12 ALA C 1.0 -104.13 -24.13 PHI 18 18 A 12 ALA N A 12 ALA CA A 12 ALA C A 13 GLN N 1.0 -94.23 5.77 PSI 19 19 A 12 ALA C A 13 GLN N A 13 GLN CA A 13 GLN C 1.0 -104.01 -24.01 PHI 20 20 A 13 GLN N A 13 GLN CA A 13 GLN C A 14 SER N 1.0 -91.46 8.54 PSI 21 21 A 13 GLN C A 14 SER N A 14 SER CA A 14 SER C 1.0 -105.93 -25.93 PHI 22 22 A 14 SER N A 14 SER CA A 14 SER C A 15 GLN N 1.0 -92.79 7.21 PSI 23 23 A 14 SER C A 15 GLN N A 15 GLN CA A 15 GLN C 1.0 -104.58 -24.58 PHI 24 24 A 15 GLN N A 15 GLN CA A 15 GLN C A 16 GLY N 1.0 -91.44 8.56 PSI 25 25 A 16 GLY C A 17 TYR N A 17 TYR CA A 17 TYR C 1.0 -102.63 -22.63 PHI 26 26 A 17 TYR N A 17 TYR CA A 17 TYR C A 18 LYS N 1.0 -91.63 8.37 PSI 27 27 A 17 TYR C A 18 LYS N A 18 LYS CA A 18 LYS C 1.0 -103.76 -23.76 PHI 28 28 A 18 LYS N A 18 LYS CA A 18 LYS C A 19 ALA N 1.0 -89.67 10.33 PSI 29 29 A 18 LYS C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -104.84 -24.84 PHI 30 30 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 GLY N 1.0 -87.66 12.34 PSI 31 31 A 19 ALA C A 20 GLY N A 20 GLY CA A 20 GLY C 1.0 -107.80 -27.80 PHI 32 32 A 20 GLY N A 20 GLY CA A 20 GLY C A 21 LEU N 1.0 -89.15 10.85 PSI 33 33 A 20 GLY C A 21 LEU N A 21 LEU CA A 21 LEU C 1.0 -109.29 -29.29 PHI 34 34 A 21 LEU N A 21 LEU CA A 21 LEU C A 22 ASN N 1.0 -83.02 16.98 PSI 35 35 A 21 LEU C A 22 ASN N A 22 ASN CA A 22 ASN C 1.0 -129.89 -49.89 PHI 36 36 A 22 ASN N A 22 ASN CA A 22 ASN C A 23 GLY N 1.0 -48.87 51.13 PSI 37 37 A 24 ARG C A 25 SER N A 25 SER CA A 25 SER C 1.0 -130.53 -50.53 PHI 38 38 A 25 SER N A 25 SER CA A 25 SER C A 26 GLN N 1.0 117.89 217.89 PSI 39 39 A 25 SER C A 26 GLN N A 26 GLN CA A 26 GLN C 1.0 -97.04 -17.04 PHI 40 40 A 26 GLN N A 26 GLN CA A 26 GLN C A 27 GLU N 1.0 -88.53 11.47 PSI 41 41 A 26 GLN C A 27 GLU N A 27 GLU CA A 27 GLU C 1.0 -106.76 -26.76 PHI 42 42 A 27 GLU N A 27 GLU CA A 27 GLU C A 28 ALA N 1.0 -74.98 25.02 PSI 43 43 A 33 GLN C A 34 VAL N A 34 VAL CA A 34 VAL C 1.0 -101.85 -21.85 PHI 44 44 A 34 VAL N A 34 VAL CA A 34 VAL C A 35 ASP N 1.0 -90.77 9.23 PSI 45 45 A 34 VAL C A 35 ASP N A 35 ASP CA A 35 ASP C 1.0 -104.89 -24.89 PHI 46 46 A 35 ASP N A 35 ASP CA A 35 ASP C A 36 ALA N 1.0 -87.88 12.12 PSI 47 47 A 35 ASP C A 36 ALA N A 36 ALA CA A 36 ALA C 1.0 -103.27 -23.27 PHI 48 48 A 36 ALA N A 36 ALA CA A 36 ALA C A 37 ARG N 1.0 -92.28 7.72 PSI 49 49 A 36 ALA C A 37 ARG N A 37 ARG CA A 37 ARG C 1.0 -100.87 -20.87 PHI 50 50 A 37 ARG N A 37 ARG CA A 37 ARG C A 38 SER N 1.0 -92.66 7.34 PSI 51 51 A 37 ARG C A 38 SER N A 38 SER CA A 38 SER C 1.0 -103.15 -23.15 PHI 52 52 A 38 SER N A 38 SER CA A 38 SER C A 39 TYR N 1.0 -87.82 12.18 PSI 53 53 A 38 SER C A 39 TYR N A 39 TYR CA A 39 TYR C 1.0 -104.68 -24.68 PHI 54 54 A 39 TYR N A 39 TYR CA A 39 TYR C A 40 TRP N 1.0 -93.32 6.68 PSI 55 55 A 39 TYR C A 40 TRP N A 40 TRP CA A 40 TRP C 1.0 -102.11 -22.11 PHI 56 56 A 40 TRP N A 40 TRP CA A 40 TRP C A 41 LEU N 1.0 -96.58 3.42 PSI 57 57 A 40 TRP C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 -103.03 -23.03 PHI 58 58 A 41 LEU N A 41 LEU CA A 41 LEU C A 42 GLY N 1.0 -94.00 6.00 PSI 59 59 A 41 LEU C A 42 GLY N A 42 GLY CA A 42 GLY C 1.0 -111.94 -31.94 PHI 60 60 A 42 GLY N A 42 GLY CA A 42 GLY C A 43 GLY N 1.0 -85.50 14.50 PSI 61 61 A 43 GLY C A 44 TRP N A 44 TRP CA A 44 TRP C 1.0 -100.26 -20.26 PHI 62 62 A 44 TRP N A 44 TRP CA A 44 TRP C A 45 ARG N 1.0 -96.11 3.89 PSI 63 63 A 44 TRP C A 45 ARG N A 45 ARG CA A 45 ARG C 1.0 -104.08 -24.08 PHI 64 64 A 45 ARG N A 45 ARG CA A 45 ARG C A 46 ASP N 1.0 -90.42 9.58 PSI 65 65 A 45 ARG C A 46 ASP N A 46 ASP CA A 46 ASP C 1.0 -103.60 -23.60 PHI 66 66 A 46 ASP N A 46 ASP CA A 46 ASP C A 47 ALA N 1.0 -89.75 10.25 PSI 67 67 A 46 ASP C A 47 ALA N A 47 ALA CA A 47 ALA C 1.0 -103.61 -23.61 PHI 68 68 A 47 ALA N A 47 ALA CA A 47 ALA C A 48 ARG N 1.0 -88.43 11.57 PSI 69 69 A 47 ALA C A 48 ARG N A 48 ARG CA A 48 ARG C 1.0 -105.91 -25.91 PHI 70 70 A 48 ARG N A 48 ARG CA A 48 ARG C A 49 ASP N 1.0 -85.76 14.24 PSI 71 71 A 48 ARG C A 49 ASP N A 49 ASP CA A 49 ASP C 1.0 -101.88 -21.88 PHI 72 72 A 49 ASP N A 49 ASP CA A 49 ASP C A 50 GLU N 1.0 -89.33 10.67 PSI 73 73 A 49 ASP C A 50 GLU N A 50 GLU CA A 50 GLU C 1.0 -103.73 -23.73 PHI 74 74 A 50 GLU N A 50 GLU CA A 50 GLU C A 51 LYS N 1.0 -93.73 6.27 PSI 75 75 A 50 GLU C A 51 LYS N A 51 LYS CA A 51 LYS C 1.0 -102.48 -22.48 PHI 76 76 A 51 LYS N A 51 LYS CA A 51 LYS C A 52 GLN N 1.0 -90.14 9.86 PSI 77 77 A 51 LYS C A 52 GLN N A 52 GLN CA A 52 GLN C 1.0 -111.03 -31.03 PHI 78 78 A 52 GLN N A 52 GLN CA A 52 GLN C A 53 SER N 1.0 -88.17 11.83 PSI 79 79 A 6 ARG C A 7 ASP N A 7 ASP CA A 7 ASP C 1.0 -100.00 -30.00 PHI 80 80 A 7 ASP N A 7 ASP CA A 7 ASP C A 8 ARG N 1.0 -75.00 5.00 PSI 81 81 A 7 ASP C A 8 ARG N A 8 ARG CA A 8 ARG C 1.0 -100.00 -30.00 PHI 82 82 A 8 ARG C A 9 LEU N A 9 LEU CA A 9 LEU C 1.0 -100.00 -30.00 PHI 83 83 A 8 ARG N A 8 ARG CA A 8 ARG C A 9 LEU N 1.0 -75.00 5.00 PSI 84 84 A 9 LEU N A 9 LEU CA A 9 LEU C A 10 GLU N 1.0 -75.00 5.00 PSI 85 85 A 9 LEU C A 10 GLU N A 10 GLU CA A 10 GLU C 1.0 -100.00 -30.00 PHI 86 86 A 10 GLU N A 10 GLU CA A 10 GLU C A 11 ARG N 1.0 -75.00 5.00 PSI 87 87 A 10 GLU C A 11 ARG N A 11 ARG CA A 11 ARG C 1.0 -100.00 -30.00 PHI 88 88 A 11 ARG C A 12 ALA N A 12 ALA CA A 12 ALA C 1.0 -100.00 -30.00 PHI 89 89 A 11 ARG N A 11 ARG CA A 11 ARG C A 12 ALA N 1.0 -75.00 5.00 PSI 90 90 A 12 ALA N A 12 ALA CA A 12 ALA C A 13 GLN N 1.0 -75.00 5.00 PSI 91 91 A 12 ALA C A 13 GLN N A 13 GLN CA A 13 GLN C 1.0 -100.00 -30.00 PHI 92 92 A 13 GLN C A 14 SER N A 14 SER CA A 14 SER C 1.0 -100.00 -30.00 PHI 93 93 A 13 GLN N A 13 GLN CA A 13 GLN C A 14 SER N 1.0 -75.00 5.00 PSI 94 94 A 14 SER N A 14 SER CA A 14 SER C A 15 GLN N 1.0 -75.00 5.00 PSI 95 95 A 14 SER C A 15 GLN N A 15 GLN CA A 15 GLN C 1.0 -100.00 -30.00 PHI 96 96 A 15 GLN C A 16 GLY N A 16 GLY CA A 16 GLY C 1.0 -100.00 -30.00 PHI 97 97 A 15 GLN N A 15 GLN CA A 15 GLN C A 16 GLY N 1.0 -75.00 5.00 PSI 98 98 A 16 GLY N A 16 GLY CA A 16 GLY C A 17 TYR N 1.0 -75.00 5.00 PSI 99 99 A 16 GLY C A 17 TYR N A 17 TYR CA A 17 TYR C 1.0 -100.00 -30.00 PHI 100 100 A 17 TYR N A 17 TYR CA A 17 TYR C A 18 LYS N 1.0 -75.00 5.00 PSI 101 101 A 17 TYR C A 18 LYS N A 18 LYS CA A 18 LYS C 1.0 -100.00 -30.00 PHI 102 102 A 18 LYS C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -100.00 -30.00 PHI 103 103 A 18 LYS N A 18 LYS CA A 18 LYS C A 19 ALA N 1.0 -75.00 5.00 PSI 104 104 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 GLY N 1.0 -75.00 5.00 PSI 105 105 A 19 ALA C A 20 GLY N A 20 GLY CA A 20 GLY C 1.0 -100.00 -30.00 PHI 106 106 A 20 GLY N A 20 GLY CA A 20 GLY C A 21 LEU N 1.0 -75.00 5.00 PSI 107 107 A 20 GLY C A 21 LEU N A 21 LEU CA A 21 LEU C 1.0 -100.00 -30.00 PHI 108 108 A 21 LEU C A 22 ASN N A 22 ASN CA A 22 ASN C 1.0 -100.00 -30.00 PHI 109 109 A 21 LEU N A 21 LEU CA A 21 LEU C A 22 ASN N 1.0 -75.00 5.00 PSI 110 110 A 22 ASN C A 23 GLY N A 23 GLY CA A 23 GLY C 1.0 -100.00 -30.00 PHI 111 111 A 22 ASN N A 22 ASN CA A 22 ASN C A 23 GLY N 1.0 -75.00 5.00 PSI 112 112 A 23 GLY N A 23 GLY CA A 23 GLY C A 24 ARG N 1.0 -75.00 5.00 PSI 113 113 A 32 GLN C A 33 GLN N A 33 GLN CA A 33 GLN C 1.0 -100.00 -30.00 PHI 114 114 A 33 GLN N A 33 GLN CA A 33 GLN C A 34 VAL N 1.0 -75.00 5.00 PSI 115 115 A 33 GLN C A 34 VAL N A 34 VAL CA A 34 VAL C 1.0 -100.00 -30.00 PHI 116 116 A 34 VAL N A 34 VAL CA A 34 VAL C A 35 ASP N 1.0 -75.00 5.00 PSI 117 117 A 34 VAL C A 35 ASP N A 35 ASP CA A 35 ASP C 1.0 -100.00 -30.00 PHI 118 118 A 35 ASP N A 35 ASP CA A 35 ASP C A 36 ALA N 1.0 -75.00 5.00 PSI 119 119 A 35 ASP C A 36 ALA N A 36 ALA CA A 36 ALA C 1.0 -100.00 -30.00 PHI 120 120 A 36 ALA N A 36 ALA CA A 36 ALA C A 37 ARG N 1.0 -75.00 5.00 PSI 121 121 A 36 ALA C A 37 ARG N A 37 ARG CA A 37 ARG C 1.0 -100.00 -30.00 PHI 122 122 A 37 ARG C A 38 SER N A 38 SER CA A 38 SER C 1.0 -100.00 -30.00 PHI 123 123 A 37 ARG N A 37 ARG CA A 37 ARG C A 38 SER N 1.0 -75.00 5.00 PSI 124 124 A 38 SER C A 39 TYR N A 39 TYR CA A 39 TYR C 1.0 -100.00 -30.00 PHI 125 125 A 38 SER N A 38 SER CA A 38 SER C A 39 TYR N 1.0 -75.00 5.00 PSI 126 126 A 39 TYR N A 39 TYR CA A 39 TYR C A 40 TRP N 1.0 -75.00 5.00 PSI 127 127 A 39 TYR C A 40 TRP N A 40 TRP CA A 40 TRP C 1.0 -100.00 -30.00 PHI 128 128 A 40 TRP C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 -100.00 -30.00 PHI 129 129 A 40 TRP N A 40 TRP CA A 40 TRP C A 41 LEU N 1.0 -75.00 5.00 PSI 130 130 A 41 LEU N A 41 LEU CA A 41 LEU C A 42 GLY N 1.0 -75.00 5.00 PSI 131 131 A 41 LEU C A 42 GLY N A 42 GLY CA A 42 GLY C 1.0 -100.00 -30.00 PHI 132 132 A 42 GLY C A 43 GLY N A 43 GLY CA A 43 GLY C 1.0 -100.00 -30.00 PHI 133 133 A 42 GLY N A 42 GLY CA A 42 GLY C A 43 GLY N 1.0 -75.00 5.00 PSI 134 134 A 43 GLY N A 43 GLY CA A 43 GLY C A 44 TRP N 1.0 -75.00 5.00 PSI 135 135 A 43 GLY C A 44 TRP N A 44 TRP CA A 44 TRP C 1.0 -100.00 -30.00 PHI 136 136 A 44 TRP C A 45 ARG N A 45 ARG CA A 45 ARG C 1.0 -100.00 -30.00 PHI 137 137 A 44 TRP N A 44 TRP CA A 44 TRP C A 45 ARG N 1.0 -75.00 5.00 PSI 138 138 A 45 ARG N A 45 ARG CA A 45 ARG C A 46 ASP N 1.0 -75.00 5.00 PSI 139 139 A 45 ARG C A 46 ASP N A 46 ASP CA A 46 ASP C 1.0 -100.00 -30.00 PHI 140 140 A 46 ASP N A 46 ASP CA A 46 ASP C A 47 ALA N 1.0 -75.00 5.00 PSI 141 141 A 46 ASP C A 47 ALA N A 47 ALA CA A 47 ALA C 1.0 -100.00 -30.00 PHI 142 142 A 47 ALA N A 47 ALA CA A 47 ALA C A 48 ARG N 1.0 -75.00 5.00 PSI 143 143 A 47 ALA C A 48 ARG N A 48 ARG CA A 48 ARG C 1.0 -100.00 -30.00 PHI 144 144 A 48 ARG C A 49 ASP N A 49 ASP CA A 49 ASP C 1.0 -100.00 -30.00 PHI 145 145 A 48 ARG N A 48 ARG CA A 48 ARG C A 49 ASP N 1.0 -75.00 5.00 PSI 146 146 A 49 ASP N A 49 ASP CA A 49 ASP C A 50 GLU N 1.0 -75.00 5.00 PSI 147 147 A 49 ASP C A 50 GLU N A 50 GLU CA A 50 GLU C 1.0 -100.00 -30.00 PHI 148 148 A 50 GLU C A 51 LYS N A 51 LYS CA A 51 LYS C 1.0 -100.00 -30.00 PHI 149 149 A 50 GLU N A 50 GLU CA A 50 GLU C A 51 LYS N 1.0 -75.00 5.00 PSI 150 150 A 51 LYS N A 51 LYS CA A 51 LYS C A 52 GLN N 1.0 -75.00 5.00 PSI 151 151 A 51 LYS C A 52 GLN N A 52 GLN CA A 52 GLN C 1.0 -100.00 -30.00 PHI 152 152 A 53 SER N A 53 SER CA A 53 SER C A 54 GLY N 1.0 -75.00 5.00 PSI 153 153 A 52 GLN C A 53 SER N A 53 SER CA A 53 SER C 1.0 -100.00 -30.00 PHI 154 154 A 52 GLN N A 52 GLN CA A 52 GLN C A 53 SER N 1.0 -75.00 5.00 PSI stop_ save_ save_CNS/XPLOR_dihedral_6 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_6 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 53 SER C A 54 GLY N A 54 GLY CA A 54 GLY C 1.0 -100.00 -30.00 PHI 2 2 A 54 GLY N A 54 GLY CA A 54 GLY C A 55 LEU N 1.0 -75.00 5.00 PSI 3 3 A 4 GLN C A 5 LYS N A 5 LYS CA A 5 LYS C 1.0 -106.71 -26.71 PHI 4 4 A 5 LYS N A 5 LYS CA A 5 LYS C A 6 ARG N 1.0 -84.09 15.91 PSI 5 5 A 5 LYS C A 6 ARG N A 6 ARG CA A 6 ARG C 1.0 -105.88 -25.88 PHI 6 6 A 6 ARG N A 6 ARG CA A 6 ARG C A 7 ASP N 1.0 -85.56 14.44 PSI 7 7 A 6 ARG C A 7 ASP N A 7 ASP CA A 7 ASP C 1.0 -101.74 -21.74 PHI 8 8 A 7 ASP N A 7 ASP CA A 7 ASP C A 8 ARG N 1.0 -92.77 7.23 PSI 9 9 A 7 ASP C A 8 ARG N A 8 ARG CA A 8 ARG C 1.0 -103.53 -23.53 PHI 10 10 A 8 ARG N A 8 ARG CA A 8 ARG C A 9 LEU N 1.0 -93.14 6.86 PSI 11 11 A 8 ARG C A 9 LEU N A 9 LEU CA A 9 LEU C 1.0 -106.32 -26.32 PHI 12 12 A 9 LEU N A 9 LEU CA A 9 LEU C A 10 GLU N 1.0 -88.65 11.35 PSI 13 13 A 9 LEU C A 10 GLU N A 10 GLU CA A 10 GLU C 1.0 -101.52 -21.52 PHI 14 14 A 10 GLU N A 10 GLU CA A 10 GLU C A 11 ARG N 1.0 -91.60 8.40 PSI 15 15 A 10 GLU C A 11 ARG N A 11 ARG CA A 11 ARG C 1.0 -105.31 -25.31 PHI 16 16 A 11 ARG N A 11 ARG CA A 11 ARG C A 12 ALA N 1.0 -90.02 9.98 PSI 17 17 A 11 ARG C A 12 ALA N A 12 ALA CA A 12 ALA C 1.0 -104.13 -24.13 PHI 18 18 A 12 ALA N A 12 ALA CA A 12 ALA C A 13 GLN N 1.0 -94.23 5.77 PSI 19 19 A 12 ALA C A 13 GLN N A 13 GLN CA A 13 GLN C 1.0 -104.01 -24.01 PHI 20 20 A 13 GLN N A 13 GLN CA A 13 GLN C A 14 SER N 1.0 -91.46 8.54 PSI 21 21 A 13 GLN C A 14 SER N A 14 SER CA A 14 SER C 1.0 -105.93 -25.93 PHI 22 22 A 14 SER N A 14 SER CA A 14 SER C A 15 GLN N 1.0 -92.79 7.21 PSI 23 23 A 14 SER C A 15 GLN N A 15 GLN CA A 15 GLN C 1.0 -104.58 -24.58 PHI 24 24 A 15 GLN N A 15 GLN CA A 15 GLN C A 16 GLY N 1.0 -91.44 8.56 PSI 25 25 A 16 GLY C A 17 TYR N A 17 TYR CA A 17 TYR C 1.0 -102.63 -22.63 PHI 26 26 A 17 TYR N A 17 TYR CA A 17 TYR C A 18 LYS N 1.0 -91.63 8.37 PSI 27 27 A 17 TYR C A 18 LYS N A 18 LYS CA A 18 LYS C 1.0 -103.76 -23.76 PHI 28 28 A 18 LYS N A 18 LYS CA A 18 LYS C A 19 ALA N 1.0 -89.67 10.33 PSI 29 29 A 18 LYS C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -104.84 -24.84 PHI 30 30 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 GLY N 1.0 -87.66 12.34 PSI 31 31 A 19 ALA C A 20 GLY N A 20 GLY CA A 20 GLY C 1.0 -107.80 -27.80 PHI 32 32 A 20 GLY N A 20 GLY CA A 20 GLY C A 21 LEU N 1.0 -89.15 10.85 PSI 33 33 A 20 GLY C A 21 LEU N A 21 LEU CA A 21 LEU C 1.0 -109.29 -29.29 PHI 34 34 A 21 LEU N A 21 LEU CA A 21 LEU C A 22 ASN N 1.0 -83.02 16.98 PSI 35 35 A 21 LEU C A 22 ASN N A 22 ASN CA A 22 ASN C 1.0 -129.89 -49.89 PHI 36 36 A 22 ASN N A 22 ASN CA A 22 ASN C A 23 GLY N 1.0 -48.87 51.13 PSI 37 37 A 24 ARG C A 25 SER N A 25 SER CA A 25 SER C 1.0 -130.53 -50.53 PHI 38 38 A 25 SER N A 25 SER CA A 25 SER C A 26 GLN N 1.0 117.89 217.89 PSI 39 39 A 25 SER C A 26 GLN N A 26 GLN CA A 26 GLN C 1.0 -97.04 -17.04 PHI 40 40 A 26 GLN N A 26 GLN CA A 26 GLN C A 27 GLU N 1.0 -88.53 11.47 PSI 41 41 A 26 GLN C A 27 GLU N A 27 GLU CA A 27 GLU C 1.0 -106.76 -26.76 PHI 42 42 A 27 GLU N A 27 GLU CA A 27 GLU C A 28 ALA N 1.0 -74.98 25.02 PSI 43 43 A 33 GLN C A 34 VAL N A 34 VAL CA A 34 VAL C 1.0 -101.85 -21.85 PHI 44 44 A 34 VAL N A 34 VAL CA A 34 VAL C A 35 ASP N 1.0 -90.77 9.23 PSI 45 45 A 34 VAL C A 35 ASP N A 35 ASP CA A 35 ASP C 1.0 -104.89 -24.89 PHI 46 46 A 35 ASP N A 35 ASP CA A 35 ASP C A 36 ALA N 1.0 -87.88 12.12 PSI 47 47 A 35 ASP C A 36 ALA N A 36 ALA CA A 36 ALA C 1.0 -103.27 -23.27 PHI 48 48 A 36 ALA N A 36 ALA CA A 36 ALA C A 37 ARG N 1.0 -92.28 7.72 PSI 49 49 A 36 ALA C A 37 ARG N A 37 ARG CA A 37 ARG C 1.0 -100.87 -20.87 PHI 50 50 A 37 ARG N A 37 ARG CA A 37 ARG C A 38 SER N 1.0 -92.66 7.34 PSI 51 51 A 37 ARG C A 38 SER N A 38 SER CA A 38 SER C 1.0 -103.15 -23.15 PHI 52 52 A 38 SER N A 38 SER CA A 38 SER C A 39 TYR N 1.0 -87.82 12.18 PSI 53 53 A 38 SER C A 39 TYR N A 39 TYR CA A 39 TYR C 1.0 -104.68 -24.68 PHI 54 54 A 39 TYR N A 39 TYR CA A 39 TYR C A 40 TRP N 1.0 -93.32 6.68 PSI 55 55 A 39 TYR C A 40 TRP N A 40 TRP CA A 40 TRP C 1.0 -102.11 -22.11 PHI 56 56 A 40 TRP N A 40 TRP CA A 40 TRP C A 41 LEU N 1.0 -96.58 3.42 PSI 57 57 A 40 TRP C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 -103.03 -23.03 PHI 58 58 A 41 LEU N A 41 LEU CA A 41 LEU C A 42 GLY N 1.0 -94.00 6.00 PSI 59 59 A 41 LEU C A 42 GLY N A 42 GLY CA A 42 GLY C 1.0 -111.94 -31.94 PHI 60 60 A 42 GLY N A 42 GLY CA A 42 GLY C A 43 GLY N 1.0 -85.50 14.50 PSI 61 61 A 43 GLY C A 44 TRP N A 44 TRP CA A 44 TRP C 1.0 -100.26 -20.26 PHI 62 62 A 44 TRP N A 44 TRP CA A 44 TRP C A 45 ARG N 1.0 -96.11 3.89 PSI 63 63 A 44 TRP C A 45 ARG N A 45 ARG CA A 45 ARG C 1.0 -104.08 -24.08 PHI 64 64 A 45 ARG N A 45 ARG CA A 45 ARG C A 46 ASP N 1.0 -90.42 9.58 PSI 65 65 A 45 ARG C A 46 ASP N A 46 ASP CA A 46 ASP C 1.0 -103.60 -23.60 PHI 66 66 A 46 ASP N A 46 ASP CA A 46 ASP C A 47 ALA N 1.0 -89.75 10.25 PSI 67 67 A 46 ASP C A 47 ALA N A 47 ALA CA A 47 ALA C 1.0 -103.61 -23.61 PHI 68 68 A 47 ALA N A 47 ALA CA A 47 ALA C A 48 ARG N 1.0 -88.43 11.57 PSI 69 69 A 47 ALA C A 48 ARG N A 48 ARG CA A 48 ARG C 1.0 -105.91 -25.91 PHI 70 70 A 48 ARG N A 48 ARG CA A 48 ARG C A 49 ASP N 1.0 -85.76 14.24 PSI 71 71 A 48 ARG C A 49 ASP N A 49 ASP CA A 49 ASP C 1.0 -101.88 -21.88 PHI 72 72 A 49 ASP N A 49 ASP CA A 49 ASP C A 50 GLU N 1.0 -89.33 10.67 PSI 73 73 A 49 ASP C A 50 GLU N A 50 GLU CA A 50 GLU C 1.0 -103.73 -23.73 PHI 74 74 A 50 GLU N A 50 GLU CA A 50 GLU C A 51 LYS N 1.0 -93.73 6.27 PSI 75 75 A 50 GLU C A 51 LYS N A 51 LYS CA A 51 LYS C 1.0 -102.48 -22.48 PHI 76 76 A 51 LYS N A 51 LYS CA A 51 LYS C A 52 GLN N 1.0 -90.14 9.86 PSI 77 77 A 51 LYS C A 52 GLN N A 52 GLN CA A 52 GLN C 1.0 -111.03 -31.03 PHI 78 78 A 52 GLN N A 52 GLN CA A 52 GLN C A 53 SER N 1.0 -88.17 11.83 PSI 79 79 A 6 ARG C A 7 ASP N A 7 ASP CA A 7 ASP C 1.0 -100.00 -30.00 PHI 80 80 A 7 ASP N A 7 ASP CA A 7 ASP C A 8 ARG N 1.0 -75.00 5.00 PSI 81 81 A 7 ASP C A 8 ARG N A 8 ARG CA A 8 ARG C 1.0 -100.00 -30.00 PHI 82 82 A 8 ARG N A 8 ARG CA A 8 ARG C A 9 LEU N 1.0 -75.00 5.00 PSI 83 83 A 8 ARG C A 9 LEU N A 9 LEU CA A 9 LEU C 1.0 -100.00 -30.00 PHI 84 84 A 9 LEU N A 9 LEU CA A 9 LEU C A 10 GLU N 1.0 -75.00 5.00 PSI 85 85 A 9 LEU C A 10 GLU N A 10 GLU CA A 10 GLU C 1.0 -100.00 -30.00 PHI 86 86 A 10 GLU N A 10 GLU CA A 10 GLU C A 11 ARG N 1.0 -75.00 5.00 PSI 87 87 A 10 GLU C A 11 ARG N A 11 ARG CA A 11 ARG C 1.0 -100.00 -30.00 PHI 88 88 A 11 ARG N A 11 ARG CA A 11 ARG C A 12 ALA N 1.0 -75.00 5.00 PSI 89 89 A 11 ARG C A 12 ALA N A 12 ALA CA A 12 ALA C 1.0 -100.00 -30.00 PHI 90 90 A 12 ALA N A 12 ALA CA A 12 ALA C A 13 GLN N 1.0 -75.00 5.00 PSI 91 91 A 12 ALA C A 13 GLN N A 13 GLN CA A 13 GLN C 1.0 -100.00 -30.00 PHI 92 92 A 13 GLN N A 13 GLN CA A 13 GLN C A 14 SER N 1.0 -75.00 5.00 PSI 93 93 A 13 GLN C A 14 SER N A 14 SER CA A 14 SER C 1.0 -100.00 -30.00 PHI 94 94 A 14 SER C A 15 GLN N A 15 GLN CA A 15 GLN C 1.0 -100.00 -30.00 PHI 95 95 A 14 SER N A 14 SER CA A 14 SER C A 15 GLN N 1.0 -75.00 5.00 PSI 96 96 A 15 GLN C A 16 GLY N A 16 GLY CA A 16 GLY C 1.0 -100.00 -30.00 PHI 97 97 A 15 GLN N A 15 GLN CA A 15 GLN C A 16 GLY N 1.0 -75.00 5.00 PSI 98 98 A 16 GLY C A 17 TYR N A 17 TYR CA A 17 TYR C 1.0 -100.00 -30.00 PHI 99 99 A 16 GLY N A 16 GLY CA A 16 GLY C A 17 TYR N 1.0 -75.00 5.00 PSI 100 100 A 17 TYR N A 17 TYR CA A 17 TYR C A 18 LYS N 1.0 -75.00 5.00 PSI 101 101 A 17 TYR C A 18 LYS N A 18 LYS CA A 18 LYS C 1.0 -100.00 -30.00 PHI 102 102 A 18 LYS N A 18 LYS CA A 18 LYS C A 19 ALA N 1.0 -75.00 5.00 PSI 103 103 A 18 LYS C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -100.00 -30.00 PHI 104 104 A 19 ALA C A 20 GLY N A 20 GLY CA A 20 GLY C 1.0 -100.00 -30.00 PHI 105 105 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 GLY N 1.0 -75.00 5.00 PSI 106 106 A 20 GLY C A 21 LEU N A 21 LEU CA A 21 LEU C 1.0 -100.00 -30.00 PHI 107 107 A 20 GLY N A 20 GLY CA A 20 GLY C A 21 LEU N 1.0 -75.00 5.00 PSI 108 108 A 21 LEU N A 21 LEU CA A 21 LEU C A 22 ASN N 1.0 -75.00 5.00 PSI 109 109 A 21 LEU C A 22 ASN N A 22 ASN CA A 22 ASN C 1.0 -100.00 -30.00 PHI 110 110 A 22 ASN N A 22 ASN CA A 22 ASN C A 23 GLY N 1.0 -75.00 5.00 PSI 111 111 A 23 GLY N A 23 GLY CA A 23 GLY C A 24 ARG N 1.0 -75.00 5.00 PSI 112 112 A 22 ASN C A 23 GLY N A 23 GLY CA A 23 GLY C 1.0 -100.00 -30.00 PHI 113 113 A 32 GLN C A 33 GLN N A 33 GLN CA A 33 GLN C 1.0 -100.00 -30.00 PHI 114 114 A 33 GLN N A 33 GLN CA A 33 GLN C A 34 VAL N 1.0 -75.00 5.00 PSI 115 115 A 33 GLN C A 34 VAL N A 34 VAL CA A 34 VAL C 1.0 -100.00 -30.00 PHI 116 116 A 34 VAL N A 34 VAL CA A 34 VAL C A 35 ASP N 1.0 -75.00 5.00 PSI 117 117 A 34 VAL C A 35 ASP N A 35 ASP CA A 35 ASP C 1.0 -100.00 -30.00 PHI 118 118 A 35 ASP N A 35 ASP CA A 35 ASP C A 36 ALA N 1.0 -75.00 5.00 PSI 119 119 A 35 ASP C A 36 ALA N A 36 ALA CA A 36 ALA C 1.0 -100.00 -30.00 PHI 120 120 A 36 ALA N A 36 ALA CA A 36 ALA C A 37 ARG N 1.0 -75.00 5.00 PSI 121 121 A 36 ALA C A 37 ARG N A 37 ARG CA A 37 ARG C 1.0 -100.00 -30.00 PHI 122 122 A 37 ARG C A 38 SER N A 38 SER CA A 38 SER C 1.0 -100.00 -30.00 PHI 123 123 A 37 ARG N A 37 ARG CA A 37 ARG C A 38 SER N 1.0 -75.00 5.00 PSI 124 124 A 38 SER N A 38 SER CA A 38 SER C A 39 TYR N 1.0 -75.00 5.00 PSI 125 125 A 38 SER C A 39 TYR N A 39 TYR CA A 39 TYR C 1.0 -100.00 -30.00 PHI 126 126 A 39 TYR C A 40 TRP N A 40 TRP CA A 40 TRP C 1.0 -100.00 -30.00 PHI 127 127 A 39 TYR N A 39 TYR CA A 39 TYR C A 40 TRP N 1.0 -75.00 5.00 PSI 128 128 A 40 TRP N A 40 TRP CA A 40 TRP C A 41 LEU N 1.0 -75.00 5.00 PSI 129 129 A 40 TRP C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 -100.00 -30.00 PHI 130 130 A 41 LEU N A 41 LEU CA A 41 LEU C A 42 GLY N 1.0 -75.00 5.00 PSI 131 131 A 41 LEU C A 42 GLY N A 42 GLY CA A 42 GLY C 1.0 -100.00 -30.00 PHI 132 132 A 42 GLY C A 43 GLY N A 43 GLY CA A 43 GLY C 1.0 -100.00 -30.00 PHI 133 133 A 42 GLY N A 42 GLY CA A 42 GLY C A 43 GLY N 1.0 -75.00 5.00 PSI 134 134 A 43 GLY N A 43 GLY CA A 43 GLY C A 44 TRP N 1.0 -75.00 5.00 PSI 135 135 A 43 GLY C A 44 TRP N A 44 TRP CA A 44 TRP C 1.0 -100.00 -30.00 PHI 136 136 A 44 TRP C A 45 ARG N A 45 ARG CA A 45 ARG C 1.0 -100.00 -30.00 PHI 137 137 A 44 TRP N A 44 TRP CA A 44 TRP C A 45 ARG N 1.0 -75.00 5.00 PSI 138 138 A 45 ARG C A 46 ASP N A 46 ASP CA A 46 ASP C 1.0 -100.00 -30.00 PHI 139 139 A 45 ARG N A 45 ARG CA A 45 ARG C A 46 ASP N 1.0 -75.00 5.00 PSI 140 140 A 46 ASP N A 46 ASP CA A 46 ASP C A 47 ALA N 1.0 -75.00 5.00 PSI 141 141 A 46 ASP C A 47 ALA N A 47 ALA CA A 47 ALA C 1.0 -100.00 -30.00 PHI 142 142 A 47 ALA C A 48 ARG N A 48 ARG CA A 48 ARG C 1.0 -100.00 -30.00 PHI 143 143 A 47 ALA N A 47 ALA CA A 47 ALA C A 48 ARG N 1.0 -75.00 5.00 PSI 144 144 A 48 ARG N A 48 ARG CA A 48 ARG C A 49 ASP N 1.0 -75.00 5.00 PSI 145 145 A 48 ARG C A 49 ASP N A 49 ASP CA A 49 ASP C 1.0 -100.00 -30.00 PHI 146 146 A 49 ASP N A 49 ASP CA A 49 ASP C A 50 GLU N 1.0 -75.00 5.00 PSI 147 147 A 49 ASP C A 50 GLU N A 50 GLU CA A 50 GLU C 1.0 -100.00 -30.00 PHI 148 148 A 50 GLU N A 50 GLU CA A 50 GLU C A 51 LYS N 1.0 -75.00 5.00 PSI 149 149 A 50 GLU C A 51 LYS N A 51 LYS CA A 51 LYS C 1.0 -100.00 -30.00 PHI 150 150 A 51 LYS C A 52 GLN N A 52 GLN CA A 52 GLN C 1.0 -100.00 -30.00 PHI 151 151 A 51 LYS N A 51 LYS CA A 51 LYS C A 52 GLN N 1.0 -75.00 5.00 PSI 152 152 A 52 GLN C A 53 SER N A 53 SER CA A 53 SER C 1.0 -100.00 -30.00 PHI 153 153 A 53 SER N A 53 SER CA A 53 SER C A 54 GLY N 1.0 -75.00 5.00 PSI 154 154 A 52 GLN N A 52 GLN CA A 52 GLN C A 53 SER N 1.0 -75.00 5.00 PSI stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 9199.632 2 13C 4828.585 3 1H 11160.714 stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 9199.632 2 13C 4828.585 3 1H 11160.714 stop_ save_ save_spectral_peak_list_3 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_3 _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 9199.632 2 15N 1784.121 3 1H 11160.714 stop_ save_