data_nef_c16001_2k9s 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 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 1BL0 PDB 1D5Y stop_ 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 ASP middle . . 3 A 3 ASN middle . . 4 A 4 ARG middle . . 5 A 5 VAL middle . . 6 A 6 ARG middle . . 7 A 7 GLU middle . . 8 A 8 ALA middle . . 9 A 9 CYS middle . . 10 A 10 GLN middle . . 11 A 11 TYR middle . . 12 A 12 ILE middle . . 13 A 13 SER middle . . 14 A 14 ASP middle . . 15 A 15 HIS middle . . 16 A 16 LEU middle . . 17 A 17 ALA middle . . 18 A 18 ASP middle . . 19 A 19 SER middle . . 20 A 20 ASN middle . . 21 A 21 PHE middle . . 22 A 22 ASP middle . . 23 A 23 ILE middle . . 24 A 24 ALA middle . . 25 A 25 SER middle . . 26 A 26 VAL middle . . 27 A 27 ALA middle . . 28 A 28 GLN middle . . 29 A 29 HIS middle . . 30 A 30 VAL middle . . 31 A 31 CYS middle . . 32 A 32 LEU middle . . 33 A 33 SER middle . . 34 A 34 PRO middle . false 35 A 35 SER middle . . 36 A 36 ARG middle . . 37 A 37 LEU middle . . 38 A 38 SER middle . . 39 A 39 HIS middle . . 40 A 40 LEU middle . . 41 A 41 PHE middle . . 42 A 42 ARG middle . . 43 A 43 GLN middle . . 44 A 44 GLN middle . . 45 A 45 LEU middle . . 46 A 46 GLY middle . false 47 A 47 ILE middle . . 48 A 48 SER middle . . 49 A 49 VAL middle . . 50 A 50 LEU middle . . 51 A 51 SER middle . . 52 A 52 TRP middle . . 53 A 53 ARG middle . . 54 A 54 GLU middle . . 55 A 55 ASP middle . . 56 A 56 GLN middle . . 57 A 57 ARG middle . . 58 A 58 ILE middle . . 59 A 59 SER middle . . 60 A 60 GLN middle . . 61 A 61 ALA middle . . 62 A 62 LYS middle . . 63 A 63 LEU middle . . 64 A 64 LEU middle . . 65 A 65 LEU middle . . 66 A 66 SER middle . . 67 A 67 THR middle . . 68 A 68 THR middle . . 69 A 69 ARG middle . . 70 A 70 MET middle . . 71 A 71 PRO middle . false 72 A 72 ILE middle . . 73 A 73 ALA middle . . 74 A 74 THR middle . . 75 A 75 VAL middle . . 76 A 76 GLY middle . false 77 A 77 ARG middle . . 78 A 78 ASN middle . . 79 A 79 VAL middle . . 80 A 80 GLY middle . false 81 A 81 PHE middle . . 82 A 82 ASP middle . . 83 A 83 ASP middle . . 84 A 84 GLN middle . . 85 A 85 LEU middle . . 86 A 86 TYR middle . . 87 A 87 PHE middle . . 88 A 88 SER middle . . 89 A 89 ARG middle . . 90 A 90 VAL middle . . 91 A 91 PHE middle . . 92 A 92 LYS middle . . 93 A 93 LYS middle . . 94 A 94 CYS middle . . 95 A 95 THR middle . . 96 A 96 GLY middle . false 97 A 97 ALA middle . . 98 A 98 SER middle . . 99 A 99 PRO middle . false 100 A 100 SER middle . . 101 A 101 GLU middle . . 102 A 102 PHE middle . . 103 A 103 ARG middle . . 104 A 104 ALA middle . . 105 A 105 GLY middle . false 106 A 106 CYS middle . . 107 A 107 GLU end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET HA H 1 4.138 0.035 A 1 MET HBx H 1 2.037 0.035 A 1 MET HBy H 1 2.185 0.035 A 1 MET HE% H 1 2.017 0.035 A 1 MET HGx H 1 2.412 0.035 A 1 MET HGy H 1 2.547 0.035 A 1 MET C C 13 172.079 0.400 A 1 MET CA C 13 54.506 0.400 A 1 MET CB C 13 33.231 0.400 A 1 MET CE C 13 16.709 0.400 A 1 MET CG C 13 30.199 0.400 A 2 ASP H H 1 8.989 0.035 A 2 ASP HA H 1 4.662 0.035 A 2 ASP HBx H 1 2.622 0.035 A 2 ASP HBy H 1 2.824 0.035 A 2 ASP C C 13 177.024 0.400 A 2 ASP CA C 13 54.092 0.400 A 2 ASP CB C 13 42.743 0.400 A 2 ASP N N 15 126.287 0.400 A 3 ASN H H 1 9.165 0.035 A 3 ASN HA H 1 4.446 0.035 A 3 ASN HBx H 1 2.890 0.035 A 3 ASN HBy H 1 2.890 0.035 A 3 ASN HD2y H 1 7.764 0.035 A 3 ASN HD2x H 1 7.076 0.035 A 3 ASN C C 13 177.306 0.400 A 3 ASN CA C 13 56.355 0.400 A 3 ASN CB C 13 38.382 0.400 A 3 ASN CG C 13 176.313 0.400 A 3 ASN N N 15 124.055 0.400 A 3 ASN ND2 N 15 114.135 0.400 A 4 ARG H H 1 9.092 0.035 A 4 ARG HA H 1 4.183 0.035 A 4 ARG HBx H 1 1.619 0.035 A 4 ARG HBy H 1 2.051 0.035 A 4 ARG HDx H 1 3.140 0.035 A 4 ARG HDy H 1 3.163 0.035 A 4 ARG HGx H 1 1.861 0.035 A 4 ARG HGy H 1 1.929 0.035 A 4 ARG C C 13 178.824 0.400 A 4 ARG CA C 13 59.401 0.400 A 4 ARG CB C 13 29.437 0.400 A 4 ARG CD C 13 43.021 0.400 A 4 ARG CG C 13 27.522 0.400 A 4 ARG N N 15 119.970 0.400 A 5 VAL H H 1 7.588 0.035 A 5 VAL HA H 1 3.458 0.035 A 5 VAL HB H 1 2.067 0.035 A 5 VAL HGx% H 1 0.438 0.035 A 5 VAL HGy% H 1 0.782 0.035 A 5 VAL C C 13 177.573 0.400 A 5 VAL CA C 13 66.543 0.400 A 5 VAL CB C 13 31.294 0.400 A 5 VAL CG1 C 13 21.895 0.400 A 5 VAL CG2 C 13 24.286 0.400 A 5 VAL N N 15 119.312 0.400 A 6 ARG H H 1 7.920 0.035 A 6 ARG HA H 1 3.860 0.035 A 6 ARG HBx H 1 1.844 0.035 A 6 ARG HBy H 1 1.993 0.035 A 6 ARG HDx H 1 3.289 0.035 A 6 ARG HDy H 1 3.289 0.035 A 6 ARG HGx H 1 1.630 0.035 A 6 ARG HGy H 1 1.715 0.035 A 6 ARG C C 13 179.380 0.400 A 6 ARG CA C 13 60.197 0.400 A 6 ARG CB C 13 29.818 0.400 A 6 ARG CD C 13 43.041 0.400 A 6 ARG CG C 13 27.084 0.400 A 6 ARG N N 15 120.863 0.400 A 7 GLU H H 1 8.262 0.035 A 7 GLU HA H 1 4.241 0.035 A 7 GLU HBx H 1 2.065 0.035 A 7 GLU HBy H 1 2.255 0.035 A 7 GLU HGx H 1 2.419 0.035 A 7 GLU HGy H 1 2.503 0.035 A 7 GLU C C 13 179.131 0.400 A 7 GLU CA C 13 58.770 0.400 A 7 GLU CB C 13 28.883 0.400 A 7 GLU CG C 13 35.844 0.400 A 7 GLU N N 15 119.166 0.400 A 8 ALA H H 1 8.421 0.035 A 8 ALA HA H 1 4.046 0.035 A 8 ALA HB% H 1 1.682 0.035 A 8 ALA C C 13 179.202 0.400 A 8 ALA CA C 13 55.610 0.400 A 8 ALA CB C 13 18.512 0.400 A 8 ALA N N 15 123.947 0.400 A 9 CYS H H 1 8.490 0.035 A 9 CYS HA H 1 3.767 0.035 A 9 CYS HBx H 1 2.765 0.035 A 9 CYS HBy H 1 2.981 0.035 A 9 CYS C C 13 176.858 0.400 A 9 CYS CA C 13 64.480 0.400 A 9 CYS CB C 13 26.690 0.400 A 9 CYS N N 15 116.232 0.400 A 10 GLN H H 1 8.088 0.035 A 10 GLN HA H 1 4.022 0.035 A 10 GLN HBx H 1 2.176 0.035 A 10 GLN HBy H 1 2.289 0.035 A 10 GLN HE2y H 1 7.853 0.035 A 10 GLN HE2x H 1 6.935 0.035 A 10 GLN HGx H 1 2.467 0.035 A 10 GLN HGy H 1 2.511 0.035 A 10 GLN C C 13 177.140 0.400 A 10 GLN CA C 13 58.804 0.400 A 10 GLN CB C 13 28.299 0.400 A 10 GLN CD C 13 180.391 0.400 A 10 GLN CG C 13 33.487 0.400 A 10 GLN N N 15 120.817 0.400 A 10 GLN NE2 N 15 115.693 0.400 A 11 TYR H H 1 8.367 0.035 A 11 TYR HA H 1 4.308 0.035 A 11 TYR HBx H 1 2.833 0.035 A 11 TYR HBy H 1 3.220 0.035 A 11 TYR HDx H 1 6.644 0.035 A 11 TYR HDy H 1 6.644 0.035 A 11 TYR HEx H 1 6.490 0.035 A 11 TYR HEy H 1 6.490 0.035 A 11 TYR C C 13 178.986 0.400 A 11 TYR CA C 13 61.850 0.400 A 11 TYR CB C 13 38.653 0.400 A 11 TYR CDx C 13 132.391 0.400 A 11 TYR CDy C 13 132.490 0.400 A 11 TYR CEx C 13 117.579 0.400 A 11 TYR CEy C 13 117.579 0.400 A 11 TYR N N 15 120.419 0.400 A 12 ILE H H 1 8.886 0.035 A 12 ILE HA H 1 3.700 0.035 A 12 ILE HB H 1 2.420 0.035 A 12 ILE HD1% H 1 1.035 0.035 A 12 ILE HG1x H 1 1.192 0.035 A 12 ILE HG1y H 1 2.419 0.035 A 12 ILE HG2% H 1 1.113 0.035 A 12 ILE C C 13 179.352 0.400 A 12 ILE CA C 13 65.621 0.400 A 12 ILE CB C 13 38.203 0.400 A 12 ILE CD1 C 13 14.947 0.400 A 12 ILE CG1 C 13 30.672 0.400 A 12 ILE CG2 C 13 17.467 0.400 A 12 ILE N N 15 119.720 0.400 A 13 SER H H 1 8.740 0.035 A 13 SER HA H 1 4.753 0.035 A 13 SER HBx H 1 4.085 0.035 A 13 SER HBy H 1 4.186 0.035 A 13 SER C C 13 176.355 0.400 A 13 SER CA C 13 62.551 0.400 A 13 SER CB C 13 62.468 0.400 A 13 SER N N 15 116.217 0.400 A 14 ASP H H 1 8.426 0.035 A 14 ASP HA H 1 4.438 0.035 A 14 ASP HBx H 1 2.321 0.035 A 14 ASP HBy H 1 2.604 0.035 A 14 ASP C C 13 176.838 0.400 A 14 ASP CA C 13 55.988 0.400 A 14 ASP CB C 13 40.500 0.400 A 14 ASP N N 15 121.201 0.400 A 15 HIS H H 1 7.530 0.035 A 15 HIS HA H 1 4.661 0.035 A 15 HIS HBx H 1 2.477 0.035 A 15 HIS HBy H 1 3.697 0.035 A 15 HIS HD2 H 1 6.712 0.035 A 15 HIS HE1 H 1 8.440 0.035 A 15 HIS C C 13 175.451 0.400 A 15 HIS CA C 13 55.320 0.400 A 15 HIS CB C 13 28.275 0.400 A 15 HIS CD2 C 13 120.036 0.400 A 15 HIS CE1 C 13 135.550 0.400 A 15 HIS N N 15 116.777 0.400 A 16 LEU H H 1 7.271 0.035 A 16 LEU HA H 1 3.812 0.035 A 16 LEU HBx H 1 1.566 0.035 A 16 LEU HBy H 1 1.924 0.035 A 16 LEU HDx% H 1 0.865 0.035 A 16 LEU HDy% H 1 0.798 0.035 A 16 LEU HG H 1 1.959 0.035 A 16 LEU C C 13 176.627 0.400 A 16 LEU CA C 13 58.076 0.400 A 16 LEU CB C 13 42.531 0.400 A 16 LEU CD1 C 13 25.104 0.400 A 16 LEU CD2 C 13 24.672 0.400 A 16 LEU CG C 13 26.273 0.400 A 16 LEU N N 15 122.531 0.400 A 17 ALA H H 1 8.243 0.035 A 17 ALA HA H 1 3.937 0.035 A 17 ALA HB% H 1 1.303 0.035 A 17 ALA C C 13 177.131 0.400 A 17 ALA CA C 13 51.802 0.400 A 17 ALA CB C 13 18.473 0.400 A 17 ALA N N 15 116.354 0.400 A 18 ASP H H 1 7.488 0.035 A 18 ASP HA H 1 4.455 0.035 A 18 ASP HBx H 1 2.835 0.035 A 18 ASP HBy H 1 2.969 0.035 A 18 ASP C C 13 177.370 0.400 A 18 ASP CA C 13 54.571 0.400 A 18 ASP CB C 13 40.521 0.400 A 18 ASP N N 15 119.230 0.400 A 19 SER H H 1 8.793 0.035 A 19 SER HA H 1 4.424 0.035 A 19 SER HBx H 1 3.934 0.035 A 19 SER HBy H 1 3.959 0.035 A 19 SER C C 13 174.779 0.400 A 19 SER CA C 13 59.706 0.400 A 19 SER CB C 13 63.351 0.400 A 19 SER N N 15 119.892 0.400 A 20 ASN H H 1 8.520 0.035 A 20 ASN HA H 1 4.869 0.035 A 20 ASN HBx H 1 2.777 0.035 A 20 ASN HBy H 1 2.826 0.035 A 20 ASN HD2y H 1 7.680 0.035 A 20 ASN HD2x H 1 6.951 0.035 A 20 ASN C C 13 173.838 0.400 A 20 ASN CA C 13 52.586 0.400 A 20 ASN CB C 13 38.799 0.400 A 20 ASN CG C 13 177.633 0.400 A 20 ASN N N 15 119.769 0.400 A 20 ASN ND2 N 15 113.830 0.400 A 21 PHE H H 1 8.082 0.035 A 21 PHE HA H 1 4.397 0.035 A 21 PHE HBy H 1 3.081 0.035 A 21 PHE HBx H 1 2.831 0.035 A 21 PHE HDx H 1 7.263 0.035 A 21 PHE HDy H 1 7.263 0.035 A 21 PHE HEx H 1 7.109 0.035 A 21 PHE HEy H 1 7.109 0.035 A 21 PHE HZ H 1 6.907 0.035 A 21 PHE C C 13 173.520 0.400 A 21 PHE CA C 13 58.672 0.400 A 21 PHE CB C 13 40.704 0.400 A 21 PHE CDx C 13 132.240 0.400 A 21 PHE CDy C 13 132.289 0.400 A 21 PHE CEx C 13 130.433 0.400 A 21 PHE CEy C 13 130.567 0.400 A 21 PHE CZ C 13 128.227 0.400 A 21 PHE N N 15 121.875 0.400 A 22 ASP H H 1 7.570 0.035 A 22 ASP HA H 1 4.563 0.035 A 22 ASP HBx H 1 2.630 0.035 A 22 ASP HBy H 1 2.722 0.035 A 22 ASP C C 13 175.674 0.400 A 22 ASP CA C 13 52.049 0.400 A 22 ASP CB C 13 43.023 0.400 A 22 ASP N N 15 126.780 0.400 A 23 ILE H H 1 8.720 0.035 A 23 ILE HA H 1 3.555 0.035 A 23 ILE HB H 1 1.852 0.035 A 23 ILE HD1% H 1 0.953 0.035 A 23 ILE HG1x H 1 1.258 0.035 A 23 ILE HG1y H 1 1.511 0.035 A 23 ILE HG2% H 1 0.958 0.035 A 23 ILE C C 13 176.441 0.400 A 23 ILE CA C 13 63.650 0.400 A 23 ILE CB C 13 37.741 0.400 A 23 ILE CD1 C 13 13.820 0.400 A 23 ILE CG1 C 13 29.547 0.400 A 23 ILE CG2 C 13 17.319 0.400 A 23 ILE N N 15 124.815 0.400 A 24 ALA H H 1 8.543 0.035 A 24 ALA HA H 1 3.917 0.035 A 24 ALA HB% H 1 1.449 0.035 A 24 ALA C C 13 180.227 0.400 A 24 ALA CA C 13 55.413 0.400 A 24 ALA CB C 13 17.760 0.400 A 24 ALA N N 15 123.943 0.400 A 25 SER H H 1 7.844 0.035 A 25 SER HA H 1 4.246 0.035 A 25 SER HBy H 1 3.892 0.035 A 25 SER C C 13 176.667 0.400 A 25 SER CA C 13 61.238 0.400 A 25 SER CB C 13 62.402 0.400 A 25 SER N N 15 114.143 0.400 A 26 VAL H H 1 7.086 0.035 A 26 VAL HA H 1 3.198 0.035 A 26 VAL HB H 1 2.177 0.035 A 26 VAL HGx% H 1 1.083 0.035 A 26 VAL HGy% H 1 1.155 0.035 A 26 VAL C C 13 176.670 0.400 A 26 VAL CA C 13 64.809 0.400 A 26 VAL CB C 13 31.274 0.400 A 26 VAL CG1 C 13 22.179 0.400 A 26 VAL CG2 C 13 22.917 0.400 A 26 VAL N N 15 122.369 0.400 A 27 ALA H H 1 8.043 0.035 A 27 ALA HA H 1 3.775 0.035 A 27 ALA HB% H 1 1.371 0.035 A 27 ALA C C 13 178.948 0.400 A 27 ALA CA C 13 55.507 0.400 A 27 ALA CB C 13 17.412 0.400 A 27 ALA N N 15 122.045 0.400 A 28 GLN H H 1 8.089 0.035 A 28 GLN HA H 1 4.053 0.035 A 28 GLN HBx H 1 2.084 0.035 A 28 GLN HBy H 1 2.176 0.035 A 28 GLN HE2y H 1 7.447 0.035 A 28 GLN HE2x H 1 6.822 0.035 A 28 GLN HGx H 1 2.401 0.035 A 28 GLN HGy H 1 2.505 0.035 A 28 GLN C C 13 179.289 0.400 A 28 GLN CA C 13 58.625 0.400 A 28 GLN CB C 13 28.155 0.400 A 28 GLN CD C 13 180.155 0.400 A 28 GLN CG C 13 33.714 0.400 A 28 GLN N N 15 116.168 0.400 A 28 GLN NE2 N 15 111.482 0.400 A 29 HIS H H 1 7.454 0.035 A 29 HIS HA H 1 4.209 0.035 A 29 HIS HBx H 1 2.638 0.035 A 29 HIS HBy H 1 3.103 0.035 A 29 HIS HD2 H 1 6.649 0.035 A 29 HIS HE1 H 1 8.703 0.035 A 29 HIS C C 13 175.895 0.400 A 29 HIS CA C 13 59.132 0.400 A 29 HIS CB C 13 28.947 0.400 A 29 HIS CD2 C 13 119.052 0.400 A 29 HIS CE1 C 13 137.719 0.400 A 29 HIS N N 15 118.117 0.400 A 30 VAL H H 1 7.309 0.035 A 30 VAL HA H 1 4.441 0.035 A 30 VAL HB H 1 2.562 0.035 A 30 VAL HGx% H 1 1.046 0.035 A 30 VAL HGy% H 1 0.991 0.035 A 30 VAL C C 13 173.598 0.400 A 30 VAL CA C 13 59.948 0.400 A 30 VAL CB C 13 31.067 0.400 A 30 VAL CG1 C 13 21.623 0.400 A 30 VAL CG2 C 13 19.268 0.400 A 30 VAL N N 15 106.791 0.400 A 31 CYS H H 1 7.837 0.035 A 31 CYS HA H 1 3.929 0.035 A 31 CYS HBx H 1 3.086 0.035 A 31 CYS HBy H 1 3.086 0.035 A 31 CYS C C 13 173.679 0.400 A 31 CYS CA C 13 59.814 0.400 A 31 CYS CB C 13 24.898 0.400 A 31 CYS N N 15 116.363 0.400 A 32 LEU H H 1 8.061 0.035 A 32 LEU HA H 1 4.871 0.035 A 32 LEU HBx H 1 1.351 0.035 A 32 LEU HBy H 1 1.523 0.035 A 32 LEU HDx% H 1 0.738 0.035 A 32 LEU HDy% H 1 0.997 0.035 A 32 LEU HG H 1 1.702 0.035 A 32 LEU C C 13 176.243 0.400 A 32 LEU CA C 13 52.555 0.400 A 32 LEU CB C 13 48.238 0.400 A 32 LEU CD1 C 13 26.598 0.400 A 32 LEU CD2 C 13 23.544 0.400 A 32 LEU CG C 13 25.942 0.400 A 32 LEU N N 15 118.159 0.400 A 33 SER H H 1 8.221 0.035 A 33 SER N N 15 116.259 0.400 A 34 PRO HA H 1 3.951 0.035 A 34 PRO HBx H 1 2.113 0.035 A 34 PRO HBy H 1 2.165 0.035 A 34 PRO HDx H 1 3.891 0.035 A 34 PRO HDy H 1 4.018 0.035 A 34 PRO HGx H 1 1.817 0.035 A 34 PRO HGy H 1 2.385 0.035 A 34 PRO C C 13 178.473 0.400 A 34 PRO CA C 13 66.404 0.400 A 34 PRO CB C 13 31.712 0.400 A 34 PRO CD C 13 49.964 0.400 A 34 PRO CG C 13 28.155 0.400 A 35 SER H H 1 8.343 0.035 A 35 SER HA H 1 4.192 0.035 A 35 SER HBy H 1 3.862 0.035 A 35 SER C C 13 177.361 0.400 A 35 SER CA C 13 61.358 0.400 A 35 SER CB C 13 62.140 0.400 A 35 SER N N 15 111.653 0.400 A 36 ARG H H 1 7.868 0.035 A 36 ARG HA H 1 4.243 0.035 A 36 ARG HBx H 1 1.993 0.035 A 36 ARG HBy H 1 1.993 0.035 A 36 ARG HDx H 1 3.289 0.035 A 36 ARG HDy H 1 3.386 0.035 A 36 ARG HGx H 1 1.767 0.035 A 36 ARG HGy H 1 1.808 0.035 A 36 ARG C C 13 178.850 0.400 A 36 ARG CA C 13 58.714 0.400 A 36 ARG CB C 13 29.804 0.400 A 36 ARG CD C 13 42.942 0.400 A 36 ARG CG C 13 27.408 0.400 A 36 ARG N N 15 124.303 0.400 A 37 LEU H H 1 8.593 0.035 A 37 LEU HA H 1 4.052 0.035 A 37 LEU HBx H 1 1.310 0.035 A 37 LEU HBy H 1 1.949 0.035 A 37 LEU HDx% H 1 0.808 0.035 A 37 LEU HDy% H 1 0.942 0.035 A 37 LEU HG H 1 1.513 0.035 A 37 LEU C C 13 177.894 0.400 A 37 LEU CA C 13 58.289 0.400 A 37 LEU CB C 13 40.775 0.400 A 37 LEU CD1 C 13 26.181 0.400 A 37 LEU CD2 C 13 22.998 0.400 A 37 LEU CG C 13 27.171 0.400 A 37 LEU N N 15 119.319 0.400 A 38 SER H H 1 8.478 0.035 A 38 SER HA H 1 4.066 0.035 A 38 SER C C 13 176.577 0.400 A 38 SER CA C 13 62.824 0.400 A 38 SER N N 15 113.612 0.400 A 39 HIS H H 1 7.983 0.035 A 39 HIS HA H 1 4.403 0.035 A 39 HIS HBx H 1 3.388 0.035 A 39 HIS HBy H 1 3.388 0.035 A 39 HIS HD2 H 1 7.228 0.035 A 39 HIS HE1 H 1 8.462 0.035 A 39 HIS C C 13 177.138 0.400 A 39 HIS CA C 13 59.316 0.400 A 39 HIS CB C 13 29.226 0.400 A 39 HIS CD2 C 13 119.891 0.400 A 39 HIS CE1 C 13 136.980 0.400 A 39 HIS N N 15 119.938 0.400 A 40 LEU H H 1 8.432 0.035 A 40 LEU HA H 1 4.045 0.035 A 40 LEU HBy H 1 1.863 0.035 A 40 LEU HBx H 1 1.493 0.035 A 40 LEU HDx% H 1 0.887 0.035 A 40 LEU HDy% H 1 0.902 0.035 A 40 LEU HG H 1 1.761 0.035 A 40 LEU C C 13 178.876 0.400 A 40 LEU CA C 13 57.990 0.400 A 40 LEU CB C 13 42.609 0.400 A 40 LEU CD1 C 13 23.604 0.400 A 40 LEU CD2 C 13 25.128 0.400 A 40 LEU CG C 13 26.811 0.400 A 40 LEU N N 15 120.053 0.400 A 41 PHE H H 1 8.937 0.035 A 41 PHE HA H 1 3.736 0.035 A 41 PHE HBx H 1 3.072 0.035 A 41 PHE HBy H 1 3.454 0.035 A 41 PHE HDx H 1 7.076 0.035 A 41 PHE HDy H 1 7.076 0.035 A 41 PHE HEx H 1 6.831 0.035 A 41 PHE HEy H 1 6.831 0.035 A 41 PHE HZ H 1 6.032 0.035 A 41 PHE C C 13 178.022 0.400 A 41 PHE CA C 13 62.523 0.400 A 41 PHE CB C 13 39.534 0.400 A 41 PHE CDx C 13 131.425 0.400 A 41 PHE CDy C 13 131.491 0.400 A 41 PHE CEx C 13 131.515 0.400 A 41 PHE CEy C 13 131.536 0.400 A 41 PHE CZ C 13 129.331 0.400 A 41 PHE N N 15 120.491 0.400 A 42 ARG H H 1 8.009 0.035 A 42 ARG HA H 1 4.021 0.035 A 42 ARG HBx H 1 1.928 0.035 A 42 ARG HBy H 1 1.966 0.035 A 42 ARG HDy H 1 3.147 0.035 A 42 ARG HGx H 1 1.569 0.035 A 42 ARG HGy H 1 1.735 0.035 A 42 ARG C C 13 179.850 0.400 A 42 ARG CA C 13 59.243 0.400 A 42 ARG CB C 13 29.748 0.400 A 42 ARG CD C 13 43.107 0.400 A 42 ARG CG C 13 27.825 0.400 A 42 ARG N N 15 117.688 0.400 A 43 GLN H H 1 8.286 0.035 A 43 GLN HA H 1 4.006 0.035 A 43 GLN HBx H 1 2.120 0.035 A 43 GLN HBy H 1 2.139 0.035 A 43 GLN HE2y H 1 7.449 0.035 A 43 GLN HE2x H 1 6.837 0.035 A 43 GLN HGx H 1 2.254 0.035 A 43 GLN HGy H 1 2.411 0.035 A 43 GLN C C 13 177.917 0.400 A 43 GLN CA C 13 58.715 0.400 A 43 GLN CB C 13 29.345 0.400 A 43 GLN CD C 13 180.108 0.400 A 43 GLN CG C 13 33.934 0.400 A 43 GLN N N 15 118.179 0.400 A 43 GLN NE2 N 15 111.898 0.400 A 44 GLN H H 1 8.296 0.035 A 44 GLN HA H 1 4.208 0.035 A 44 GLN HBx H 1 1.911 0.035 A 44 GLN HBy H 1 2.065 0.035 A 44 GLN HE2y H 1 7.480 0.035 A 44 GLN HE2x H 1 6.951 0.035 A 44 GLN HGx H 1 2.417 0.035 A 44 GLN HGy H 1 2.455 0.035 A 44 GLN C C 13 177.314 0.400 A 44 GLN CA C 13 57.913 0.400 A 44 GLN CB C 13 29.027 0.400 A 44 GLN CD C 13 178.731 0.400 A 44 GLN CG C 13 34.736 0.400 A 44 GLN N N 15 114.928 0.400 A 44 GLN NE2 N 15 112.182 0.400 A 45 LEU H H 1 8.463 0.035 A 45 LEU HA H 1 4.567 0.035 A 45 LEU HBy H 1 1.709 0.035 A 45 LEU HBx H 1 1.474 0.035 A 45 LEU HDx% H 1 -0.174 0.035 A 45 LEU HDy% H 1 0.529 0.035 A 45 LEU HG H 1 0.999 0.035 A 45 LEU C C 13 178.381 0.400 A 45 LEU CA C 13 54.564 0.400 A 45 LEU CB C 13 43.031 0.400 A 45 LEU CD1 C 13 25.068 0.400 A 45 LEU CD2 C 13 23.061 0.400 A 45 LEU CG C 13 27.599 0.400 A 45 LEU N N 15 117.028 0.400 A 46 GLY H H 1 7.852 0.035 A 46 GLY HAx H 1 4.005 0.035 A 46 GLY HAy H 1 4.167 0.035 A 46 GLY C C 13 173.114 0.400 A 46 GLY CA C 13 46.080 0.400 A 46 GLY N N 15 108.569 0.400 A 47 ILE H H 1 7.281 0.035 A 47 ILE HA H 1 4.735 0.035 A 47 ILE HB H 1 2.064 0.035 A 47 ILE HD1% H 1 1.100 0.035 A 47 ILE HG1x H 1 1.450 0.035 A 47 ILE HG1y H 1 1.762 0.035 A 47 ILE HG2% H 1 1.027 0.035 A 47 ILE C C 13 172.231 0.400 A 47 ILE CA C 13 59.240 0.400 A 47 ILE CB C 13 42.470 0.400 A 47 ILE CD1 C 13 17.581 0.400 A 47 ILE CG1 C 13 26.658 0.400 A 47 ILE CG2 C 13 14.133 0.400 A 47 ILE N N 15 115.396 0.400 A 48 SER H H 1 8.298 0.035 A 48 SER HA H 1 4.725 0.035 A 48 SER HBx H 1 4.071 0.035 A 48 SER HBy H 1 4.599 0.035 A 48 SER C C 13 174.600 0.400 A 48 SER CA C 13 57.092 0.400 A 48 SER CB C 13 65.286 0.400 A 48 SER N N 15 115.685 0.400 A 49 VAL H H 1 8.296 0.035 A 49 VAL HA H 1 3.081 0.035 A 49 VAL HB H 1 1.813 0.035 A 49 VAL HGx% H 1 0.180 0.035 A 49 VAL HGy% H 1 0.709 0.035 A 49 VAL C C 13 177.888 0.400 A 49 VAL CA C 13 65.881 0.400 A 49 VAL CB C 13 31.149 0.400 A 49 VAL CG1 C 13 21.107 0.400 A 49 VAL CG2 C 13 21.373 0.400 A 49 VAL N N 15 120.175 0.400 A 50 LEU H H 1 8.138 0.035 A 50 LEU HA H 1 4.011 0.035 A 50 LEU HBx H 1 1.639 0.035 A 50 LEU HBy H 1 1.805 0.035 A 50 LEU HDx% H 1 1.051 0.035 A 50 LEU HDy% H 1 0.997 0.035 A 50 LEU HG H 1 1.637 0.035 A 50 LEU C C 13 180.412 0.400 A 50 LEU CA C 13 57.962 0.400 A 50 LEU CB C 13 41.224 0.400 A 50 LEU CD1 C 13 24.879 0.400 A 50 LEU CD2 C 13 23.568 0.400 A 50 LEU CG C 13 27.809 0.400 A 50 LEU N N 15 116.998 0.400 A 51 SER H H 1 8.087 0.035 A 51 SER HA H 1 4.279 0.035 A 51 SER HBy H 1 4.096 0.035 A 51 SER C C 13 176.081 0.400 A 51 SER CA C 13 62.174 0.400 A 51 SER N N 15 117.207 0.400 A 52 TRP H H 1 8.913 0.035 A 52 TRP HA H 1 4.067 0.035 A 52 TRP HBx H 1 3.498 0.035 A 52 TRP HBy H 1 3.728 0.035 A 52 TRP HD1 H 1 7.365 0.035 A 52 TRP HE1 H 1 10.427 0.035 A 52 TRP HE3 H 1 7.414 0.035 A 52 TRP HH2 H 1 7.225 0.035 A 52 TRP HZ2 H 1 7.474 0.035 A 52 TRP HZ3 H 1 7.048 0.035 A 52 TRP C C 13 178.579 0.400 A 52 TRP CA C 13 63.288 0.400 A 52 TRP CB C 13 29.159 0.400 A 52 TRP CD1 C 13 127.023 0.400 A 52 TRP CE3 C 13 119.421 0.400 A 52 TRP CH2 C 13 124.468 0.400 A 52 TRP CZ2 C 13 115.298 0.400 A 52 TRP CZ3 C 13 121.288 0.400 A 52 TRP N N 15 124.958 0.400 A 52 TRP NE1 N 15 130.955 0.400 A 53 ARG H H 1 8.547 0.035 A 53 ARG HA H 1 3.578 0.035 A 53 ARG HBy H 1 1.535 0.035 A 53 ARG HDx H 1 2.090 0.035 A 53 ARG HDy H 1 2.541 0.035 A 53 ARG HGx H 1 1.175 0.035 A 53 ARG HGy H 1 1.308 0.035 A 53 ARG C C 13 177.290 0.400 A 53 ARG CA C 13 60.443 0.400 A 53 ARG CB C 13 30.001 0.400 A 53 ARG CD C 13 42.899 0.400 A 53 ARG CG C 13 28.433 0.400 A 53 ARG N N 15 118.356 0.400 A 54 GLU H H 1 8.002 0.035 A 54 GLU HA H 1 4.016 0.035 A 54 GLU HBx H 1 2.192 0.035 A 54 GLU HBy H 1 2.254 0.035 A 54 GLU HGx H 1 2.304 0.035 A 54 GLU HGy H 1 2.347 0.035 A 54 GLU C C 13 178.460 0.400 A 54 GLU CA C 13 59.982 0.400 A 54 GLU CB C 13 29.759 0.400 A 54 GLU CG C 13 36.670 0.400 A 54 GLU N N 15 118.818 0.400 A 55 ASP H H 1 8.111 0.035 A 55 ASP HA H 1 4.289 0.035 A 55 ASP HBx H 1 2.454 0.035 A 55 ASP HBy H 1 2.673 0.035 A 55 ASP C C 13 179.313 0.400 A 55 ASP CA C 13 57.131 0.400 A 55 ASP CB C 13 40.227 0.400 A 55 ASP N N 15 119.156 0.400 A 56 GLN H H 1 8.099 0.035 A 56 GLN HA H 1 3.781 0.035 A 56 GLN HBx H 1 1.535 0.035 A 56 GLN HBy H 1 1.829 0.035 A 56 GLN HE2x H 1 6.565 0.035 A 56 GLN HE2y H 1 6.727 0.035 A 56 GLN HGx H 1 1.521 0.035 A 56 GLN HGy H 1 1.521 0.035 A 56 GLN C C 13 178.700 0.400 A 56 GLN CA C 13 57.487 0.400 A 56 GLN CB C 13 27.430 0.400 A 56 GLN CD C 13 179.334 0.400 A 56 GLN CG C 13 32.328 0.400 A 56 GLN N N 15 119.807 0.400 A 56 GLN NE2 N 15 113.889 0.400 A 57 ARG H H 1 8.240 0.035 A 57 ARG HA H 1 3.898 0.035 A 57 ARG HBy H 1 2.307 0.035 A 57 ARG HBx H 1 1.926 0.035 A 57 ARG HDx H 1 2.815 0.035 A 57 ARG HDy H 1 3.042 0.035 A 57 ARG HGx H 1 1.586 0.035 A 57 ARG HGy H 1 2.142 0.035 A 57 ARG C C 13 178.185 0.400 A 57 ARG CA C 13 60.671 0.400 A 57 ARG CB C 13 31.221 0.400 A 57 ARG CD C 13 44.960 0.400 A 57 ARG CG C 13 28.502 0.400 A 57 ARG N N 15 120.129 0.400 A 58 ILE H H 1 7.885 0.035 A 58 ILE HA H 1 3.978 0.035 A 58 ILE HB H 1 2.284 0.035 A 58 ILE HD1% H 1 0.775 0.035 A 58 ILE HG1x H 1 1.565 0.035 A 58 ILE HG1y H 1 2.017 0.035 A 58 ILE HG2% H 1 0.599 0.035 A 58 ILE C C 13 178.357 0.400 A 58 ILE CA C 13 61.684 0.400 A 58 ILE CB C 13 34.538 0.400 A 58 ILE CD1 C 13 8.408 0.400 A 58 ILE CG1 C 13 26.813 0.400 A 58 ILE CG2 C 13 17.805 0.400 A 58 ILE N N 15 118.096 0.400 A 59 SER H H 1 8.563 0.035 A 59 SER HA H 1 4.010 0.035 A 59 SER C C 13 177.731 0.400 A 59 SER CA C 13 62.459 0.400 A 59 SER N N 15 117.208 0.400 A 60 GLN H H 1 8.471 0.035 A 60 GLN HA H 1 4.228 0.035 A 60 GLN HBy H 1 2.147 0.035 A 60 GLN HBx H 1 2.038 0.035 A 60 GLN HE2y H 1 7.183 0.035 A 60 GLN HE2x H 1 6.785 0.035 A 60 GLN HGx H 1 2.249 0.035 A 60 GLN HGy H 1 2.397 0.035 A 60 GLN C C 13 177.958 0.400 A 60 GLN CA C 13 58.233 0.400 A 60 GLN CB C 13 27.288 0.400 A 60 GLN CD C 13 178.737 0.400 A 60 GLN CG C 13 33.070 0.400 A 60 GLN N N 15 121.780 0.400 A 60 GLN NE2 N 15 109.951 0.400 A 61 ALA H H 1 8.504 0.035 A 61 ALA HA H 1 3.947 0.035 A 61 ALA HB% H 1 1.809 0.035 A 61 ALA C C 13 179.360 0.400 A 61 ALA CA C 13 55.413 0.400 A 61 ALA CB C 13 18.124 0.400 A 61 ALA N N 15 122.352 0.400 A 62 LYS H H 1 8.776 0.035 A 62 LYS HA H 1 3.722 0.035 A 62 LYS HBx H 1 2.040 0.035 A 62 LYS HBy H 1 2.070 0.035 A 62 LYS HDx H 1 1.527 0.035 A 62 LYS HDy H 1 1.527 0.035 A 62 LYS HEx H 1 2.581 0.035 A 62 LYS HEy H 1 2.656 0.035 A 62 LYS HGx H 1 1.653 0.035 A 62 LYS HGy H 1 1.680 0.035 A 62 LYS C C 13 179.330 0.400 A 62 LYS CA C 13 60.632 0.400 A 62 LYS CB C 13 32.580 0.400 A 62 LYS CD C 13 29.966 0.400 A 62 LYS CE C 13 41.447 0.400 A 62 LYS CG C 13 25.744 0.400 A 62 LYS N N 15 117.072 0.400 A 63 LEU H H 1 7.670 0.035 A 63 LEU HA H 1 4.233 0.035 A 63 LEU HBx H 1 1.784 0.035 A 63 LEU HBy H 1 2.009 0.035 A 63 LEU HDx% H 1 0.938 0.035 A 63 LEU HDy% H 1 0.982 0.035 A 63 LEU HG H 1 1.561 0.035 A 63 LEU C C 13 180.902 0.400 A 63 LEU CA C 13 58.446 0.400 A 63 LEU CB C 13 41.598 0.400 A 63 LEU CD1 C 13 24.773 0.400 A 63 LEU CD2 C 13 24.280 0.400 A 63 LEU CG C 13 27.097 0.400 A 63 LEU N N 15 121.196 0.400 A 64 LEU H H 1 8.585 0.035 A 64 LEU HA H 1 4.088 0.035 A 64 LEU HBx H 1 1.450 0.035 A 64 LEU HBy H 1 2.028 0.035 A 64 LEU HDx% H 1 0.927 0.035 A 64 LEU HDy% H 1 0.859 0.035 A 64 LEU HG H 1 1.965 0.035 A 64 LEU C C 13 180.869 0.400 A 64 LEU CA C 13 57.782 0.400 A 64 LEU CB C 13 42.760 0.400 A 64 LEU CD1 C 13 25.513 0.400 A 64 LEU CD2 C 13 21.723 0.400 A 64 LEU CG C 13 27.093 0.400 A 64 LEU N N 15 121.842 0.400 A 65 LEU H H 1 9.100 0.035 A 65 LEU HA H 1 4.346 0.035 A 65 LEU HBx H 1 1.431 0.035 A 65 LEU HBy H 1 2.406 0.035 A 65 LEU HDx% H 1 0.525 0.035 A 65 LEU HDy% H 1 0.823 0.035 A 65 LEU HG H 1 2.003 0.035 A 65 LEU C C 13 178.659 0.400 A 65 LEU CA C 13 57.408 0.400 A 65 LEU CB C 13 43.013 0.400 A 65 LEU CD1 C 13 27.520 0.400 A 65 LEU CD2 C 13 23.114 0.400 A 65 LEU CG C 13 27.730 0.400 A 65 LEU N N 15 119.872 0.400 A 66 SER H H 1 8.303 0.035 A 66 SER HA H 1 4.211 0.035 A 66 SER HBy H 1 4.222 0.035 A 66 SER C C 13 176.580 0.400 A 66 SER CA C 13 60.155 0.400 A 66 SER CB C 13 65.198 0.400 A 66 SER N N 15 110.490 0.400 A 67 THR H H 1 7.901 0.035 A 67 THR HA H 1 4.812 0.035 A 67 THR HB H 1 4.485 0.035 A 67 THR HG2% H 1 1.407 0.035 A 67 THR C C 13 174.240 0.400 A 67 THR CA C 13 62.400 0.400 A 67 THR CB C 13 71.512 0.400 A 67 THR CG2 C 13 21.307 0.400 A 67 THR N N 15 108.414 0.400 A 68 THR H H 1 7.507 0.035 A 68 THR HA H 1 5.096 0.035 A 68 THR HB H 1 4.419 0.035 A 68 THR HG2% H 1 1.322 0.035 A 68 THR C C 13 174.263 0.400 A 68 THR CA C 13 60.124 0.400 A 68 THR CB C 13 72.795 0.400 A 68 THR CG2 C 13 21.163 0.400 A 68 THR N N 15 111.673 0.400 A 69 ARG H H 1 8.767 0.035 A 69 ARG HA H 1 4.422 0.035 A 69 ARG HBx H 1 1.605 0.035 A 69 ARG HBy H 1 2.183 0.035 A 69 ARG HDx H 1 3.193 0.035 A 69 ARG HDy H 1 3.193 0.035 A 69 ARG HGx H 1 1.615 0.035 A 69 ARG HGy H 1 1.711 0.035 A 69 ARG C C 13 176.568 0.400 A 69 ARG CA C 13 53.692 0.400 A 69 ARG CB C 13 28.814 0.400 A 69 ARG CD C 13 42.780 0.400 A 69 ARG CG C 13 26.833 0.400 A 69 ARG N N 15 118.034 0.400 A 70 MET H H 1 7.996 0.035 A 70 MET HA H 1 4.470 0.035 A 70 MET HBx H 1 1.729 0.035 A 70 MET HBy H 1 1.957 0.035 A 70 MET HE% H 1 2.085 0.035 A 70 MET HGx H 1 2.559 0.035 A 70 MET HGy H 1 2.587 0.035 A 70 MET CA C 13 55.386 0.400 A 70 MET CB C 13 34.080 0.400 A 70 MET CE C 13 16.819 0.400 A 70 MET CG C 13 31.619 0.400 A 70 MET N N 15 122.491 0.400 A 71 PRO HA H 1 4.574 0.035 A 71 PRO HBy H 1 2.593 0.035 A 71 PRO HBx H 1 1.967 0.035 A 71 PRO HDy H 1 4.098 0.035 A 71 PRO HDx H 1 3.566 0.035 A 71 PRO HGx H 1 2.144 0.035 A 71 PRO HGy H 1 2.242 0.035 A 71 PRO C C 13 177.204 0.400 A 71 PRO CA C 13 62.915 0.400 A 71 PRO CB C 13 32.380 0.400 A 71 PRO CD C 13 51.073 0.400 A 71 PRO CG C 13 27.968 0.400 A 72 ILE H H 1 8.782 0.035 A 72 ILE HA H 1 3.407 0.035 A 72 ILE HB H 1 1.929 0.035 A 72 ILE HD1% H 1 0.801 0.035 A 72 ILE HG1x H 1 1.229 0.035 A 72 ILE HG1y H 1 1.714 0.035 A 72 ILE HG2% H 1 0.981 0.035 A 72 ILE C C 13 177.760 0.400 A 72 ILE CA C 13 65.627 0.400 A 72 ILE CB C 13 36.771 0.400 A 72 ILE CD1 C 13 12.089 0.400 A 72 ILE CG1 C 13 29.298 0.400 A 72 ILE CG2 C 13 18.155 0.400 A 72 ILE N N 15 124.417 0.400 A 73 ALA H H 1 9.109 0.035 A 73 ALA HA H 1 3.974 0.035 A 73 ALA HB% H 1 1.501 0.035 A 73 ALA C C 13 180.248 0.400 A 73 ALA CA C 13 55.232 0.400 A 73 ALA CB C 13 18.338 0.400 A 73 ALA N N 15 119.077 0.400 A 74 THR H H 1 7.112 0.035 A 74 THR HA H 1 3.875 0.035 A 74 THR HB H 1 4.192 0.035 A 74 THR HG2% H 1 1.367 0.035 A 74 THR C C 13 175.761 0.400 A 74 THR CA C 13 65.841 0.400 A 74 THR CB C 13 68.248 0.400 A 74 THR CG2 C 13 22.477 0.400 A 74 THR N N 15 114.866 0.400 A 75 VAL H H 1 8.087 0.035 A 75 VAL HA H 1 3.305 0.035 A 75 VAL HB H 1 2.271 0.035 A 75 VAL HGx% H 1 0.897 0.035 A 75 VAL HGy% H 1 0.848 0.035 A 75 VAL C C 13 177.048 0.400 A 75 VAL CA C 13 67.681 0.400 A 75 VAL CB C 13 30.831 0.400 A 75 VAL CG1 C 13 22.159 0.400 A 75 VAL CG2 C 13 22.542 0.400 A 75 VAL N N 15 123.901 0.400 A 76 GLY H H 1 7.673 0.035 A 76 GLY HAx H 1 2.235 0.035 A 76 GLY HAy H 1 3.003 0.035 A 76 GLY C C 13 176.562 0.400 A 76 GLY CA C 13 46.293 0.400 A 76 GLY N N 15 102.438 0.400 A 77 ARG H H 1 7.760 0.035 A 77 ARG HA H 1 3.982 0.035 A 77 ARG HBx H 1 1.903 0.035 A 77 ARG HBy H 1 1.903 0.035 A 77 ARG HDx H 1 3.228 0.035 A 77 ARG HDy H 1 3.283 0.035 A 77 ARG HGx H 1 1.729 0.035 A 77 ARG HGy H 1 1.849 0.035 A 77 ARG C C 13 180.332 0.400 A 77 ARG CA C 13 59.550 0.400 A 77 ARG CB C 13 30.085 0.400 A 77 ARG CD C 13 43.349 0.400 A 77 ARG CG C 13 28.020 0.400 A 77 ARG N N 15 122.228 0.400 A 78 ASN H H 1 8.230 0.035 A 78 ASN HA H 1 4.397 0.035 A 78 ASN HBx H 1 2.594 0.035 A 78 ASN HBy H 1 2.873 0.035 A 78 ASN HD2y H 1 7.144 0.035 A 78 ASN HD2x H 1 6.719 0.035 A 78 ASN C C 13 176.105 0.400 A 78 ASN CA C 13 55.615 0.400 A 78 ASN CB C 13 38.806 0.400 A 78 ASN CG C 13 176.430 0.400 A 78 ASN N N 15 119.139 0.400 A 78 ASN ND2 N 15 110.816 0.400 A 79 VAL H H 1 7.323 0.035 A 79 VAL HA H 1 4.438 0.035 A 79 VAL HB H 1 2.473 0.035 A 79 VAL HGx% H 1 1.045 0.035 A 79 VAL HGy% H 1 0.908 0.035 A 79 VAL C C 13 174.220 0.400 A 79 VAL CA C 13 59.911 0.400 A 79 VAL CB C 13 31.400 0.400 A 79 VAL CG1 C 13 18.776 0.400 A 79 VAL CG2 C 13 20.867 0.400 A 79 VAL N N 15 108.664 0.400 A 80 GLY H H 1 7.286 0.035 A 80 GLY HAx H 1 3.540 0.035 A 80 GLY HAy H 1 4.023 0.035 A 80 GLY C C 13 174.383 0.400 A 80 GLY CA C 13 45.739 0.400 A 80 GLY N N 15 104.635 0.400 A 81 PHE H H 1 8.535 0.035 A 81 PHE HA H 1 4.845 0.035 A 81 PHE HBx H 1 2.588 0.035 A 81 PHE HBy H 1 2.943 0.035 A 81 PHE HDx H 1 7.094 0.035 A 81 PHE HDy H 1 7.094 0.035 A 81 PHE HEx H 1 6.841 0.035 A 81 PHE HEy H 1 6.841 0.035 A 81 PHE HZ H 1 6.532 0.035 A 81 PHE C C 13 174.570 0.400 A 81 PHE CA C 13 56.375 0.400 A 81 PHE CB C 13 39.941 0.400 A 81 PHE CDx C 13 131.491 0.400 A 81 PHE CDy C 13 131.491 0.400 A 81 PHE CEx C 13 131.536 0.400 A 81 PHE CEy C 13 131.536 0.400 A 81 PHE CZ C 13 130.043 0.400 A 81 PHE N N 15 119.772 0.400 A 82 ASP H H 1 8.564 0.035 A 82 ASP HA H 1 4.491 0.035 A 82 ASP HBx H 1 2.735 0.035 A 82 ASP HBy H 1 2.735 0.035 A 82 ASP C C 13 175.170 0.400 A 82 ASP CA C 13 55.195 0.400 A 82 ASP CB C 13 41.010 0.400 A 82 ASP N N 15 123.028 0.400 A 83 ASP H H 1 7.789 0.035 A 83 ASP HA H 1 4.947 0.035 A 83 ASP HBx H 1 2.704 0.035 A 83 ASP HBy H 1 3.087 0.035 A 83 ASP C C 13 176.347 0.400 A 83 ASP CA C 13 52.690 0.400 A 83 ASP CB C 13 43.152 0.400 A 83 ASP N N 15 118.576 0.400 A 84 GLN H H 1 9.104 0.035 A 84 GLN HA H 1 4.333 0.035 A 84 GLN HBx H 1 2.161 0.035 A 84 GLN HBy H 1 2.287 0.035 A 84 GLN HE2y H 1 7.594 0.035 A 84 GLN HE2x H 1 6.849 0.035 A 84 GLN HGx H 1 2.327 0.035 A 84 GLN HGy H 1 2.534 0.035 A 84 GLN C C 13 177.986 0.400 A 84 GLN CA C 13 58.909 0.400 A 84 GLN CB C 13 28.267 0.400 A 84 GLN CD C 13 178.996 0.400 A 84 GLN CG C 13 33.215 0.400 A 84 GLN N N 15 126.543 0.400 A 84 GLN NE2 N 15 111.480 0.400 A 85 LEU H H 1 8.419 0.035 A 85 LEU HA H 1 4.210 0.035 A 85 LEU HBx H 1 1.703 0.035 A 85 LEU HBy H 1 1.988 0.035 A 85 LEU HDx% H 1 1.013 0.035 A 85 LEU HDy% H 1 0.945 0.035 A 85 LEU HG H 1 1.705 0.035 A 85 LEU C C 13 179.472 0.400 A 85 LEU CA C 13 57.958 0.400 A 85 LEU CB C 13 40.678 0.400 A 85 LEU CD1 C 13 24.515 0.400 A 85 LEU CD2 C 13 23.654 0.400 A 85 LEU CG C 13 27.259 0.400 A 85 LEU N N 15 123.486 0.400 A 86 TYR H H 1 8.042 0.035 A 86 TYR HA H 1 4.288 0.035 A 86 TYR HBx H 1 3.270 0.035 A 86 TYR HBy H 1 3.299 0.035 A 86 TYR HDx H 1 7.332 0.035 A 86 TYR HDy H 1 7.332 0.035 A 86 TYR HEx H 1 6.985 0.035 A 86 TYR HEy H 1 6.985 0.035 A 86 TYR C C 13 177.195 0.400 A 86 TYR CA C 13 60.367 0.400 A 86 TYR CB C 13 38.184 0.400 A 86 TYR CDx C 13 132.798 0.400 A 86 TYR CDy C 13 132.909 0.400 A 86 TYR CEx C 13 118.470 0.400 A 86 TYR CEy C 13 118.470 0.400 A 86 TYR N N 15 122.679 0.400 A 87 PHE H H 1 8.219 0.035 A 87 PHE HA H 1 3.261 0.035 A 87 PHE HBx H 1 3.021 0.035 A 87 PHE HBy H 1 3.299 0.035 A 87 PHE HDx H 1 6.790 0.035 A 87 PHE HDy H 1 6.790 0.035 A 87 PHE HEx H 1 6.922 0.035 A 87 PHE HEy H 1 6.922 0.035 A 87 PHE HZ H 1 6.633 0.035 A 87 PHE C C 13 175.875 0.400 A 87 PHE CA C 13 58.536 0.400 A 87 PHE CB C 13 38.124 0.400 A 87 PHE CDx C 13 132.331 0.400 A 87 PHE CDy C 13 132.433 0.400 A 87 PHE CEx C 13 129.618 0.400 A 87 PHE CEy C 13 129.618 0.400 A 87 PHE CZ C 13 128.006 0.400 A 87 PHE N N 15 116.536 0.400 A 88 SER H H 1 8.082 0.035 A 88 SER HA H 1 3.951 0.035 A 88 SER HBy H 1 3.263 0.035 A 88 SER C C 13 175.926 0.400 A 88 SER CA C 13 62.398 0.400 A 88 SER N N 15 112.937 0.400 A 89 ARG H H 1 7.843 0.035 A 89 ARG HA H 1 3.975 0.035 A 89 ARG HBx H 1 1.849 0.035 A 89 ARG HBy H 1 1.972 0.035 A 89 ARG HDx H 1 3.210 0.035 A 89 ARG HDy H 1 3.252 0.035 A 89 ARG HGx H 1 1.588 0.035 A 89 ARG HGy H 1 1.847 0.035 A 89 ARG C C 13 179.414 0.400 A 89 ARG CA C 13 59.452 0.400 A 89 ARG CB C 13 30.242 0.400 A 89 ARG CD C 13 43.755 0.400 A 89 ARG CG C 13 27.524 0.400 A 89 ARG N N 15 121.621 0.400 A 90 VAL H H 1 8.235 0.035 A 90 VAL HA H 1 3.530 0.035 A 90 VAL HB H 1 1.641 0.035 A 90 VAL HGx% H 1 0.865 0.035 A 90 VAL HGy% H 1 0.719 0.035 A 90 VAL C C 13 177.752 0.400 A 90 VAL CA C 13 66.208 0.400 A 90 VAL CB C 13 31.649 0.400 A 90 VAL CG1 C 13 21.344 0.400 A 90 VAL CG2 C 13 22.696 0.400 A 90 VAL N N 15 122.095 0.400 A 91 PHE H H 1 8.763 0.035 A 91 PHE HA H 1 3.584 0.035 A 91 PHE HBx H 1 2.239 0.035 A 91 PHE HBy H 1 2.519 0.035 A 91 PHE C C 13 178.386 0.400 A 91 PHE CA C 13 62.523 0.400 A 91 PHE CB C 13 39.528 0.400 A 91 PHE N N 15 121.769 0.400 A 92 LYS H H 1 8.237 0.035 A 92 LYS HA H 1 4.217 0.035 A 92 LYS HBx H 1 1.629 0.035 A 92 LYS HBy H 1 1.882 0.035 A 92 LYS HDx H 1 1.476 0.035 A 92 LYS HDy H 1 1.538 0.035 A 92 LYS HEy H 1 2.902 0.035 A 92 LYS HGy H 1 1.313 0.035 A 92 LYS C C 13 179.621 0.400 A 92 LYS CA C 13 58.597 0.400 A 92 LYS CB C 13 32.290 0.400 A 92 LYS CD C 13 29.217 0.400 A 92 LYS CE C 13 42.009 0.400 A 92 LYS CG C 13 25.081 0.400 A 92 LYS N N 15 121.441 0.400 A 93 LYS H H 1 8.013 0.035 A 93 LYS HA H 1 3.956 0.035 A 93 LYS HBx H 1 1.922 0.035 A 93 LYS HBy H 1 2.084 0.035 A 93 LYS HDx H 1 1.670 0.035 A 93 LYS HDy H 1 1.753 0.035 A 93 LYS HEy H 1 2.991 0.035 A 93 LYS HGx H 1 1.413 0.035 A 93 LYS HGy H 1 1.561 0.035 A 93 LYS C C 13 178.611 0.400 A 93 LYS CA C 13 59.356 0.400 A 93 LYS CB C 13 31.785 0.400 A 93 LYS CD C 13 29.081 0.400 A 93 LYS CE C 13 41.825 0.400 A 93 LYS CG C 13 24.601 0.400 A 93 LYS N N 15 122.286 0.400 A 94 CYS H H 1 7.818 0.035 A 94 CYS HA H 1 4.224 0.035 A 94 CYS HBx H 1 2.601 0.035 A 94 CYS HBy H 1 2.828 0.035 A 94 CYS C C 13 176.440 0.400 A 94 CYS CA C 13 62.517 0.400 A 94 CYS CB C 13 28.104 0.400 A 94 CYS N N 15 113.581 0.400 A 95 THR H H 1 8.038 0.035 A 95 THR HA H 1 4.397 0.035 A 95 THR HB H 1 4.038 0.035 A 95 THR HG2% H 1 0.211 0.035 A 95 THR C C 13 176.237 0.400 A 95 THR CA C 13 62.507 0.400 A 95 THR CB C 13 71.481 0.400 A 95 THR CG2 C 13 19.202 0.400 A 95 THR N N 15 106.903 0.400 A 96 GLY H H 1 8.526 0.035 A 96 GLY HAx H 1 3.724 0.035 A 96 GLY HAy H 1 4.374 0.035 A 96 GLY C C 13 172.550 0.400 A 96 GLY CA C 13 45.264 0.400 A 96 GLY N N 15 112.762 0.400 A 97 ALA H H 1 8.560 0.035 A 97 ALA HA H 1 4.841 0.035 A 97 ALA HB% H 1 1.491 0.035 A 97 ALA C C 13 175.280 0.400 A 97 ALA CA C 13 50.176 0.400 A 97 ALA CB C 13 22.551 0.400 A 97 ALA N N 15 125.656 0.400 A 98 SER H H 1 8.817 0.035 A 98 SER HA H 1 4.656 0.035 A 98 SER CA C 13 56.612 0.400 A 98 SER N N 15 114.919 0.400 A 99 PRO HA H 1 3.500 0.035 A 99 PRO HBx H 1 1.536 0.035 A 99 PRO HBy H 1 1.842 0.035 A 99 PRO HDx H 1 3.624 0.035 A 99 PRO HDy H 1 3.991 0.035 A 99 PRO HGy H 1 1.499 0.035 A 99 PRO C C 13 177.585 0.400 A 99 PRO CA C 13 66.202 0.400 A 99 PRO CB C 13 32.030 0.400 A 99 PRO CD C 13 49.492 0.400 A 99 PRO CG C 13 27.203 0.400 A 100 SER H H 1 8.254 0.035 A 100 SER HA H 1 4.029 0.035 A 100 SER C C 13 177.441 0.400 A 100 SER CA C 13 61.891 0.400 A 100 SER N N 15 111.230 0.400 A 101 GLU H H 1 7.848 0.035 A 101 GLU HA H 1 4.021 0.035 A 101 GLU HBy H 1 2.377 0.035 A 101 GLU HBx H 1 2.064 0.035 A 101 GLU HGx H 1 2.340 0.035 A 101 GLU HGy H 1 2.358 0.035 A 101 GLU C C 13 179.288 0.400 A 101 GLU CA C 13 58.822 0.400 A 101 GLU CB C 13 29.846 0.400 A 101 GLU CG C 13 36.590 0.400 A 101 GLU N N 15 125.150 0.400 A 102 PHE H H 1 8.923 0.035 A 102 PHE HA H 1 4.155 0.035 A 102 PHE HBx H 1 3.264 0.035 A 102 PHE HBy H 1 3.301 0.035 A 102 PHE C C 13 178.343 0.400 A 102 PHE CA C 13 61.315 0.400 A 102 PHE CB C 13 40.083 0.400 A 102 PHE N N 15 121.281 0.400 A 103 ARG H H 1 8.210 0.035 A 103 ARG HA H 1 3.830 0.035 A 103 ARG HBx H 1 2.000 0.035 A 103 ARG HBy H 1 2.000 0.035 A 103 ARG HDx H 1 3.146 0.035 A 103 ARG HDy H 1 3.431 0.035 A 103 ARG HGx H 1 1.752 0.035 A 103 ARG HGy H 1 1.845 0.035 A 103 ARG C C 13 177.602 0.400 A 103 ARG CA C 13 59.235 0.400 A 103 ARG CD C 13 44.247 0.400 A 103 ARG CG C 13 26.184 0.400 A 103 ARG N N 15 119.223 0.400 A 104 ALA H H 1 7.905 0.035 A 104 ALA HA H 1 4.186 0.035 A 104 ALA HB% H 1 1.493 0.035 A 104 ALA C C 13 179.126 0.400 A 104 ALA CA C 13 54.188 0.400 A 104 ALA CB C 13 18.254 0.400 A 104 ALA N N 15 120.546 0.400 A 105 GLY H H 1 7.676 0.035 A 105 GLY HAx H 1 3.849 0.035 A 105 GLY HAy H 1 4.052 0.035 A 105 GLY C C 13 174.515 0.400 A 105 GLY CA C 13 45.317 0.400 A 105 GLY N N 15 104.677 0.400 A 106 CYS H H 1 7.599 0.035 A 106 CYS HA H 1 4.447 0.035 A 106 CYS HBx H 1 2.908 0.035 A 106 CYS HBy H 1 2.935 0.035 A 106 CYS C C 13 173.823 0.400 A 106 CYS CA C 13 59.123 0.400 A 106 CYS CB C 13 28.004 0.400 A 106 CYS N N 15 118.321 0.400 A 107 GLU H H 1 7.740 0.035 A 107 GLU HA H 1 4.110 0.035 A 107 GLU HBx H 1 1.931 0.035 A 107 GLU HBy H 1 2.057 0.035 A 107 GLU HGx H 1 2.261 0.035 A 107 GLU HGy H 1 2.313 0.035 A 107 GLU CA C 13 57.989 0.400 A 107 GLU CB C 13 30.733 0.400 A 107 GLU CG C 13 36.177 0.400 A 107 GLU N N 15 126.982 0.400 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 32 LEU HA A 32 LEU HDx% 1.0 . 4.60 2 2 A 32 LEU HA A 32 LEU HG 1.0 . 4.19 3 3 A 19 SER HA A 20 ASN HA 1.0 . 5.07 4 4 A 20 ASN HA A 21 PHE HA 1.0 . 5.38 5 5 A 28 GLN HA A 30 VAL HGy% 1.0 . 5.16 6 6 A 30 VAL HGy% A 37 LEU HA 1.0 . 5.18 7 7 A 30 VAL HGy% A 30 VAL HA 1.0 . 4.25 8 8 A 30 VAL HGy% A 32 LEU HBx 1.0 . 3.98 9 9 A 30 VAL HGy% A 37 LEU HBx 1.0 . 4.28 10 10 A 95 THR HG2% A 94 CYS HBy 1.0 . 4.49 11 11 A 22 ASP HA A 23 ILE HB 1.0 . 5.18 12 12 A 22 ASP HA A 23 ILE HG2% 1.0 . 4.65 13 13 A 95 THR HG2% A 62 LYS HEx 1.0 . 4.41 14 14 A 95 THR HG2% A 62 LYS HDx 1.0 . 4.14 15 14 A 95 THR HG2% A 62 LYS HDy 1.0 . 4.14 16 15 A 95 THR HG2% A 58 ILE HG2% 1.0 . 3.84 17 16 A 17 ALA HA A 18 ASP HA 1.0 . 5.38 18 17 A 17 ALA HA A 79 VAL HA 1.0 . 5.50 19 18 A 17 ALA HA A 80 GLY HAx 1.0 . 4.09 20 19 A 57 ARG HA A 79 VAL HGy% 1.0 . 5.50 21 20 A 79 VAL HGy% A 58 ILE HA 1.0 . 5.50 22 21 A 79 VAL HGy% A 76 GLY HAy 1.0 . 4.16 23 22 A 79 VAL HGy% A 61 ALA HB% 1.0 . 3.79 24 23 A 8 ALA HB% A 26 VAL HGx% 1.0 . 3.38 25 24 A 8 ALA HB% A 30 VAL HGx% 1.0 . 3.65 26 25 A 8 ALA HB% A 37 LEU HDy% 1.0 . 3.70 27 26 A 8 ALA HB% A 37 LEU HDx% 1.0 . 3.70 28 27 A 80 GLY HAx A 17 ALA HB% 1.0 . 5.01 29 28 A 73 ALA HB% A 84 GLN HBx 1.0 . 4.29 30 29 A 73 ALA HB% A 84 GLN HA 1.0 . 5.32 31 30 A 73 ALA HB% A 72 ILE HB 1.0 . 4.96 32 31 A 70 MET HGx A 71 PRO HDy 1.0 . 4.94 33 32 A 58 ILE HA A 61 ALA HB% 1.0 . 3.42 34 33 A 61 ALA HB% A 60 GLN HBx 1.0 . 4.43 35 34 A 61 ALA HB% A 79 VAL HGx% 1.0 . 3.28 36 35 A 61 ALA HB% A 58 ILE HD1% 1.0 . 4.59 37 36 A 72 ILE HG2% A 73 ALA HA 1.0 . 4.42 38 37 A 72 ILE HG2% A 88 SER HA 1.0 . 4.94 39 38 A 72 ILE HG2% A 72 ILE HA 1.0 . 3.75 40 39 A 72 ILE HG2% A 84 GLN HGy 1.0 . 5.24 41 40 A 72 ILE HG2% A 75 VAL HB 1.0 . 4.81 42 41 A 72 ILE HG2% A 99 PRO HBx 1.0 . 4.05 43 42 A 72 ILE HG2% A 72 ILE HG1y 1.0 . 3.89 44 43 A 72 ILE HG2% A 72 ILE HG1x 1.0 . 3.89 45 44 A 72 ILE HG2% A 72 ILE HD1% 1.0 . 3.18 46 45 A 58 ILE HG2% A 58 ILE HA 1.0 . 3.72 47 46 A 58 ILE HG2% A 91 PHE HA 1.0 . 4.82 48 47 A 58 ILE HG2% A 62 LYS HEx 1.0 . 4.67 49 48 A 58 ILE HG2% A 94 CYS HBx 1.0 . 4.51 50 49 A 58 ILE HG2% A 58 ILE HG1y 1.0 . 4.09 51 50 A 58 ILE HG2% A 58 ILE HG1x 1.0 . 4.09 52 51 A 58 ILE HG2% A 62 LYS HDx 1.0 . 4.25 53 51 A 62 LYS HDy A 58 ILE HG2% 1.0 . 4.25 54 52 A 24 ALA HA A 24 ALA HB% 1.0 . 2.99 55 53 A 23 ILE HG2% A 24 ALA HB% 1.0 . 4.10 56 54 A 12 ILE HG2% A 13 SER HA 1.0 . 4.11 57 55 A 47 ILE HA A 47 ILE HD1% 1.0 . 4.50 58 56 A 47 ILE HD1% A 52 TRP HA 1.0 . 4.00 59 57 A 47 ILE HD1% A 47 ILE HB 1.0 . 3.55 60 58 A 12 ILE HG2% A 12 ILE HA 1.0 . 3.74 61 59 A 24 ALA HA A 27 ALA HB% 1.0 . 3.51 62 60 A 27 ALA HB% A 34 PRO HBy 1.0 . 4.51 63 61 A 27 ALA HB% A 37 LEU HBy 1.0 . 4.67 64 62 A 27 ALA HB% A 34 PRO HGy 1.0 . 4.54 65 63 A 23 ILE HG2% A 27 ALA HB% 1.0 . 4.58 66 64 A 23 ILE HG2% A 24 ALA HA 1.0 . 3.91 67 65 A 23 ILE HG2% A 23 ILE HA 1.0 . 3.95 68 66 A 23 ILE HG2% A 34 PRO HBx 1.0 . 4.42 69 67 A 23 ILE HG2% A 34 PRO HBy 1.0 . 4.42 70 68 A 23 ILE HG2% A 23 ILE HG1y 1.0 . 3.84 71 69 A 23 ILE HG2% A 23 ILE HG1x 1.0 . 3.84 72 70 A 97 ALA HA A 101 GLU HBx 1.0 . 5.50 73 71 A 97 ALA HA A 101 GLU HBy 1.0 . 5.50 74 72 A 27 ALA HB% A 34 PRO HDx 1.0 . 4.89 75 73 A 24 ALA HB% A 34 PRO HDy 1.0 . 5.50 76 74 A 27 ALA HB% A 34 PRO HDy 1.0 . 4.45 77 75 A 68 THR HB A 70 MET HE% 1.0 . 4.00 78 76 A 71 PRO HDy A 70 MET HE% 1.0 . 5.39 79 77 A 70 MET HE% A 70 MET HGy 1.0 . 3.38 80 78 A 70 MET HE% A 70 MET HBx 1.0 . 2.66 81 79 A 70 MET HE% A 70 MET HBy 1.0 . 3.50 82 80 A 70 MET HE% A 68 THR HG2% 1.0 . 4.01 83 81 A 70 MET HE% A 75 VAL HGy% 1.0 . 3.02 84 82 A 70 MET HE% A 75 VAL HA 1.0 . 4.61 85 83 A 1 MET HA A 1 MET HE% 1.0 . 4.49 86 84 A 1 MET HE% A 6 ARG HA 1.0 . 4.78 87 85 A 1 MET HE% A 6 ARG HDx 1.0 . 5.16 88 85 A 1 MET HE% A 6 ARG HDy 1.0 . 5.16 89 86 A 1 MET HE% A 1 MET HGy 1.0 . 3.65 90 87 A 1 MET HE% A 45 LEU HDy% 1.0 . 3.90 91 88 A 1 MET HE% A 45 LEU HDx% 1.0 . 3.90 92 89 A 30 VAL HGy% A 32 LEU HBy 1.0 . 3.98 93 90 A 9 CYS HA A 12 ILE HD1% 1.0 . 4.10 94 91 A 12 ILE HD1% A 12 ILE HB 1.0 . 3.45 95 92 A 8 ALA HB% A 12 ILE HD1% 1.0 . 4.26 96 93 A 12 ILE HD1% A 49 VAL HGy% 1.0 . 4.45 97 94 A 12 ILE HD1% A 49 VAL HGx% 1.0 . 4.45 98 95 A 47 ILE HG2% A 52 TRP HBx 1.0 . 4.75 99 96 A 47 ILE HG2% A 55 ASP HBx 1.0 . 5.50 100 97 A 47 ILE HG2% A 47 ILE HG1y 1.0 . 3.38 101 98 A 47 ILE HG2% A 47 ILE HG1x 1.0 . 3.38 102 99 A 23 ILE HA A 23 ILE HD1% 1.0 . 4.11 103 100 A 23 ILE HB A 23 ILE HD1% 1.0 . 3.57 104 101 A 72 ILE HB A 72 ILE HD1% 1.0 . 3.69 105 102 A 99 PRO HBx A 72 ILE HD1% 1.0 . 3.81 106 103 A 54 GLU HA A 57 ARG HDx 1.0 . 4.41 107 104 A 103 ARG HBx A 103 ARG HDy 1.0 . 4.16 108 104 A 103 ARG HBy A 103 ARG HDy 1.0 . 4.16 109 105 A 103 ARG HBy A 103 ARG HDx 1.0 . 4.16 110 105 A 103 ARG HDx A 103 ARG HBx 1.0 . 4.16 111 106 A 85 LEU HBy A 89 ARG HDx 1.0 . 5.50 112 107 A 85 LEU HBy A 89 ARG HDy 1.0 . 5.50 113 108 A 89 ARG HA A 89 ARG HDx 1.0 . 5.50 114 109 A 3 ASN HA A 6 ARG HDx 1.0 . 4.36 115 109 A 6 ARG HDy A 3 ASN HA 1.0 . 4.36 116 110 A 6 ARG HDy A 6 ARG HBx 1.0 . 3.71 117 110 A 6 ARG HBx A 6 ARG HDx 1.0 . 3.71 118 111 A 36 ARG HA A 36 ARG HDx 1.0 . 3.97 119 112 A 6 ARG HA A 6 ARG HDx 1.0 . 4.36 120 112 A 6 ARG HA A 6 ARG HDy 1.0 . 4.36 121 113 A 6 ARG HDy A 6 ARG HBy 1.0 . 3.71 122 113 A 6 ARG HBy A 6 ARG HDx 1.0 . 3.71 123 114 A 69 ARG HA A 69 ARG HDx 1.0 . 3.82 124 114 A 69 ARG HA A 69 ARG HDy 1.0 . 3.82 125 115 A 16 LEU HBx A 16 LEU HDx% 1.0 . 3.90 126 116 A 40 LEU HDx% A 40 LEU HBy 1.0 . 3.63 127 117 A 14 ASP HA A 16 LEU HBy 1.0 . 5.50 128 118 A 59 SER HA A 62 LYS HEy 1.0 . 5.20 129 119 A 95 THR HG2% A 62 LYS HEy 1.0 . 4.41 130 120 A 58 ILE HG2% A 62 LYS HEy 1.0 . 4.67 131 121 A 59 SER HA A 62 LYS HEx 1.0 . 5.20 132 122 A 37 LEU HBx A 34 PRO HA 1.0 . 4.83 133 123 A 85 LEU HBx A 85 LEU HDx% 1.0 . 4.03 134 124 A 52 TRP HA A 55 ASP HBx 1.0 . 4.10 135 125 A 52 TRP HA A 55 ASP HBy 1.0 . 4.42 136 126 A 38 SER HA A 41 PHE HBx 1.0 . 4.48 137 127 A 75 VAL HA A 78 ASN HBx 1.0 . 4.69 138 128 A 64 LEU HA A 67 THR HB 1.0 . 4.85 139 129 A 68 THR HG2% A 67 THR HB 1.0 . 4.94 140 130 A 85 LEU HBx A 86 TYR HBx 1.0 . 5.50 141 131 A 85 LEU HBx A 86 TYR HBy 1.0 . 5.50 142 132 A 72 ILE HB A 84 GLN HBy 1.0 . 5.14 143 133 A 54 GLU HA A 54 GLU HGy 1.0 . 4.04 144 134 A 30 VAL HGx% A 7 GLU HGy 1.0 . 4.73 145 135 A 7 GLU HA A 7 GLU HGx 1.0 . 4.13 146 136 A 71 PRO HDx A 74 THR HB 1.0 . 4.30 147 137 A 70 MET HGx A 74 THR HB 1.0 . 4.60 148 138 A 70 MET HBx A 74 THR HB 1.0 . 4.52 149 139 A 70 MET HBy A 74 THR HB 1.0 . 4.65 150 140 A 75 VAL HA A 78 ASN HBy 1.0 . 4.69 151 141 A 75 VAL HA A 75 VAL HGx% 1.0 . 3.59 152 142 A 44 GLN HA A 44 GLN HGy 1.0 . 3.86 153 143 A 40 LEU HDy% A 44 GLN HGy 1.0 . 5.50 154 144 A 44 GLN HGx A 40 LEU HDy% 1.0 . 5.50 155 145 A 70 MET HBx A 75 VAL HGy% 1.0 . 4.12 156 146 A 43 GLN HA A 43 GLN HGy 1.0 . 4.09 157 147 A 8 ALA HB% A 5 VAL HA 1.0 . 3.69 158 148 A 37 LEU HBy A 34 PRO HA 1.0 . 4.16 159 149 A 27 ALA HB% A 34 PRO HA 1.0 . 3.51 160 150 A 23 ILE HG2% A 34 PRO HA 1.0 . 5.12 161 151 A 23 ILE HD1% A 34 PRO HA 1.0 . 5.50 162 152 A 34 PRO HA A 37 LEU HDy% 1.0 . 5.50 163 153 A 72 ILE HG2% A 84 GLN HGx 1.0 . 5.24 164 154 A 41 PHE HBy A 49 VAL HA 1.0 . 5.19 165 155 A 52 TRP HBx A 49 VAL HA 1.0 . 5.43 166 156 A 74 THR HA A 77 ARG HBx 1.0 . 3.66 167 156 A 74 THR HA A 77 ARG HBy 1.0 . 3.66 168 157 A 72 ILE HA A 75 VAL HB 1.0 . 3.89 169 158 A 72 ILE HA A 72 ILE HG1x 1.0 . 4.20 170 159 A 72 ILE HA A 72 ILE HG1y 1.0 . 4.20 171 160 A 72 ILE HA A 72 ILE HD1% 1.0 . 3.99 172 161 A 73 ALA HB% A 71 PRO HBy 1.0 . 4.28 173 162 A 74 THR HB A 71 PRO HBy 1.0 . 4.87 174 163 A 71 PRO HBy A 70 MET HA 1.0 . 5.50 175 164 A 89 ARG HA A 92 LYS HBy 1.0 . 4.67 176 165 A 99 PRO HBy A 100 SER HA 1.0 . 5.50 177 166 A 89 ARG HA A 92 LYS HBx 1.0 . 5.22 178 167 A 72 ILE HG2% A 99 PRO HBy 1.0 . 4.32 179 168 A 72 ILE HD1% A 99 PRO HBy 1.0 . 4.86 180 169 A 68 THR HB A 70 MET HGy 1.0 . 4.40 181 170 A 70 MET HGx A 71 PRO HDx 1.0 . 4.87 182 171 A 70 MET HGy A 74 THR HG2% 1.0 . 4.92 183 172 A 27 ALA HB% A 34 PRO HBx 1.0 . 4.51 184 173 A 9 CYS HA A 12 ILE HB 1.0 . 4.15 185 174 A 23 ILE HD1% A 26 VAL HB 1.0 . 4.74 186 175 A 23 ILE HD1% A 49 VAL HB 1.0 . 4.20 187 176 A 4 ARG HA A 30 VAL HB 1.0 . 5.05 188 177 A 75 VAL HB A 70 MET HBx 1.0 . 5.32 189 178 A 23 ILE HA A 26 VAL HB 1.0 . 4.34 190 179 A 52 TRP HA A 47 ILE HG2% 1.0 . 4.94 191 180 A 86 TYR HA A 89 ARG HBy 1.0 . 4.76 192 181 A 37 LEU HBy A 38 SER HA 1.0 . 4.76 193 182 A 51 SER HA A 54 GLU HBx 1.0 . 4.78 194 183 A 36 ARG HBy A 32 LEU HDy% 1.0 . 4.49 195 183 A 32 LEU HDy% A 36 ARG HBx 1.0 . 4.49 196 184 A 78 ASN HA A 77 ARG HBx 1.0 . 5.27 197 184 A 77 ARG HBy A 78 ASN HA 1.0 . 5.27 198 185 A 66 SER HA A 67 THR HA 1.0 . 4.92 199 186 A 95 THR HG2% A 95 THR HA 1.0 . 3.43 200 187 A 88 SER HA A 99 PRO HBx 1.0 . 5.34 201 188 A 88 SER HA A 98 SER HA 1.0 . 4.51 202 189 A 49 VAL HA A 52 TRP HBy 1.0 . 4.33 203 190 A 41 PHE HA A 5 VAL HGy% 1.0 . 4.04 204 191 A 41 PHE HA A 5 VAL HGx% 1.0 . 4.04 205 192 A 58 ILE HD1% A 91 PHE HA 1.0 . 3.92 206 193 A 95 THR HG2% A 91 PHE HA 1.0 . 5.11 207 194 A 49 VAL HGx% A 23 ILE HG1x 1.0 . 5.01 208 195 A 59 SER HA A 62 LYS HDx 1.0 . 4.25 209 195 A 62 LYS HDy A 59 SER HA 1.0 . 4.25 210 196 A 41 PHE HA A 45 LEU HBx 1.0 . 5.50 211 197 A 59 SER HA A 62 LYS HBx 1.0 . 5.39 212 198 A 59 SER HA A 62 LYS HBy 1.0 . 5.39 213 199 A 36 ARG HA A 39 HIS HBx 1.0 . 3.75 214 199 A 36 ARG HA A 39 HIS HBy 1.0 . 3.75 215 200 A 11 TYR HA A 14 ASP HBy 1.0 . 4.59 216 201 A 45 LEU HG A 44 GLN HBx 1.0 . 5.48 217 202 A 44 GLN HBx A 5 VAL HGy% 1.0 . 4.73 218 203 A 100 SER HA A 103 ARG HBx 1.0 . 4.33 219 203 A 103 ARG HBy A 100 SER HA 1.0 . 4.33 220 204 A 72 ILE HD1% A 100 SER HA 1.0 . 4.13 221 205 A 58 ILE HA A 58 ILE HD1% 1.0 . 3.62 222 206 A 34 PRO HGx A 35 SER HA 1.0 . 5.50 223 207 A 102 PHE HA A 104 ALA HB% 1.0 . 5.50 224 208 A 73 ALA HA A 84 GLN HBy 1.0 . 4.36 225 209 A 73 ALA HB% A 84 GLN HBy 1.0 . 4.29 226 210 A 72 ILE HB A 84 GLN HBx 1.0 . 5.14 227 211 A 95 THR HG2% A 94 CYS HBx 1.0 . 4.49 228 212 A 23 ILE HG2% A 34 PRO HGx 1.0 . 5.16 229 213 A 82 ASP HA A 77 ARG HGx 1.0 . 4.41 230 214 A 62 LYS HA A 65 LEU HG 1.0 . 5.03 231 215 A 75 VAL HGy% A 65 LEU HG 1.0 . 4.53 232 216 A 47 ILE HA A 42 ARG HGy 1.0 . 5.20 233 217 A 47 ILE HA A 42 ARG HGx 1.0 . 5.20 234 218 A 57 ARG HA A 79 VAL HB 1.0 . 4.11 235 219 A 57 ARG HA A 57 ARG HGy 1.0 . 4.16 236 220 A 57 ARG HA A 60 GLN HBy 1.0 . 4.67 237 221 A 57 ARG HA A 57 ARG HGx 1.0 . 4.16 238 222 A 62 LYS HA A 62 LYS HDx 1.0 . 4.67 239 222 A 62 LYS HDy A 62 LYS HA 1.0 . 4.67 240 223 A 86 TYR HA A 89 ARG HGx 1.0 . 5.15 241 224 A 86 TYR HA A 89 ARG HBx 1.0 . 3.96 242 225 A 86 TYR HA A 89 ARG HGy 1.0 . 5.15 243 226 A 53 ARG HA A 56 GLN HBx 1.0 . 4.43 244 227 A 45 LEU HG A 44 GLN HBy 1.0 . 5.48 245 228 A 79 VAL HGx% A 60 GLN HBy 1.0 . 4.41 246 229 A 68 THR HG2% A 68 THR HA 1.0 . 3.24 247 230 A 30 VAL HA A 31 CYS HBx 1.0 . 5.50 248 230 A 30 VAL HA A 31 CYS HBy 1.0 . 5.50 249 231 A 79 VAL HA A 16 LEU HBy 1.0 . 5.25 250 232 A 79 VAL HA A 79 VAL HGx% 1.0 . 3.39 251 233 A 54 GLU HA A 57 ARG HDy 1.0 . 4.41 252 234 A 54 GLU HA A 54 GLU HGx 1.0 . 4.04 253 235 A 30 VAL HA A 30 VAL HGx% 1.0 . 3.14 254 236 A 79 VAL HA A 16 LEU HG 1.0 . 4.61 255 237 A 40 LEU HG A 39 HIS HBx 1.0 . 4.93 256 237 A 39 HIS HBy A 40 LEU HG 1.0 . 4.93 257 238 A 77 ARG HA A 77 ARG HDx 1.0 . 5.50 258 239 A 77 ARG HA A 77 ARG HDy 1.0 . 5.50 259 240 A 89 ARG HA A 89 ARG HDy 1.0 . 5.50 260 241 A 30 VAL HGx% A 29 HIS HA 1.0 . 4.94 261 242 A 37 LEU HBx A 37 LEU HDx% 1.0 . 3.59 262 243 A 36 ARG HA A 36 ARG HDy 1.0 . 3.97 263 244 A 7 GLU HA A 7 GLU HGy 1.0 . 4.13 264 245 A 104 ALA HB% A 101 GLU HA 1.0 . 3.56 265 246 A 43 GLN HA A 43 GLN HGx 1.0 . 4.09 266 247 A 87 PHE HA A 90 VAL HGy% 1.0 . 4.88 267 248 A 87 PHE HA A 90 VAL HGx% 1.0 . 4.88 268 249 A 87 PHE HA A 90 VAL HB 1.0 . 4.58 269 250 A 64 LEU HA A 64 LEU HDx% 1.0 . 4.61 270 251 A 63 LEU HA A 63 LEU HDy% 1.0 . 4.72 271 252 A 64 LEU HA A 64 LEU HG 1.0 . 4.23 272 253 A 40 LEU HBy A 40 LEU HDy% 1.0 . 3.63 273 254 A 40 LEU HBx A 40 LEU HDy% 1.0 . 3.63 274 255 A 79 VAL HA A 16 LEU HDx% 1.0 . 5.50 275 256 A 16 LEU HA A 16 LEU HDx% 1.0 . 4.05 276 257 A 37 LEU HA A 39 HIS HBx 1.0 . 5.50 277 257 A 37 LEU HA A 39 HIS HBy 1.0 . 5.50 278 258 A 40 LEU HA A 39 HIS HBx 1.0 . 5.50 279 258 A 39 HIS HBy A 40 LEU HA 1.0 . 5.50 280 259 A 40 LEU HA A 43 GLN HBx 1.0 . 4.25 281 260 A 40 LEU HA A 43 GLN HBy 1.0 . 4.25 282 261 A 37 LEU HA A 37 LEU HG 1.0 . 3.91 283 262 A 16 LEU HG A 16 LEU HA 1.0 . 4.27 284 263 A 16 LEU HA A 16 LEU HDy% 1.0 . 4.05 285 264 A 57 ARG HA A 16 LEU HDx% 1.0 . 4.09 286 265 A 16 LEU HBy A 16 LEU HDx% 1.0 . 3.92 287 266 A 45 LEU HBx A 45 LEU HDx% 1.0 . 4.16 288 267 A 44 GLN HA A 44 GLN HGx 1.0 . 3.86 289 268 A 40 LEU HA A 40 LEU HDy% 1.0 . 4.41 290 269 A 40 LEU HG A 40 LEU HA 1.0 . 4.12 291 270 A 50 LEU HA A 50 LEU HG 1.0 . 4.26 292 271 A 50 LEU HA A 50 LEU HDx% 1.0 . 4.08 293 272 A 85 LEU HA A 85 LEU HG 1.0 . 4.05 294 273 A 63 LEU HA A 63 LEU HDx% 1.0 . 4.72 295 274 A 63 LEU HBy A 63 LEU HDx% 1.0 . 3.93 296 275 A 63 LEU HDx% A 63 LEU HBx 1.0 . 3.93 297 276 A 79 VAL HA A 16 LEU HDy% 1.0 . 5.50 298 277 A 57 ARG HA A 16 LEU HDy% 1.0 . 4.09 299 278 A 16 LEU HBx A 16 LEU HDy% 1.0 . 3.90 300 279 A 16 LEU HBy A 16 LEU HDy% 1.0 . 3.92 301 280 A 85 LEU HA A 85 LEU HDx% 1.0 . 4.53 302 281 A 63 LEU HBy A 63 LEU HDy% 1.0 . 3.93 303 282 A 65 LEU HG A 65 LEU HA 1.0 . 4.05 304 283 A 65 LEU HA A 65 LEU HDy% 1.0 . 4.65 305 284 A 65 LEU HA A 65 LEU HDx% 1.0 . 4.65 306 285 A 63 LEU HBx A 63 LEU HDy% 1.0 . 3.93 307 286 A 5 VAL HA A 5 VAL HGy% 1.0 . 3.67 308 287 A 55 ASP HA A 58 ILE HB 1.0 . 4.01 309 288 A 92 LYS HBy A 98 SER HA 1.0 . 4.96 310 289 A 92 LYS HBx A 98 SER HA 1.0 . 4.30 311 290 A 98 SER HA A 99 PRO HDy 1.0 . 3.87 312 291 A 98 SER HA A 99 PRO HDx 1.0 . 3.87 313 292 A 85 LEU HA A 85 LEU HDy% 1.0 . 4.53 314 293 A 85 LEU HBx A 85 LEU HDy% 1.0 . 4.03 315 294 A 40 LEU HA A 40 LEU HDx% 1.0 . 4.41 316 295 A 40 LEU HDx% A 44 GLN HGx 1.0 . 5.50 317 296 A 40 LEU HDx% A 44 GLN HGy 1.0 . 5.50 318 297 A 40 LEU HDx% A 40 LEU HBx 1.0 . 3.63 319 298 A 77 ARG HA A 81 PHE HA 1.0 . 5.12 320 299 A 50 LEU HA A 50 LEU HDy% 1.0 . 4.08 321 300 A 32 LEU HA A 32 LEU HDy% 1.0 . 4.60 322 301 A 3 ASN HA A 6 ARG HBy 1.0 . 3.86 323 302 A 3 ASN HA A 6 ARG HBx 1.0 . 3.86 324 303 A 45 LEU HBx A 45 LEU HDy% 1.0 . 4.16 325 304 A 27 ALA HA A 37 LEU HDy% 1.0 . 4.71 326 305 A 37 LEU HBx A 37 LEU HDy% 1.0 . 3.59 327 306 A 45 LEU HA A 45 LEU HDy% 1.0 . 4.55 328 307 A 23 ILE HA A 26 VAL HGy% 1.0 . 3.98 329 308 A 26 VAL HGy% A 8 ALA HA 1.0 . 4.99 330 309 A 26 VAL HGy% A 26 VAL HA 1.0 . 3.69 331 310 A 90 VAL HA A 90 VAL HGy% 1.0 . 3.49 332 311 A 8 ALA HA A 11 TYR HBy 1.0 . 4.51 333 312 A 8 ALA HA A 11 TYR HBx 1.0 . 4.51 334 313 A 26 VAL HGx% A 8 ALA HA 1.0 . 3.72 335 314 A 30 VAL HGx% A 8 ALA HA 1.0 . 4.00 336 315 A 75 VAL HGy% A 65 LEU HA 1.0 . 4.40 337 316 A 30 VAL HGy% A 27 ALA HA 1.0 . 3.45 338 317 A 27 ALA HA A 37 LEU HDx% 1.0 . 4.71 339 318 A 96 GLY HAy A 97 ALA HB% 1.0 . 5.50 340 319 A 102 PHE HA A 97 ALA HB% 1.0 . 5.06 341 320 A 97 ALA HB% A 102 PHE HBx 1.0 . 4.12 342 321 A 74 THR HA A 74 THR HG2% 1.0 . 3.39 343 322 A 71 PRO HDx A 74 THR HG2% 1.0 . 4.80 344 323 A 70 MET HGx A 74 THR HG2% 1.0 . 3.79 345 324 A 70 MET HE% A 74 THR HG2% 1.0 . 3.97 346 325 A 70 MET HBx A 74 THR HG2% 1.0 . 4.18 347 326 A 74 THR HG2% A 77 ARG HBx 1.0 . 4.72 348 326 A 77 ARG HBy A 74 THR HG2% 1.0 . 4.72 349 327 A 70 MET HBy A 74 THR HG2% 1.0 . 4.27 350 328 A 71 PRO HDy A 74 THR HG2% 1.0 . 4.51 351 329 A 72 ILE HA A 75 VAL HGy% 1.0 . 3.95 352 330 A 75 VAL HGy% A 75 VAL HA 1.0 . 3.51 353 331 A 70 MET HGy A 75 VAL HGy% 1.0 . 4.51 354 332 A 70 MET HBy A 75 VAL HGy% 1.0 . 3.99 355 333 A 71 PRO HDy A 70 MET HA 1.0 . 3.40 356 334 A 71 PRO HDx A 70 MET HA 1.0 . 3.69 357 335 A 70 MET HGx A 70 MET HA 1.0 . 4.12 358 336 A 79 VAL HGy% A 61 ALA HA 1.0 . 5.13 359 337 A 60 GLN HBx A 61 ALA HA 1.0 . 4.79 360 338 A 24 ALA HA A 34 PRO HGx 1.0 . 5.50 361 339 A 75 VAL HA A 74 THR HG2% 1.0 . 4.56 362 340 A 15 HIS HA A 18 ASP HBx 1.0 . 5.01 363 341 A 73 ALA HA A 84 GLN HBx 1.0 . 4.36 364 342 A 26 VAL HGx% A 23 ILE HA 1.0 . 4.70 365 343 A 26 VAL HGx% A 26 VAL HA 1.0 . 3.66 366 344 A 26 VAL HGx% A 49 VAL HB 1.0 . 5.50 367 345 A 82 ASP HA A 77 ARG HGy 1.0 . 4.41 368 346 A 82 ASP HA A 77 ARG HA 1.0 . 4.50 369 347 A 75 VAL HGx% A 61 ALA HA 1.0 . 3.76 370 348 A 75 VAL HGx% A 65 LEU HG 1.0 . 3.77 371 349 A 61 ALA HB% A 75 VAL HGx% 1.0 . 4.30 372 350 A 5 VAL HA A 5 VAL HGx% 1.0 . 3.67 373 351 A 5 VAL HGx% A 44 GLN HBx 1.0 . 4.73 374 352 A 45 LEU HG A 45 LEU HA 1.0 . 4.13 375 353 A 45 LEU HA A 45 LEU HDx% 1.0 . 4.55 376 354 A 30 VAL HGx% A 4 ARG HA 1.0 . 4.28 377 355 A 30 VAL HGx% A 7 GLU HGx 1.0 . 4.73 378 356 A 30 VAL HGx% A 7 GLU HBy 1.0 . 4.08 379 357 A 30 VAL HGx% A 7 GLU HBx 1.0 . 4.08 380 358 A 64 LEU HA A 64 LEU HDy% 1.0 . 4.61 381 359 A 70 MET HE% A 64 LEU HDy% 1.0 . 5.18 382 360 A 1 MET HE% A 45 LEU HA 1.0 . 5.46 383 361 A 67 THR HA A 67 THR HG2% 1.0 . 3.39 384 362 A 63 LEU HA A 67 THR HG2% 1.0 . 5.29 385 363 A 65 LEU HA A 67 THR HG2% 1.0 . 4.87 386 364 A 90 VAL HA A 90 VAL HGx% 1.0 . 3.49 387 365 A 49 VAL HA A 49 VAL HGy% 1.0 . 3.67 388 366 A 23 ILE HG1y A 49 VAL HGy% 1.0 . 5.01 389 367 A 68 THR HG2% A 65 LEU HA 1.0 . 4.33 390 368 A 68 THR HG2% A 64 LEU HA 1.0 . 3.61 391 369 A 68 THR HG2% A 64 LEU HG 1.0 . 4.70 392 370 A 70 MET HBx A 68 THR HG2% 1.0 . 5.19 393 371 A 49 VAL HA A 49 VAL HGx% 1.0 . 3.67 394 372 A 49 VAL HGx% A 23 ILE HG1y 1.0 . 5.01 395 373 A 79 VAL HGx% A 60 GLN HA 1.0 . 5.31 396 374 A 57 ARG HA A 79 VAL HGx% 1.0 . 4.17 397 375 A 79 VAL HGx% A 61 ALA HA 1.0 . 4.54 398 376 A 60 GLN HBx A 79 VAL HGx% 1.0 . 3.67 399 377 A 79 VAL HGy% A 76 GLY HAx 1.0 . 4.16 400 378 A 71 PRO HDy A 70 MET HBx 1.0 . 4.94 401 379 A 71 PRO HDy A 74 THR HB 1.0 . 4.09 402 380 A 58 ILE HG2% A 94 CYS HBy 1.0 . 4.51 403 381 A 24 ALA HB% A 34 PRO HGy 1.0 . 4.41 404 382 A 47 ILE HD1% A 45 LEU HBx 1.0 . 3.80 405 383 A 47 ILE HD1% A 52 TRP HBx 1.0 . 4.11 406 384 A 12 ILE HG2% A 53 ARG HA 1.0 . 4.12 407 385 A 70 MET HE% A 64 LEU HDx% 1.0 . 5.18 408 386 A 70 MET HE% A 75 VAL HGx% 1.0 . 5.43 409 387 A 1 MET HE% A 1 MET HGx 1.0 . 3.65 410 388 A 1 MET HE% A 45 LEU HG 1.0 . 4.55 411 389 A 97 ALA HB% A 102 PHE HBy 1.0 . 5.50 412 390 A 38 SER HA A 41 PHE HBy 1.0 . 4.66 413 391 A 75 VAL HGy% A 74 THR HB 1.0 . 5.02 414 392 A 34 PRO HA A 37 LEU HDx% 1.0 . 5.50 415 393 A 51 SER HA A 54 GLU HBy 1.0 . 4.78 416 394 A 23 ILE HG1x A 49 VAL HGy% 1.0 . 5.01 417 395 A 5 VAL HGy% A 44 GLN HBy 1.0 . 4.73 418 396 A 5 VAL HGx% A 44 GLN HBy 1.0 . 4.73 419 397 A 11 TYR HA A 14 ASP HBx 1.0 . 4.59 420 398 A 57 ARG HA A 60 GLN HBx 1.0 . 4.52 421 399 A 57 ARG HA A 56 GLN HBy 1.0 . 5.11 422 400 A 57 ARG HA A 61 ALA HB% 1.0 . 5.50 423 401 A 61 ALA HB% A 62 LYS HA 1.0 . 5.50 424 402 A 53 ARG HA A 56 GLN HBy 1.0 . 4.88 425 403 A 6 ARG HA A 6 ARG HGy 1.0 . 4.18 426 404 A 6 ARG HA A 6 ARG HGx 1.0 . 4.18 427 405 A 36 ARG HBy A 32 LEU HDx% 1.0 . 4.49 428 405 A 32 LEU HDx% A 36 ARG HBx 1.0 . 4.49 429 406 A 107 GLU H A 106 CYS HBx 1.0 . 4.88 430 407 A 107 GLU H A 106 CYS HBy 1.0 . 4.88 431 408 A 21 PHE HD% A 22 ASP H 1.0 . 4.16 432 409 A 21 PHE HA A 22 ASP H 1.0 . 2.86 433 410 A 83 ASP HA A 84 GLN H 1.0 . 2.95 434 411 A 84 GLN H A 84 GLN HBy 1.0 . 3.72 435 412 A 84 GLN H A 84 GLN HBx 1.0 . 3.72 436 413 A 95 THR HB A 97 ALA H 1.0 . 4.38 437 414 A 97 ALA HB% A 97 ALA H 1.0 . 3.47 438 415 A 97 ALA H A 95 THR H 1.0 . 4.57 439 416 A 97 ALA H A 92 LYS HA 1.0 . 3.81 440 417 A 95 THR HG2% A 97 ALA H 1.0 . 4.89 441 418 A 101 GLU H A 102 PHE H 1.0 . 3.62 442 419 A 102 PHE HBx A 101 GLU H 1.0 . 5.18 443 420 A 97 ALA HB% A 101 GLU H 1.0 . 5.50 444 421 A 104 ALA HB% A 101 GLU H 1.0 . 5.50 445 422 A 52 TRP HBy A 52 TRP H 1.0 . 3.85 446 423 A 52 TRP HBx A 52 TRP H 1.0 . 3.73 447 424 A 52 TRP H A 47 ILE HG1y 1.0 . 5.13 448 425 A 52 TRP H A 47 ILE HG1x 1.0 . 5.13 449 426 A 52 TRP H A 53 ARG H 1.0 . 4.08 450 427 A 52 TRP H A 51 SER H 1.0 . 3.72 451 428 A 52 TRP H A 41 PHE HE% 1.0 . 5.50 452 429 A 49 VAL HA A 52 TRP H 1.0 . 4.96 453 430 A 47 ILE HG2% A 52 TRP H 1.0 . 5.18 454 431 A 23 ILE H A 24 ALA H 1.0 . 3.68 455 432 A 22 ASP HA A 23 ILE H 1.0 . 3.04 456 433 A 23 ILE HB A 23 ILE H 1.0 . 3.36 457 434 A 23 ILE HG2% A 23 ILE H 1.0 . 3.53 458 435 A 71 PRO HA A 72 ILE H 1.0 . 3.18 459 436 A 72 ILE H A 71 PRO HBx 1.0 . 4.53 460 437 A 72 ILE HB A 72 ILE H 1.0 . 3.33 461 438 A 72 ILE H A 72 ILE HG1y 1.0 . 3.79 462 439 A 72 ILE H A 72 ILE HG1x 1.0 . 3.79 463 440 A 72 ILE HG2% A 72 ILE H 1.0 . 4.41 464 441 A 72 ILE HD1% A 72 ILE H 1.0 . 4.31 465 442 A 35 SER H A 36 ARG H 1.0 . 3.91 466 443 A 36 ARG H A 36 ARG HBx 1.0 . 3.11 467 443 A 36 ARG HBy A 36 ARG H 1.0 . 3.11 468 444 A 24 ALA HB% A 24 ALA H 1.0 . 3.06 469 445 A 23 ILE HG2% A 24 ALA H 1.0 . 3.68 470 446 A 70 MET HBx A 75 VAL H 1.0 . 4.97 471 447 A 22 ASP HA A 24 ALA H 1.0 . 4.45 472 448 A 23 ILE HB A 24 ALA H 1.0 . 4.35 473 449 A 7 GLU H A 8 ALA H 1.0 . 3.63 474 450 A 5 VAL HA A 8 ALA H 1.0 . 4.30 475 451 A 8 ALA H A 7 GLU HBy 1.0 . 4.22 476 452 A 8 ALA H A 7 GLU HBx 1.0 . 4.22 477 453 A 8 ALA HB% A 8 ALA H 1.0 . 3.24 478 454 A 30 VAL HGx% A 8 ALA H 1.0 . 3.79 479 455 A 75 VAL H A 76 GLY H 1.0 . 3.75 480 456 A 75 VAL H A 74 THR H 1.0 . 3.35 481 457 A 74 THR HB A 75 VAL H 1.0 . 3.71 482 458 A 75 VAL HB A 75 VAL H 1.0 . 3.42 483 459 A 74 THR HG2% A 75 VAL H 1.0 . 4.58 484 460 A 75 VAL HGy% A 75 VAL H 1.0 . 3.19 485 461 A 84 GLN H A 85 LEU H 1.0 . 3.86 486 462 A 85 LEU H A 84 GLN HGy 1.0 . 4.95 487 463 A 85 LEU H A 84 GLN HBy 1.0 . 4.58 488 464 A 85 LEU H A 84 GLN HGx 1.0 . 4.95 489 465 A 85 LEU H A 84 GLN HBx 1.0 . 4.58 490 466 A 85 LEU HBy A 85 LEU H 1.0 . 4.11 491 467 A 85 LEU HG A 85 LEU H 1.0 . 4.33 492 468 A 83 ASP HA A 85 LEU H 1.0 . 4.54 493 469 A 85 LEU HBx A 85 LEU H 1.0 . 3.33 494 470 A 81 PHE HA A 82 ASP H 1.0 . 2.98 495 471 A 82 ASP H A 81 PHE HBy 1.0 . 4.51 496 472 A 82 ASP H A 82 ASP HBx 1.0 . 3.40 497 472 A 82 ASP H A 82 ASP HBy 1.0 . 3.40 498 473 A 77 ARG HA A 82 ASP H 1.0 . 5.27 499 474 A 85 LEU H A 86 TYR H 1.0 . 3.31 500 475 A 86 TYR H A 86 TYR HD% 1.0 . 4.87 501 476 A 85 LEU HBx A 86 TYR H 1.0 . 3.80 502 477 A 85 LEU HBy A 86 TYR H 1.0 . 3.92 503 478 A 69 ARG H A 70 MET H 1.0 . 3.84 504 479 A 68 THR HA A 70 MET H 1.0 . 4.41 505 480 A 68 THR HB A 70 MET H 1.0 . 3.19 506 481 A 70 MET HGy A 70 MET H 1.0 . 3.84 507 482 A 70 MET HBx A 70 MET H 1.0 . 3.51 508 483 A 70 MET HBy A 70 MET H 1.0 . 4.10 509 484 A 68 THR HG2% A 70 MET H 1.0 . 4.39 510 485 A 75 VAL HGy% A 70 MET H 1.0 . 4.84 511 486 A 15 HIS HBx A 16 LEU H 1.0 . 5.07 512 487 A 16 LEU HBx A 16 LEU H 1.0 . 3.17 513 488 A 16 LEU HBy A 16 LEU H 1.0 . 3.78 514 489 A 61 ALA H A 63 LEU H 1.0 . 5.15 515 490 A 60 GLN HBy A 61 ALA H 1.0 . 4.17 516 491 A 60 GLN HBx A 61 ALA H 1.0 . 3.93 517 492 A 61 ALA HB% A 61 ALA H 1.0 . 3.25 518 493 A 79 VAL HGx% A 61 ALA H 1.0 . 3.81 519 494 A 90 VAL HA A 93 LYS H 1.0 . 3.98 520 495 A 92 LYS HBy A 93 LYS H 1.0 . 3.19 521 496 A 24 ALA H A 26 VAL H 1.0 . 5.10 522 497 A 26 VAL H A 27 ALA H 1.0 . 3.45 523 498 A 24 ALA HA A 26 VAL H 1.0 . 4.64 524 499 A 23 ILE HA A 26 VAL H 1.0 . 4.48 525 500 A 27 ALA HB% A 26 VAL H 1.0 . 4.58 526 501 A 26 VAL HGy% A 26 VAL H 1.0 . 3.27 527 502 A 77 ARG H A 79 VAL H 1.0 . 4.74 528 503 A 74 THR HA A 77 ARG H 1.0 . 4.02 529 504 A 77 ARG H A 77 ARG HDx 1.0 . 5.50 530 505 A 77 ARG H A 77 ARG HDy 1.0 . 5.50 531 506 A 77 ARG H A 77 ARG HBx 1.0 . 3.14 532 506 A 77 ARG HBy A 77 ARG H 1.0 . 3.14 533 507 A 89 ARG HBx A 90 VAL H 1.0 . 4.03 534 508 A 90 VAL HB A 90 VAL H 1.0 . 3.29 535 509 A 90 VAL H A 90 VAL HGx% 1.0 . 4.09 536 510 A 90 VAL H A 90 VAL HGy% 1.0 . 4.09 537 511 A 87 PHE HA A 90 VAL H 1.0 . 4.69 538 512 A 89 ARG HBy A 90 VAL H 1.0 . 3.94 539 513 A 26 VAL HGx% A 27 ALA H 1.0 . 4.13 540 514 A 26 VAL HB A 27 ALA H 1.0 . 3.57 541 515 A 27 ALA HB% A 27 ALA H 1.0 . 3.25 542 516 A 61 ALA HA A 64 LEU H 1.0 . 4.69 543 517 A 64 LEU HG A 64 LEU H 1.0 . 3.22 544 518 A 60 GLN HA A 64 LEU H 1.0 . 4.85 545 519 A 57 ARG HA A 60 GLN H 1.0 . 3.83 546 520 A 60 GLN HBy A 60 GLN H 1.0 . 3.50 547 521 A 60 GLN HBx A 60 GLN H 1.0 . 3.63 548 522 A 61 ALA HB% A 60 GLN H 1.0 . 4.81 549 523 A 20 ASN H A 21 PHE H 1.0 . 4.34 550 524 A 22 ASP H A 21 PHE H 1.0 . 4.78 551 525 A 21 PHE HD% A 21 PHE H 1.0 . 4.61 552 526 A 20 ASN HA A 21 PHE H 1.0 . 3.06 553 527 A 21 PHE H A 21 PHE HBy 1.0 . 3.89 554 528 A 21 PHE H A 21 PHE HBx 1.0 . 3.89 555 529 A 90 VAL H A 91 PHE H 1.0 . 3.59 556 530 A 91 PHE H A 92 LYS H 1.0 . 3.87 557 531 A 91 PHE H A 89 ARG H 1.0 . 5.13 558 532 A 87 PHE HA A 91 PHE H 1.0 . 4.29 559 533 A 91 PHE H A 91 PHE HBy 1.0 . 3.56 560 534 A 91 PHE H A 91 PHE HBx 1.0 . 3.56 561 535 A 90 VAL HB A 91 PHE H 1.0 . 3.98 562 536 A 91 PHE H A 90 VAL HGx% 1.0 . 4.42 563 537 A 91 PHE H A 90 VAL HGy% 1.0 . 4.42 564 538 A 88 SER HA A 91 PHE H 1.0 . 4.99 565 539 A 90 VAL H A 89 ARG H 1.0 . 3.45 566 540 A 86 TYR HA A 89 ARG H 1.0 . 4.32 567 541 A 89 ARG HBx A 89 ARG H 1.0 . 3.36 568 542 A 89 ARG H A 89 ARG HGy 1.0 . 4.39 569 543 A 89 ARG H A 89 ARG HGx 1.0 . 4.39 570 544 A 93 LYS H A 92 LYS H 1.0 . 3.65 571 545 A 88 SER HA A 92 LYS H 1.0 . 4.62 572 546 A 89 ARG HA A 92 LYS H 1.0 . 5.02 573 547 A 92 LYS H A 91 PHE HBy 1.0 . 4.50 574 548 A 92 LYS H A 91 PHE HBx 1.0 . 4.50 575 549 A 92 LYS HBy A 92 LYS H 1.0 . 3.46 576 550 A 92 LYS HBx A 92 LYS H 1.0 . 3.45 577 551 A 102 PHE H A 99 PRO HA 1.0 . 4.61 578 552 A 102 PHE H A 101 GLU HBy 1.0 . 4.41 579 553 A 102 PHE H A 101 GLU HBx 1.0 . 4.41 580 554 A 16 LEU H A 14 ASP H 1.0 . 5.26 581 555 A 102 PHE H A 103 ARG H 1.0 . 3.92 582 556 A 102 PHE HBx A 102 PHE H 1.0 . 3.28 583 557 A 97 ALA HB% A 102 PHE H 1.0 . 4.10 584 558 A 11 TYR HA A 14 ASP H 1.0 . 4.66 585 559 A 14 ASP H A 13 SER H 1.0 . 4.03 586 560 A 12 ILE HA A 14 ASP H 1.0 . 5.24 587 561 A 14 ASP H A 14 ASP HBy 1.0 . 3.98 588 562 A 14 ASP H A 14 ASP HBx 1.0 . 3.98 589 563 A 63 LEU H A 62 LYS H 1.0 . 3.92 590 564 A 63 LEU H A 64 LEU H 1.0 . 3.84 591 565 A 63 LEU H A 63 LEU HBy 1.0 . 3.33 592 566 A 63 LEU H A 63 LEU HBx 1.0 . 3.33 593 567 A 63 LEU H A 62 LYS HDx 1.0 . 4.91 594 567 A 62 LYS HDy A 63 LEU H 1.0 . 4.91 595 568 A 63 LEU H A 63 LEU HG 1.0 . 5.23 596 569 A 15 HIS HBx A 14 ASP H 1.0 . 4.94 597 570 A 6 ARG H A 1 MET HGy 1.0 . 5.33 598 571 A 6 ARG H A 5 VAL H 1.0 . 3.39 599 572 A 3 ASN HA A 6 ARG H 1.0 . 4.06 600 573 A 6 ARG H A 1 MET HGx 1.0 . 5.33 601 574 A 6 ARG H A 6 ARG HBy 1.0 . 3.58 602 575 A 104 ALA H A 103 ARG HBx 1.0 . 3.87 603 575 A 103 ARG HBy A 104 ALA H 1.0 . 3.87 604 576 A 6 ARG H A 6 ARG HBx 1.0 . 3.58 605 577 A 6 ARG H A 5 VAL HGy% 1.0 . 5.01 606 578 A 6 ARG H A 5 VAL HGx% 1.0 . 5.01 607 579 A 7 GLU HA A 10 GLN H 1.0 . 4.15 608 580 A 10 GLN H A 9 CYS HBy 1.0 . 4.50 609 581 A 10 GLN H A 9 CYS HBx 1.0 . 4.50 610 582 A 104 ALA HB% A 104 ALA H 1.0 . 3.00 611 583 A 40 LEU H A 41 PHE H 1.0 . 3.60 612 584 A 41 PHE H A 41 PHE HD% 1.0 . 3.97 613 585 A 38 SER HA A 41 PHE H 1.0 . 4.32 614 586 A 41 PHE HBy A 41 PHE H 1.0 . 3.62 615 587 A 41 PHE HBx A 41 PHE H 1.0 . 3.26 616 588 A 41 PHE H A 40 LEU HBx 1.0 . 4.01 617 589 A 41 PHE H A 40 LEU HBy 1.0 . 4.01 618 590 A 104 ALA H A 105 GLY H 1.0 . 3.59 619 591 A 101 GLU HA A 104 ALA H 1.0 . 3.93 620 592 A 11 TYR H A 12 ILE H 1.0 . 3.95 621 593 A 10 GLN H A 11 TYR H 1.0 . 3.87 622 594 A 8 ALA HA A 11 TYR H 1.0 . 4.22 623 595 A 11 TYR H A 11 TYR HBy 1.0 . 3.47 624 596 A 11 TYR H A 11 TYR HBx 1.0 . 3.47 625 597 A 12 ILE HB A 11 TYR H 1.0 . 5.50 626 598 A 49 VAL H A 50 LEU H 1.0 . 3.66 627 599 A 49 VAL H A 48 SER HA 1.0 . 3.22 628 600 A 49 VAL H A 48 SER HBy 1.0 . 4.10 629 601 A 49 VAL H A 48 SER HBx 1.0 . 4.10 630 602 A 49 VAL HB A 49 VAL H 1.0 . 3.67 631 603 A 49 VAL H A 49 VAL HGy% 1.0 . 4.57 632 604 A 49 VAL H A 49 VAL HGx% 1.0 . 4.57 633 605 A 41 PHE HD% A 49 VAL H 1.0 . 5.17 634 606 A 56 GLN H A 57 ARG H 1.0 . 3.68 635 607 A 57 ARG H A 58 ILE H 1.0 . 3.78 636 608 A 57 ARG H A 57 ARG HBy 1.0 . 4.16 637 609 A 57 ARG H A 57 ARG HBx 1.0 . 4.16 638 610 A 56 GLN HBx A 57 ARG H 1.0 . 3.98 639 611 A 40 LEU H A 41 PHE HD% 1.0 . 5.50 640 612 A 36 ARG HA A 40 LEU H 1.0 . 4.79 641 613 A 40 LEU H A 40 LEU HBy 1.0 . 3.80 642 614 A 40 LEU H A 40 LEU HBx 1.0 . 3.80 643 615 A 40 LEU H A 40 LEU HDx% 1.0 . 4.77 644 616 A 40 LEU H A 40 LEU HDy% 1.0 . 4.77 645 617 A 5 VAL H A 4 ARG H 1.0 . 3.45 646 618 A 4 ARG H A 3 ASN HBx 1.0 . 4.58 647 618 A 4 ARG H A 3 ASN HBy 1.0 . 4.58 648 619 A 6 ARG H A 4 ARG H 1.0 . 4.49 649 620 A 65 LEU H A 67 THR H 1.0 . 4.85 650 621 A 18 ASP H A 19 SER H 1.0 . 5.17 651 622 A 19 SER H A 18 ASP HBy 1.0 . 4.31 652 623 A 40 LEU H A 39 HIS H 1.0 . 3.34 653 624 A 36 ARG HA A 39 HIS H 1.0 . 3.81 654 625 A 65 LEU H A 65 LEU HDx% 1.0 . 5.44 655 626 A 64 LEU H A 65 LEU H 1.0 . 3.88 656 627 A 65 LEU H A 66 SER H 1.0 . 3.83 657 628 A 65 LEU HG A 65 LEU H 1.0 . 4.39 658 629 A 65 LEU H A 65 LEU HDy% 1.0 . 5.44 659 630 A 75 VAL HGy% A 65 LEU H 1.0 . 5.31 660 631 A 18 ASP HA A 19 SER H 1.0 . 3.02 661 632 A 18 ASP HBx A 19 SER H 1.0 . 4.64 662 633 A 53 ARG HA A 56 GLN H 1.0 . 4.69 663 634 A 55 ASP HBy A 56 GLN H 1.0 . 4.42 664 635 A 56 GLN HBy A 56 GLN H 1.0 . 4.12 665 636 A 56 GLN HBx A 56 GLN H 1.0 . 3.53 666 637 A 12 ILE H A 11 TYR HBx 1.0 . 4.59 667 638 A 79 VAL HGy% A 81 PHE H 1.0 . 4.58 668 639 A 81 PHE H A 80 GLY H 1.0 . 3.29 669 640 A 77 ARG HA A 81 PHE H 1.0 . 4.09 670 641 A 81 PHE H A 81 PHE HBx 1.0 . 3.74 671 642 A 20 ASN H A 18 ASP HBy 1.0 . 4.33 672 643 A 20 ASN H A 19 SER H 1.0 . 3.65 673 644 A 81 PHE H A 78 ASN H 1.0 . 4.95 674 645 A 55 ASP HBx A 56 GLN H 1.0 . 4.47 675 646 A 8 ALA HA A 12 ILE H 1.0 . 5.29 676 647 A 12 ILE H A 10 GLN HA 1.0 . 5.50 677 648 A 13 SER H A 12 ILE H 1.0 . 4.01 678 649 A 12 ILE H A 11 TYR HBy 1.0 . 4.59 679 650 A 12 ILE HB A 12 ILE H 1.0 . 3.34 680 651 A 26 VAL HGy% A 12 ILE H 1.0 . 4.49 681 652 A 26 VAL HGx% A 12 ILE H 1.0 . 4.52 682 653 A 36 ARG H A 37 LEU H 1.0 . 3.49 683 654 A 37 LEU HBy A 37 LEU H 1.0 . 3.16 684 655 A 37 LEU HG A 37 LEU H 1.0 . 5.33 685 656 A 37 LEU HBx A 37 LEU H 1.0 . 3.39 686 657 A 5 VAL H A 4 ARG HBy 1.0 . 4.67 687 658 A 5 VAL H A 4 ARG HBx 1.0 . 4.67 688 659 A 5 VAL H A 5 VAL HGy% 1.0 . 4.77 689 660 A 5 VAL H A 5 VAL HGx% 1.0 . 4.77 690 661 A 71 PRO HBx A 73 ALA H 1.0 . 4.89 691 662 A 77 ARG H A 78 ASN H 1.0 . 3.71 692 663 A 79 VAL H A 78 ASN H 1.0 . 3.67 693 664 A 78 ASN H A 78 ASN HBx 1.0 . 3.93 694 665 A 75 VAL HGx% A 78 ASN H 1.0 . 5.50 695 666 A 79 VAL HGx% A 78 ASN H 1.0 . 5.50 696 667 A 78 ASN H A 78 ASN HBy 1.0 . 3.93 697 668 A 78 ASN H A 77 ARG HBx 1.0 . 3.78 698 668 A 77 ARG HBy A 78 ASN H 1.0 . 3.78 699 669 A 103 ARG H A 104 ALA H 1.0 . 3.60 700 670 A 100 SER HA A 103 ARG H 1.0 . 4.40 701 671 A 101 GLU HA A 103 ARG H 1.0 . 5.09 702 672 A 102 PHE HBy A 103 ARG H 1.0 . 3.63 703 673 A 103 ARG H A 103 ARG HBx 1.0 . 3.21 704 673 A 103 ARG HBy A 103 ARG H 1.0 . 3.21 705 674 A 104 ALA HB% A 103 ARG H 1.0 . 4.78 706 675 A 52 TRP HA A 55 ASP H 1.0 . 4.49 707 676 A 55 ASP HBx A 55 ASP H 1.0 . 3.54 708 677 A 18 ASP H A 17 ALA H 1.0 . 3.38 709 678 A 15 HIS HA A 18 ASP H 1.0 . 4.40 710 679 A 16 LEU HA A 18 ASP H 1.0 . 4.74 711 680 A 18 ASP H A 18 ASP HBy 1.0 . 3.53 712 681 A 18 ASP HBx A 18 ASP H 1.0 . 3.15 713 682 A 17 ALA HB% A 18 ASP H 1.0 . 3.87 714 683 A 72 ILE H A 73 ALA H 1.0 . 3.84 715 684 A 74 THR H A 73 ALA H 1.0 . 3.68 716 685 A 71 PRO HA A 73 ALA H 1.0 . 5.06 717 686 A 72 ILE HB A 73 ALA H 1.0 . 3.37 718 687 A 73 ALA HB% A 73 ALA H 1.0 . 2.99 719 688 A 72 ILE HG2% A 73 ALA H 1.0 . 4.21 720 689 A 72 ILE HD1% A 73 ALA H 1.0 . 5.22 721 690 A 7 GLU H A 6 ARG H 1.0 . 3.82 722 691 A 7 GLU H A 6 ARG HBy 1.0 . 4.13 723 692 A 7 GLU H A 6 ARG HBx 1.0 . 4.13 724 693 A 3 ASN HA A 7 GLU H 1.0 . 4.97 725 694 A 55 ASP HBy A 55 ASP H 1.0 . 3.91 726 695 A 52 TRP H A 54 GLU H 1.0 . 5.45 727 696 A 53 ARG H A 54 GLU H 1.0 . 4.08 728 697 A 51 SER HA A 54 GLU H 1.0 . 4.14 729 698 A 54 GLU HA A 53 ARG H 1.0 . 5.39 730 699 A 84 GLN H A 83 ASP H 1.0 . 5.22 731 700 A 49 VAL HA A 53 ARG H 1.0 . 5.36 732 701 A 82 ASP H A 83 ASP H 1.0 . 3.29 733 702 A 86 TYR HD% A 83 ASP H 1.0 . 5.00 734 703 A 81 PHE HBy A 83 ASP H 1.0 . 4.13 735 704 A 83 ASP H A 82 ASP HBx 1.0 . 3.73 736 704 A 82 ASP HBy A 83 ASP H 1.0 . 3.73 737 705 A 50 LEU HA A 53 ARG H 1.0 . 4.48 738 706 A 53 ARG H A 52 TRP HE3 1.0 . 4.64 739 707 A 52 TRP HBy A 53 ARG H 1.0 . 4.08 740 708 A 83 ASP H A 81 PHE HD% 1.0 . 5.39 741 709 A 107 GLU H A 106 CYS H 1.0 . 4.60 742 710 A 106 CYS H A 104 ALA HA 1.0 . 4.56 743 711 A 28 GLN HA A 32 LEU H 1.0 . 4.70 744 712 A 104 ALA HB% A 106 CYS H 1.0 . 5.26 745 713 A 39 HIS HA A 43 GLN H 1.0 . 5.05 746 714 A 27 ALA HA A 32 LEU H 1.0 . 4.66 747 715 A 32 LEU H A 31 CYS H 1.0 . 3.57 748 716 A 32 LEU H A 30 VAL H 1.0 . 4.73 749 717 A 32 LEU H A 31 CYS HA 1.0 . 3.42 750 718 A 32 LEU H A 31 CYS HBx 1.0 . 4.70 751 718 A 31 CYS HBy A 32 LEU H 1.0 . 4.70 752 719 A 32 LEU HG A 32 LEU H 1.0 . 4.77 753 720 A 30 VAL HGy% A 32 LEU H 1.0 . 3.63 754 721 A 30 VAL H A 29 HIS H 1.0 . 3.55 755 722 A 26 VAL HA A 29 HIS H 1.0 . 4.26 756 723 A 30 VAL HGx% A 29 HIS H 1.0 . 4.80 757 724 A 68 THR HB A 69 ARG H 1.0 . 3.63 758 725 A 58 ILE H A 58 ILE HG1x 1.0 . 4.18 759 726 A 58 ILE HG2% A 58 ILE H 1.0 . 4.65 760 727 A 55 ASP HA A 58 ILE H 1.0 . 4.71 761 728 A 58 ILE HB A 58 ILE H 1.0 . 3.80 762 729 A 58 ILE H A 58 ILE HG1y 1.0 . 4.18 763 730 A 58 ILE HD1% A 58 ILE H 1.0 . 4.43 764 731 A 69 ARG H A 68 THR H 1.0 . 5.47 765 732 A 68 THR HG2% A 69 ARG H 1.0 . 4.93 766 733 A 41 PHE HBy A 42 ARG H 1.0 . 3.83 767 734 A 42 ARG H A 42 ARG HGx 1.0 . 4.65 768 735 A 41 PHE H A 42 ARG H 1.0 . 3.81 769 736 A 43 GLN H A 42 ARG H 1.0 . 3.65 770 737 A 41 PHE HD% A 42 ARG H 1.0 . 5.18 771 738 A 39 HIS HA A 42 ARG H 1.0 . 4.46 772 739 A 41 PHE HBx A 42 ARG H 1.0 . 4.10 773 740 A 42 ARG H A 42 ARG HBx 1.0 . 3.74 774 741 A 42 ARG H A 42 ARG HBy 1.0 . 3.74 775 742 A 42 ARG H A 42 ARG HGy 1.0 . 4.65 776 743 A 48 SER HA A 42 ARG H 1.0 . 5.16 777 744 A 58 ILE HB A 59 SER H 1.0 . 3.72 778 745 A 59 SER H A 62 LYS HDx 1.0 . 5.50 779 745 A 62 LYS HDy A 59 SER H 1.0 . 5.50 780 746 A 62 LYS H A 59 SER H 1.0 . 5.16 781 747 A 64 LEU H A 62 LYS H 1.0 . 5.41 782 748 A 58 ILE H A 59 SER H 1.0 . 3.81 783 749 A 58 ILE HG2% A 59 SER H 1.0 . 4.55 784 750 A 61 ALA H A 62 LYS H 1.0 . 3.76 785 751 A 58 ILE HA A 62 LYS H 1.0 . 4.67 786 752 A 59 SER HA A 62 LYS H 1.0 . 4.90 787 753 A 62 LYS H A 62 LYS HBx 1.0 . 4.17 788 754 A 62 LYS H A 62 LYS HBy 1.0 . 4.17 789 755 A 61 ALA HB% A 62 LYS H 1.0 . 3.77 790 756 A 45 LEU H A 44 GLN HBx 1.0 . 4.38 791 757 A 45 LEU HG A 45 LEU H 1.0 . 4.19 792 758 A 45 LEU H A 42 ARG HA 1.0 . 4.74 793 759 A 41 PHE HA A 45 LEU H 1.0 . 5.00 794 760 A 45 LEU H A 44 GLN HBy 1.0 . 4.38 795 761 A 45 LEU H A 45 LEU HBy 1.0 . 3.78 796 762 A 50 LEU H A 48 SER HA 1.0 . 4.54 797 763 A 49 VAL HB A 50 LEU H 1.0 . 4.15 798 764 A 50 LEU H A 49 VAL HGy% 1.0 . 4.66 799 765 A 50 LEU H A 49 VAL HGx% 1.0 . 4.66 800 766 A 14 ASP H A 15 HIS H 1.0 . 3.71 801 767 A 16 LEU H A 15 HIS H 1.0 . 3.42 802 768 A 12 ILE HA A 15 HIS H 1.0 . 3.99 803 769 A 15 HIS HBx A 15 HIS H 1.0 . 3.50 804 770 A 16 LEU HBx A 15 HIS H 1.0 . 4.71 805 771 A 86 TYR H A 87 PHE H 1.0 . 3.47 806 772 A 5 VAL HA A 9 CYS H 1.0 . 5.31 807 773 A 16 LEU H A 17 ALA H 1.0 . 3.81 808 774 A 15 HIS HA A 17 ALA H 1.0 . 4.37 809 775 A 16 LEU HBx A 17 ALA H 1.0 . 4.20 810 776 A 17 ALA HB% A 17 ALA H 1.0 . 3.45 811 777 A 31 CYS H A 31 CYS HBx 1.0 . 4.01 812 777 A 31 CYS HBy A 31 CYS H 1.0 . 4.01 813 778 A 31 CYS H A 30 VAL H 1.0 . 3.39 814 779 A 30 VAL HGy% A 31 CYS H 1.0 . 4.18 815 780 A 12 ILE HB A 13 SER H 1.0 . 4.39 816 781 A 12 ILE HG2% A 13 SER H 1.0 . 5.32 817 782 A 7 GLU H A 9 CYS H 1.0 . 4.62 818 783 A 10 GLN H A 9 CYS H 1.0 . 3.90 819 784 A 9 CYS H A 9 CYS HBy 1.0 . 4.04 820 785 A 9 CYS H A 9 CYS HBx 1.0 . 4.04 821 786 A 8 ALA HB% A 9 CYS H 1.0 . 4.34 822 787 A 36 ARG H A 33 SER H 1.0 . 5.19 823 788 A 89 ARG H A 87 PHE H 1.0 . 5.43 824 789 A 32 LEU HA A 33 SER H 1.0 . 3.13 825 790 A 84 GLN HA A 87 PHE H 1.0 . 4.20 826 791 A 33 SER H A 36 ARG HBx 1.0 . 3.82 827 791 A 36 ARG HBy A 33 SER H 1.0 . 3.82 828 792 A 26 VAL H A 28 GLN H 1.0 . 5.10 829 793 A 29 HIS H A 28 GLN H 1.0 . 3.72 830 794 A 24 ALA HA A 28 GLN H 1.0 . 4.48 831 795 A 27 ALA HB% A 28 GLN H 1.0 . 3.54 832 796 A 48 SER H A 48 SER HBx 1.0 . 3.98 833 797 A 47 ILE HD1% A 48 SER H 1.0 . 4.47 834 798 A 51 SER H A 48 SER H 1.0 . 4.42 835 799 A 47 ILE HA A 48 SER H 1.0 . 3.19 836 800 A 48 SER H A 48 SER HBy 1.0 . 3.98 837 801 A 47 ILE HB A 48 SER H 1.0 . 3.71 838 802 A 10 GLN HA A 10 GLN HE2y 1.0 . 4.93 839 803 A 10 GLN HA A 10 GLN HE2x 1.0 . 4.93 840 804 A 45 LEU H A 47 ILE H 1.0 . 4.68 841 805 A 47 ILE H A 46 GLY H 1.0 . 3.67 842 806 A 41 PHE HD% A 47 ILE H 1.0 . 5.09 843 807 A 42 ARG HA A 47 ILE H 1.0 . 3.36 844 808 A 45 LEU HBy A 47 ILE H 1.0 . 3.94 845 809 A 48 SER H A 47 ILE H 1.0 . 4.64 846 810 A 45 LEU HBx A 47 ILE H 1.0 . 3.87 847 811 A 47 ILE HD1% A 47 ILE H 1.0 . 4.15 848 812 A 45 LEU H A 44 GLN H 1.0 . 3.51 849 813 A 46 GLY H A 44 GLN H 1.0 . 4.64 850 814 A 41 PHE HA A 44 GLN H 1.0 . 4.75 851 815 A 44 GLN H A 44 GLN HBy 1.0 . 3.64 852 816 A 44 GLN H A 44 GLN HBx 1.0 . 3.64 853 817 A 72 ILE H A 74 THR H 1.0 . 5.40 854 818 A 101 GLU H A 98 SER H 1.0 . 4.88 855 819 A 97 ALA HA A 98 SER H 1.0 . 3.19 856 820 A 98 SER H A 101 GLU HBy 1.0 . 4.26 857 821 A 98 SER H A 101 GLU HBx 1.0 . 4.26 858 822 A 97 ALA HB% A 98 SER H 1.0 . 3.69 859 823 A 74 THR HB A 74 THR H 1.0 . 3.31 860 824 A 71 PRO HBx A 74 THR H 1.0 . 4.82 861 825 A 71 PRO HBy A 74 THR H 1.0 . 3.66 862 826 A 74 THR HG2% A 74 THR H 1.0 . 4.34 863 827 A 76 GLY H A 74 THR H 1.0 . 5.01 864 828 A 73 ALA HB% A 74 THR H 1.0 . 4.09 865 829 A 75 VAL HGy% A 74 THR H 1.0 . 5.04 866 830 A 26 VAL HB A 25 SER H 1.0 . 5.16 867 831 A 24 ALA H A 25 SER H 1.0 . 3.65 868 832 A 26 VAL H A 25 SER H 1.0 . 3.44 869 833 A 24 ALA HB% A 25 SER H 1.0 . 4.35 870 834 A 39 HIS H A 38 SER H 1.0 . 3.59 871 835 A 37 LEU HBy A 38 SER H 1.0 . 3.57 872 836 A 37 LEU HG A 38 SER H 1.0 . 5.00 873 837 A 37 LEU HBx A 38 SER H 1.0 . 4.06 874 838 A 38 SER H A 37 LEU HDy% 1.0 . 5.15 875 839 A 38 SER H A 37 LEU HDx% 1.0 . 5.15 876 840 A 91 PHE HA A 94 CYS H 1.0 . 4.44 877 841 A 94 CYS H A 94 CYS HBy 1.0 . 3.83 878 842 A 94 CYS H A 93 LYS HBy 1.0 . 4.31 879 843 A 94 CYS H A 96 GLY H 1.0 . 5.11 880 844 A 93 LYS H A 94 CYS H 1.0 . 3.44 881 845 A 94 CYS H A 94 CYS HBx 1.0 . 3.83 882 846 A 94 CYS H A 93 LYS HBx 1.0 . 4.31 883 847 A 87 PHE H A 88 SER H 1.0 . 3.67 884 848 A 89 ARG H A 88 SER H 1.0 . 3.68 885 849 A 85 LEU HA A 88 SER H 1.0 . 4.01 886 850 A 95 THR HG2% A 96 GLY H 1.0 . 5.07 887 851 A 95 THR H A 96 GLY H 1.0 . 3.26 888 852 A 92 LYS HA A 96 GLY H 1.0 . 3.97 889 853 A 95 THR HB A 96 GLY H 1.0 . 4.87 890 854 A 97 ALA HB% A 96 GLY H 1.0 . 5.50 891 855 A 34 PRO HDy A 35 SER H 1.0 . 3.89 892 856 A 64 LEU HA A 68 THR H 1.0 . 4.65 893 857 A 66 SER H A 68 THR H 1.0 . 5.13 894 858 A 67 THR H A 68 THR H 1.0 . 3.09 895 859 A 68 THR HB A 68 THR H 1.0 . 4.17 896 860 A 68 THR HG2% A 68 THR H 1.0 . 3.51 897 861 A 101 GLU H A 100 SER H 1.0 . 3.62 898 862 A 99 PRO HBx A 100 SER H 1.0 . 3.63 899 863 A 72 ILE HD1% A 100 SER H 1.0 . 4.14 900 864 A 70 MET HE% A 78 ASN HD2y 1.0 . 4.69 901 865 A 74 THR HG2% A 78 ASN HD2y 1.0 . 4.01 902 866 A 70 MET HE% A 78 ASN HD2x 1.0 . 4.69 903 867 A 74 THR HG2% A 78 ASN HD2x 1.0 . 4.01 904 868 A 67 THR H A 66 SER H 1.0 . 3.47 905 869 A 64 LEU HG A 66 SER H 1.0 . 5.50 906 870 A 65 LEU HG A 66 SER H 1.0 . 5.50 907 871 A 67 THR HG2% A 66 SER H 1.0 . 4.90 908 872 A 79 VAL H A 81 PHE H 1.0 . 4.74 909 873 A 79 VAL H A 78 ASN HBy 1.0 . 4.84 910 874 A 77 ARG HA A 79 VAL H 1.0 . 4.71 911 875 A 45 LEU H A 46 GLY H 1.0 . 3.40 912 876 A 43 GLN H A 46 GLY H 1.0 . 5.22 913 877 A 45 LEU HBy A 46 GLY H 1.0 . 4.45 914 878 A 45 LEU HBx A 46 GLY H 1.0 . 4.91 915 879 A 45 LEU HG A 46 GLY H 1.0 . 5.50 916 880 A 79 VAL H A 78 ASN HBx 1.0 . 4.84 917 881 A 79 VAL HGy% A 79 VAL H 1.0 . 3.51 918 882 A 79 VAL HGx% A 79 VAL H 1.0 . 3.81 919 883 A 64 LEU HA A 67 THR H 1.0 . 4.50 920 884 A 64 LEU HG A 67 THR H 1.0 . 5.50 921 885 A 67 THR HB A 67 THR H 1.0 . 4.18 922 886 A 67 THR HG2% A 67 THR H 1.0 . 3.54 923 887 A 95 THR H A 94 CYS H 1.0 . 3.61 924 888 A 95 THR H A 92 LYS HA 1.0 . 4.36 925 889 A 95 THR H A 94 CYS HBx 1.0 . 4.45 926 890 A 95 THR HG2% A 95 THR H 1.0 . 3.58 927 891 A 95 THR H A 94 CYS HBy 1.0 . 4.45 928 892 A 30 VAL H A 31 CYS HA 1.0 . 4.67 929 893 A 27 ALA HA A 30 VAL H 1.0 . 4.73 930 894 A 30 VAL HGy% A 30 VAL H 1.0 . 3.32 931 895 A 102 PHE HA A 105 GLY H 1.0 . 4.36 932 896 A 104 ALA HB% A 105 GLY H 1.0 . 3.64 933 897 A 77 ARG HA A 80 GLY H 1.0 . 4.05 934 898 A 79 VAL HGy% A 80 GLY H 1.0 . 5.05 935 899 A 76 GLY H A 77 ARG HBx 1.0 . 5.16 936 899 A 77 ARG HBy A 76 GLY H 1.0 . 5.16 937 900 A 73 ALA HA A 76 GLY H 1.0 . 4.43 938 901 A 75 VAL HB A 76 GLY H 1.0 . 3.50 939 902 A 75 VAL HGx% A 76 GLY H 1.0 . 4.18 940 903 A 75 VAL HGy% A 76 GLY H 1.0 . 4.69 941 904 A 30 VAL HGx% A 29 HIS HE1 1.0 . 5.33 942 905 A 30 VAL HA A 29 HIS HE1 1.0 . 5.50 943 906 A 29 HIS HA A 29 HIS HE1 1.0 . 4.99 944 907 A 39 HIS HE1 A 39 HIS HBx 1.0 . 4.41 945 907 A 39 HIS HBy A 39 HIS HE1 1.0 . 4.41 946 908 A 11 TYR HE% A 15 HIS HE1 1.0 . 4.21 947 909 A 86 TYR HA A 86 TYR HD% 1.0 . 3.23 948 910 A 81 PHE HBy A 86 TYR HD% 1.0 . 3.54 949 911 A 72 ILE HD1% A 87 PHE HD% 1.0 . 4.60 950 912 A 21 PHE HD% A 21 PHE HZ 1.0 . 3.86 951 913 A 84 GLN HA A 87 PHE HD% 1.0 . 4.67 952 914 A 88 SER HA A 87 PHE HD% 1.0 . 4.21 953 915 A 81 PHE HBx A 87 PHE HD% 1.0 . 4.58 954 916 A 72 ILE HG2% A 87 PHE HD% 1.0 . 3.59 955 917 A 11 TYR HA A 11 TYR HD% 1.0 . 3.64 956 918 A 12 ILE HA A 11 TYR HD% 1.0 . 4.11 957 919 A 26 VAL HA A 11 TYR HD% 1.0 . 3.78 958 920 A 26 VAL HB A 11 TYR HD% 1.0 . 4.70 959 921 A 8 ALA HA A 11 TYR HD% 1.0 . 4.43 960 922 A 26 VAL HGy% A 11 TYR HD% 1.0 . 3.20 961 923 A 22 ASP HA A 21 PHE HD% 1.0 . 4.91 962 924 A 21 PHE HA A 21 PHE HD% 1.0 . 3.81 963 925 A 87 PHE HA A 87 PHE HD% 1.0 . 3.46 964 926 A 61 ALA HB% A 87 PHE HD% 1.0 . 4.97 965 927 A 41 PHE HD% A 41 PHE HZ 1.0 . 4.02 966 928 A 41 PHE HE% A 45 LEU HDx% 1.0 . 4.51 967 929 A 81 PHE HD% A 81 PHE HZ 1.0 . 3.90 968 930 A 41 PHE HA A 41 PHE HD% 1.0 . 3.74 969 931 A 37 LEU HG A 41 PHE HD% 1.0 . 4.01 970 932 A 41 PHE HD% A 45 LEU HDx% 1.0 . 4.42 971 933 A 8 ALA HA A 41 PHE HE% 1.0 . 5.28 972 934 A 80 GLY HAy A 81 PHE HE% 1.0 . 5.50 973 935 A 52 TRP HBy A 41 PHE HE% 1.0 . 3.71 974 936 A 5 VAL HA A 41 PHE HE% 1.0 . 4.04 975 937 A 49 VAL HA A 41 PHE HE% 1.0 . 3.70 976 938 A 37 LEU HG A 41 PHE HE% 1.0 . 4.23 977 939 A 23 ILE HA A 21 PHE HE% 1.0 . 4.05 978 940 A 26 VAL HGy% A 21 PHE HE% 1.0 . 3.28 979 941 A 87 PHE HE% A 91 PHE HBy 1.0 . 4.48 980 942 A 99 PRO HBy A 87 PHE HE% 1.0 . 4.36 981 943 A 58 ILE HA A 87 PHE HE% 1.0 . 4.31 982 944 A 87 PHE HE% A 91 PHE HBx 1.0 . 4.48 983 945 A 61 ALA HB% A 87 PHE HE% 1.0 . 3.52 984 946 A 72 ILE HG2% A 87 PHE HE% 1.0 . 3.37 985 947 A 87 PHE HA A 87 PHE HE% 1.0 . 4.84 986 948 A 8 ALA HB% A 41 PHE HZ 1.0 . 4.95 987 949 A 12 ILE HG2% A 21 PHE HZ 1.0 . 4.39 988 950 A 26 VAL HGy% A 21 PHE HZ 1.0 . 4.89 989 951 A 23 ILE HA A 21 PHE HZ 1.0 . 5.30 990 952 A 61 ALA HB% A 87 PHE HZ 1.0 . 3.60 991 953 A 75 VAL HGx% A 87 PHE HZ 1.0 . 3.96 992 954 A 58 ILE HA A 87 PHE HZ 1.0 . 5.19 993 955 A 61 ALA HA A 87 PHE HZ 1.0 . 5.50 994 956 A 99 PRO HBy A 87 PHE HZ 1.0 . 5.31 995 957 A 52 TRP HA A 52 TRP HD1 1.0 . 3.93 996 958 A 52 TRP HBx A 52 TRP HD1 1.0 . 3.88 997 959 A 55 ASP HBx A 52 TRP HD1 1.0 . 5.50 998 960 A 52 TRP HD1 A 45 LEU HDy% 1.0 . 4.51 999 961 A 52 TRP HD1 A 45 LEU HDx% 1.0 . 4.51 1000 962 A 55 ASP HBy A 52 TRP HD1 1.0 . 4.88 1001 963 A 52 TRP HH2 A 9 CYS HBy 1.0 . 4.35 1002 964 A 9 CYS HA A 52 TRP HH2 1.0 . 4.22 1003 965 A 52 TRP HH2 A 9 CYS HBx 1.0 . 4.35 1004 966 A 12 ILE HG2% A 52 TRP HH2 1.0 . 4.20 1005 967 A 52 TRP HH2 A 56 GLN HGx 1.0 . 4.66 1006 967 A 52 TRP HH2 A 56 GLN HGy 1.0 . 4.66 1007 968 A 12 ILE HB A 52 TRP HZ3 1.0 . 3.78 1008 969 A 9 CYS HA A 52 TRP HZ3 1.0 . 4.16 1009 970 A 12 ILE HG2% A 52 TRP HZ3 1.0 . 3.56 1010 971 A 15 HIS HD2 A 14 ASP HBx 1.0 . 3.89 1011 972 A 11 TYR HA A 15 HIS HD2 1.0 . 4.46 1012 973 A 15 HIS HD2 A 14 ASP HBy 1.0 . 3.89 1013 974 A 15 HIS HA A 15 HIS HD2 1.0 . 4.32 1014 975 A 39 HIS HA A 39 HIS HD2 1.0 . 4.16 1015 976 A 40 LEU HA A 39 HIS HD2 1.0 . 3.91 1016 977 A 39 HIS HD2 A 39 HIS HBx 1.0 . 3.39 1017 977 A 39 HIS HBy A 39 HIS HD2 1.0 . 3.39 1018 978 A 40 LEU HG A 39 HIS HD2 1.0 . 3.96 1019 979 A 12 ILE HB A 52 TRP HE3 1.0 . 5.50 1020 980 A 39 HIS HD2 A 40 LEU HDx% 1.0 . 4.95 1021 981 A 39 HIS HD2 A 40 LEU HDy% 1.0 . 4.95 1022 982 A 52 TRP HBy A 52 TRP HE3 1.0 . 3.93 1023 983 A 12 ILE HD1% A 52 TRP HE3 1.0 . 3.50 1024 984 A 53 ARG HA A 52 TRP HE3 1.0 . 3.90 1025 985 A 30 VAL HGx% A 29 HIS HD2 1.0 . 3.22 1026 986 A 30 VAL HA A 29 HIS HD2 1.0 . 5.39 1027 987 A 8 ALA HA A 29 HIS HD2 1.0 . 3.97 1028 988 A 29 HIS HD2 A 29 HIS HBy 1.0 . 3.91 1029 989 A 29 HIS HD2 A 11 TYR HBx 1.0 . 3.81 1030 990 A 8 ALA HB% A 29 HIS HD2 1.0 . 5.09 1031 991 A 29 HIS HD2 A 11 TYR HBy 1.0 . 3.81 1032 992 A 29 HIS HD2 A 29 HIS HBx 1.0 . 3.91 1033 993 A 87 PHE HA A 86 TYR HE% 1.0 . 5.25 1034 994 A 86 TYR HA A 86 TYR HE% 1.0 . 4.92 1035 995 A 90 VAL HB A 86 TYR HE% 1.0 . 4.50 1036 996 A 86 TYR HE% A 90 VAL HGx% 1.0 . 4.38 1037 997 A 86 TYR HE% A 90 VAL HGy% 1.0 . 4.38 1038 998 A 26 VAL HB A 11 TYR HE% 1.0 . 5.00 1039 999 A 21 PHE HD% A 11 TYR HE% 1.0 . 4.29 1040 1000 A 11 TYR HE% A 21 PHE HE% 1.0 . 5.08 1041 1001 A 26 VAL HA A 11 TYR HE% 1.0 . 3.67 1042 1002 A 26 VAL HGy% A 11 TYR HE% 1.0 . 3.32 1043 1003 A 12 ILE HA A 11 TYR HE% 1.0 . 4.96 1044 1004 A 52 TRP HZ2 A 56 GLN HGx 1.0 . 4.35 1045 1004 A 56 GLN HGy A 52 TRP HZ2 1.0 . 4.35 1046 1005 A 90 VAL HB A 86 TYR HD% 1.0 . 4.89 1047 1006 A 41 PHE HE% A 45 LEU HDy% 1.0 . 4.51 1048 1007 A 41 PHE HD% A 45 LEU HDy% 1.0 . 4.42 1049 1008 A 41 PHE HE% A 37 LEU HDx% 1.0 . 3.94 1050 1009 A 41 PHE HE% A 37 LEU HDy% 1.0 . 3.94 1051 1010 A 41 PHE HD% A 45 LEU HBy 1.0 . 3.84 1052 1011 A 8 ALA HB% A 41 PHE HE% 1.0 . 3.94 1053 1012 A 87 PHE HA A 81 PHE HE% 1.0 . 3.84 1054 1013 A 37 LEU HA A 41 PHE HD% 1.0 . 4.49 1055 1014 A 81 PHE HD% A 80 GLY HAy 1.0 . 4.75 1056 1015 A 52 TRP HBy A 41 PHE HZ 1.0 . 5.50 1057 1016 A 15 HIS HBx A 11 TYR HE% 1.0 . 5.03 1058 1017 A 11 TYR HA A 11 TYR HE% 1.0 . 4.80 1059 1018 A 1 MET HA A 1 MET HGy 1.0 . 3.57 1060 1018 A 1 MET HA A 1 MET HGx 1.0 . 3.57 1061 1019 A 5 VAL HB A 1 MET HGy 1.0 . 5.34 1062 1019 A 1 MET HGx A 5 VAL HB 1.0 . 5.34 1063 1020 A 1 MET HGx A 5 VAL HGy% 1.0 . 4.09 1064 1020 A 1 MET HGy A 5 VAL HGy% 1.0 . 4.09 1065 1020 A 5 VAL HGx% A 1 MET HGy 1.0 . 4.09 1066 1020 A 1 MET HGx A 5 VAL HGx% 1.0 . 4.09 1067 1021 A 6 ARG H A 1 MET HGy 1.0 . 4.66 1068 1021 A 6 ARG H A 1 MET HGx 1.0 . 4.66 1069 1022 A 1 MET HGx A 6 ARG HBy 1.0 . 4.03 1070 1022 A 6 ARG HBx A 1 MET HGy 1.0 . 4.03 1071 1022 A 1 MET HGx A 6 ARG HBx 1.0 . 4.03 1072 1022 A 1 MET HGy A 6 ARG HBy 1.0 . 4.03 1073 1023 A 1 MET HGy A 6 ARG HDx 1.0 . 4.79 1074 1023 A 1 MET HGx A 6 ARG HDx 1.0 . 4.79 1075 1023 A 6 ARG HDy A 1 MET HGy 1.0 . 4.79 1076 1023 A 6 ARG HDy A 1 MET HGx 1.0 . 4.79 1077 1024 A 1 MET HE% A 5 VAL HGy% 1.0 . 3.70 1078 1024 A 1 MET HE% A 5 VAL HGx% 1.0 . 3.70 1079 1025 A 5 VAL H A 2 ASP HBx 1.0 . 4.16 1080 1025 A 5 VAL H A 2 ASP HBy 1.0 . 4.16 1081 1026 A 5 VAL HB A 2 ASP HBx 1.0 . 4.38 1082 1026 A 5 VAL HB A 2 ASP HBy 1.0 . 4.38 1083 1027 A 2 ASP HBy A 5 VAL HGy% 1.0 . 3.68 1084 1027 A 2 ASP HBx A 5 VAL HGy% 1.0 . 3.68 1085 1027 A 5 VAL HGx% A 2 ASP HBx 1.0 . 3.68 1086 1027 A 5 VAL HGx% A 2 ASP HBy 1.0 . 3.68 1087 1028 A 2 ASP HBx A 40 LEU HDy% 1.0 . 4.33 1088 1028 A 2 ASP HBy A 40 LEU HDy% 1.0 . 4.33 1089 1028 A 40 LEU HDx% A 2 ASP HBx 1.0 . 4.33 1090 1028 A 2 ASP HBy A 40 LEU HDx% 1.0 . 4.33 1091 1029 A 2 ASP HBy A 44 GLN HBy 1.0 . 5.11 1092 1029 A 2 ASP HBx A 44 GLN HBy 1.0 . 5.11 1093 1029 A 44 GLN HBx A 2 ASP HBx 1.0 . 5.11 1094 1029 A 2 ASP HBy A 44 GLN HBx 1.0 . 5.11 1095 1030 A 2 ASP HBx A 44 GLN HGy 1.0 . 4.38 1096 1030 A 2 ASP HBy A 44 GLN HGy 1.0 . 4.38 1097 1030 A 44 GLN HGx A 2 ASP HBx 1.0 . 4.38 1098 1030 A 2 ASP HBy A 44 GLN HGx 1.0 . 4.38 1099 1031 A 2 ASP HBx A 44 GLN HE2x 1.0 . 3.99 1100 1031 A 2 ASP HBy A 44 GLN HE2x 1.0 . 3.99 1101 1031 A 44 GLN HE2y A 2 ASP HBx 1.0 . 3.99 1102 1031 A 2 ASP HBy A 44 GLN HE2y 1.0 . 3.99 1103 1032 A 3 ASN HA A 6 ARG HBy 1.0 . 3.27 1104 1032 A 3 ASN HA A 6 ARG HBx 1.0 . 3.27 1105 1033 A 4 ARG H A 4 ARG HGx 1.0 . 3.62 1106 1033 A 4 ARG H A 4 ARG HGy 1.0 . 3.62 1107 1034 A 4 ARG HA A 4 ARG HGx 1.0 . 3.55 1108 1034 A 4 ARG HA A 4 ARG HGy 1.0 . 3.55 1109 1035 A 4 ARG HA A 4 ARG HDx 1.0 . 4.80 1110 1035 A 4 ARG HA A 4 ARG HDy 1.0 . 4.80 1111 1036 A 4 ARG HA A 7 GLU HBy 1.0 . 4.00 1112 1036 A 4 ARG HA A 7 GLU HBx 1.0 . 4.00 1113 1037 A 5 VAL H A 4 ARG HBy 1.0 . 3.91 1114 1037 A 5 VAL H A 4 ARG HBx 1.0 . 3.91 1115 1038 A 30 VAL HB A 4 ARG HBy 1.0 . 4.93 1116 1038 A 30 VAL HB A 4 ARG HBx 1.0 . 4.93 1117 1039 A 4 ARG HBx A 32 LEU HDy% 1.0 . 4.28 1118 1039 A 32 LEU HDx% A 4 ARG HBy 1.0 . 4.28 1119 1039 A 4 ARG HBx A 32 LEU HDx% 1.0 . 4.28 1120 1039 A 4 ARG HBy A 32 LEU HDy% 1.0 . 4.28 1121 1040 A 4 ARG HBx A 40 LEU HDy% 1.0 . 3.99 1122 1040 A 4 ARG HBy A 40 LEU HDy% 1.0 . 3.99 1123 1040 A 40 LEU HDx% A 4 ARG HBy 1.0 . 3.99 1124 1040 A 40 LEU HDx% A 4 ARG HBx 1.0 . 3.99 1125 1041 A 30 VAL HB A 4 ARG HGx 1.0 . 4.89 1126 1041 A 30 VAL HB A 4 ARG HGy 1.0 . 4.89 1127 1042 A 4 ARG HGx A 32 LEU HDy% 1.0 . 5.01 1128 1042 A 4 ARG HGy A 32 LEU HDy% 1.0 . 5.01 1129 1042 A 32 LEU HDx% A 4 ARG HGx 1.0 . 5.01 1130 1042 A 4 ARG HGy A 32 LEU HDx% 1.0 . 5.01 1131 1043 A 30 VAL HB A 4 ARG HDx 1.0 . 5.04 1132 1043 A 30 VAL HB A 4 ARG HDy 1.0 . 5.04 1133 1044 A 30 VAL HGy% A 4 ARG HDx 1.0 . 5.04 1134 1044 A 30 VAL HGy% A 4 ARG HDy 1.0 . 5.04 1135 1045 A 4 ARG HDx A 32 LEU HDy% 1.0 . 4.00 1136 1045 A 4 ARG HDy A 32 LEU HDy% 1.0 . 4.00 1137 1045 A 32 LEU HDx% A 4 ARG HDx 1.0 . 4.00 1138 1045 A 4 ARG HDy A 32 LEU HDx% 1.0 . 4.00 1139 1046 A 5 VAL H A 5 VAL HGy% 1.0 . 3.46 1140 1046 A 5 VAL H A 5 VAL HGx% 1.0 . 3.46 1141 1047 A 5 VAL HA A 37 LEU HDy% 1.0 . 4.39 1142 1047 A 5 VAL HA A 37 LEU HDx% 1.0 . 4.39 1143 1048 A 6 ARG H A 5 VAL HGy% 1.0 . 4.32 1144 1048 A 6 ARG H A 5 VAL HGx% 1.0 . 4.32 1145 1049 A 6 ARG HA A 5 VAL HGy% 1.0 . 4.80 1146 1049 A 6 ARG HA A 5 VAL HGx% 1.0 . 4.80 1147 1050 A 8 ALA HB% A 5 VAL HGy% 1.0 . 5.44 1148 1050 A 8 ALA HB% A 5 VAL HGx% 1.0 . 5.44 1149 1051 A 5 VAL HGx% A 40 LEU HBy 1.0 . 3.30 1150 1051 A 5 VAL HGy% A 40 LEU HBy 1.0 . 3.30 1151 1051 A 40 LEU HBx A 5 VAL HGy% 1.0 . 3.30 1152 1051 A 5 VAL HGx% A 40 LEU HBx 1.0 . 3.30 1153 1052 A 40 LEU HG A 5 VAL HGy% 1.0 . 4.86 1154 1052 A 40 LEU HG A 5 VAL HGx% 1.0 . 4.86 1155 1053 A 5 VAL HGx% A 40 LEU HDy% 1.0 . 3.24 1156 1053 A 5 VAL HGy% A 40 LEU HDy% 1.0 . 3.24 1157 1053 A 40 LEU HDx% A 5 VAL HGy% 1.0 . 3.24 1158 1053 A 5 VAL HGx% A 40 LEU HDx% 1.0 . 3.24 1159 1054 A 41 PHE H A 5 VAL HGy% 1.0 . 4.81 1160 1054 A 41 PHE H A 5 VAL HGx% 1.0 . 4.81 1161 1055 A 41 PHE HA A 5 VAL HGy% 1.0 . 3.51 1162 1055 A 41 PHE HA A 5 VAL HGx% 1.0 . 3.51 1163 1056 A 41 PHE HD% A 5 VAL HGy% 1.0 . 3.71 1164 1056 A 41 PHE HD% A 5 VAL HGx% 1.0 . 3.71 1165 1057 A 5 VAL HGy% A 44 GLN HBy 1.0 . 3.63 1166 1057 A 5 VAL HGx% A 44 GLN HBy 1.0 . 3.63 1167 1057 A 44 GLN HBx A 5 VAL HGy% 1.0 . 3.63 1168 1057 A 5 VAL HGx% A 44 GLN HBx 1.0 . 3.63 1169 1058 A 5 VAL HGx% A 44 GLN HGy 1.0 . 3.78 1170 1058 A 5 VAL HGy% A 44 GLN HGy 1.0 . 3.78 1171 1058 A 44 GLN HGx A 5 VAL HGy% 1.0 . 3.78 1172 1058 A 5 VAL HGx% A 44 GLN HGx 1.0 . 3.78 1173 1059 A 45 LEU HBy A 5 VAL HGy% 1.0 . 5.44 1174 1059 A 45 LEU HBy A 5 VAL HGx% 1.0 . 5.44 1175 1060 A 45 LEU HG A 5 VAL HGy% 1.0 . 4.63 1176 1060 A 45 LEU HG A 5 VAL HGx% 1.0 . 4.63 1177 1061 A 5 VAL HGy% A 45 LEU HDy% 1.0 . 3.77 1178 1061 A 5 VAL HGx% A 45 LEU HDy% 1.0 . 3.77 1179 1061 A 45 LEU HDx% A 5 VAL HGy% 1.0 . 3.77 1180 1061 A 5 VAL HGx% A 45 LEU HDx% 1.0 . 3.77 1181 1062 A 6 ARG H A 6 ARG HBy 1.0 . 3.13 1182 1062 A 6 ARG H A 6 ARG HBx 1.0 . 3.13 1183 1063 A 6 ARG H A 6 ARG HGy 1.0 . 4.49 1184 1063 A 6 ARG H A 6 ARG HGx 1.0 . 4.49 1185 1064 A 6 ARG HA A 6 ARG HGy 1.0 . 3.65 1186 1064 A 6 ARG HA A 6 ARG HGx 1.0 . 3.65 1187 1065 A 6 ARG HA A 9 CYS HBy 1.0 . 4.14 1188 1065 A 6 ARG HA A 9 CYS HBx 1.0 . 4.14 1189 1066 A 6 ARG HBy A 6 ARG HDx 1.0 . 3.21 1190 1066 A 6 ARG HDy A 6 ARG HBy 1.0 . 3.21 1191 1066 A 6 ARG HDy A 6 ARG HBx 1.0 . 3.21 1192 1066 A 6 ARG HBx A 6 ARG HDx 1.0 . 3.21 1193 1067 A 7 GLU H A 6 ARG HBy 1.0 . 3.33 1194 1067 A 7 GLU H A 6 ARG HBx 1.0 . 3.33 1195 1068 A 6 ARG HGx A 9 CYS HBy 1.0 . 4.80 1196 1068 A 9 CYS HBx A 6 ARG HGy 1.0 . 4.80 1197 1068 A 6 ARG HGx A 9 CYS HBx 1.0 . 4.80 1198 1068 A 6 ARG HGy A 9 CYS HBy 1.0 . 4.80 1199 1069 A 7 GLU H A 7 GLU HBy 1.0 . 3.35 1200 1069 A 7 GLU H A 7 GLU HBx 1.0 . 3.35 1201 1070 A 7 GLU H A 7 GLU HGx 1.0 . 4.20 1202 1070 A 7 GLU H A 7 GLU HGy 1.0 . 4.20 1203 1071 A 7 GLU HA A 7 GLU HGx 1.0 . 3.57 1204 1071 A 7 GLU HA A 7 GLU HGy 1.0 . 3.57 1205 1072 A 7 GLU HA A 10 GLN HBx 1.0 . 3.78 1206 1072 A 7 GLU HA A 10 GLN HBy 1.0 . 3.78 1207 1073 A 29 HIS HD2 A 7 GLU HBy 1.0 . 4.25 1208 1073 A 29 HIS HD2 A 7 GLU HBx 1.0 . 4.25 1209 1074 A 30 VAL HGx% A 7 GLU HBy 1.0 . 3.50 1210 1074 A 30 VAL HGx% A 7 GLU HBx 1.0 . 3.50 1211 1075 A 29 HIS HE1 A 7 GLU HGx 1.0 . 4.63 1212 1075 A 29 HIS HE1 A 7 GLU HGy 1.0 . 4.63 1213 1076 A 30 VAL HGx% A 7 GLU HGx 1.0 . 3.97 1214 1076 A 30 VAL HGx% A 7 GLU HGy 1.0 . 3.97 1215 1077 A 8 ALA HA A 11 TYR HBy 1.0 . 3.75 1216 1077 A 8 ALA HA A 11 TYR HBx 1.0 . 3.75 1217 1078 A 8 ALA HB% A 37 LEU HDy% 1.0 . 3.19 1218 1078 A 8 ALA HB% A 37 LEU HDx% 1.0 . 3.19 1219 1079 A 9 CYS H A 9 CYS HBy 1.0 . 3.38 1220 1079 A 9 CYS H A 9 CYS HBx 1.0 . 3.38 1221 1080 A 10 GLN H A 9 CYS HBy 1.0 . 3.68 1222 1080 A 10 GLN H A 9 CYS HBx 1.0 . 3.68 1223 1081 A 52 TRP HZ2 A 9 CYS HBy 1.0 . 3.75 1224 1081 A 52 TRP HZ2 A 9 CYS HBx 1.0 . 3.75 1225 1082 A 52 TRP HH2 A 9 CYS HBy 1.0 . 3.68 1226 1082 A 52 TRP HH2 A 9 CYS HBx 1.0 . 3.68 1227 1083 A 10 GLN H A 10 GLN HBx 1.0 . 3.13 1228 1083 A 10 GLN H A 10 GLN HBy 1.0 . 3.13 1229 1084 A 10 GLN H A 10 GLN HGx 1.0 . 4.54 1230 1084 A 10 GLN H A 10 GLN HGy 1.0 . 4.54 1231 1085 A 10 GLN HA A 10 GLN HE2y 1.0 . 4.27 1232 1085 A 10 GLN HA A 10 GLN HE2x 1.0 . 4.27 1233 1086 A 10 GLN HE2y A 10 GLN HBy 1.0 . 4.44 1234 1086 A 10 GLN HE2x A 10 GLN HBy 1.0 . 4.44 1235 1086 A 10 GLN HE2y A 10 GLN HBx 1.0 . 4.44 1236 1086 A 10 GLN HE2x A 10 GLN HBx 1.0 . 4.44 1237 1087 A 11 TYR H A 10 GLN HBx 1.0 . 3.52 1238 1087 A 11 TYR H A 10 GLN HBy 1.0 . 3.52 1239 1088 A 10 GLN HE2x A 10 GLN HGx 1.0 . 2.97 1240 1088 A 10 GLN HE2y A 10 GLN HGy 1.0 . 2.97 1241 1088 A 10 GLN HE2x A 10 GLN HGy 1.0 . 2.97 1242 1088 A 10 GLN HE2y A 10 GLN HGx 1.0 . 2.97 1243 1089 A 11 TYR H A 10 GLN HGx 1.0 . 5.00 1244 1089 A 11 TYR H A 10 GLN HGy 1.0 . 5.00 1245 1090 A 11 TYR HA A 14 ASP HBy 1.0 . 3.89 1246 1090 A 11 TYR HA A 14 ASP HBx 1.0 . 3.89 1247 1091 A 12 ILE H A 11 TYR HBy 1.0 . 3.81 1248 1091 A 12 ILE H A 11 TYR HBx 1.0 . 3.81 1249 1092 A 11 TYR HD% A 12 ILE HG1x 1.0 . 4.21 1250 1092 A 11 TYR HD% A 12 ILE HG1y 1.0 . 4.21 1251 1093 A 11 TYR HE% A 25 SER HBx 1.0 . 3.93 1252 1093 A 11 TYR HE% A 25 SER HBy 1.0 . 3.93 1253 1094 A 11 TYR HE% A 29 HIS HBy 1.0 . 4.69 1254 1094 A 11 TYR HE% A 29 HIS HBx 1.0 . 4.69 1255 1095 A 12 ILE HG2% A 13 SER HBx 1.0 . 5.34 1256 1095 A 12 ILE HG2% A 13 SER HBy 1.0 . 5.34 1257 1096 A 12 ILE HG2% A 53 ARG HBx 1.0 . 3.93 1258 1096 A 12 ILE HG2% A 53 ARG HBy 1.0 . 3.93 1259 1097 A 12 ILE HG2% A 53 ARG HGx 1.0 . 3.78 1260 1097 A 12 ILE HG2% A 53 ARG HGy 1.0 . 3.78 1261 1098 A 12 ILE HG2% A 53 ARG HDx 1.0 . 3.86 1262 1098 A 12 ILE HG2% A 53 ARG HDy 1.0 . 3.86 1263 1099 A 21 PHE HE% A 12 ILE HG1x 1.0 . 4.17 1264 1099 A 21 PHE HE% A 12 ILE HG1y 1.0 . 4.17 1265 1100 A 21 PHE HZ A 12 ILE HG1x 1.0 . 4.48 1266 1100 A 21 PHE HZ A 12 ILE HG1y 1.0 . 4.48 1267 1101 A 26 VAL HGx% A 12 ILE HG1x 1.0 . 4.08 1268 1101 A 26 VAL HGx% A 12 ILE HG1y 1.0 . 4.08 1269 1102 A 26 VAL HGy% A 12 ILE HG1x 1.0 . 4.07 1270 1102 A 26 VAL HGy% A 12 ILE HG1y 1.0 . 4.07 1271 1103 A 52 TRP HE3 A 12 ILE HG1x 1.0 . 5.34 1272 1103 A 52 TRP HE3 A 12 ILE HG1y 1.0 . 5.34 1273 1104 A 12 ILE HD1% A 49 VAL HGy% 1.0 . 3.91 1274 1104 A 12 ILE HD1% A 49 VAL HGx% 1.0 . 3.91 1275 1105 A 12 ILE HD1% A 53 ARG HBx 1.0 . 4.74 1276 1105 A 12 ILE HD1% A 53 ARG HBy 1.0 . 4.74 1277 1106 A 13 SER H A 13 SER HBx 1.0 . 3.65 1278 1106 A 13 SER H A 13 SER HBy 1.0 . 3.65 1279 1107 A 14 ASP H A 13 SER HBx 1.0 . 3.91 1280 1107 A 14 ASP H A 13 SER HBy 1.0 . 3.91 1281 1108 A 14 ASP HA A 13 SER HBx 1.0 . 4.85 1282 1108 A 14 ASP HA A 13 SER HBy 1.0 . 4.85 1283 1109 A 15 HIS H A 13 SER HBx 1.0 . 5.19 1284 1109 A 15 HIS H A 13 SER HBy 1.0 . 5.19 1285 1110 A 16 LEU H A 13 SER HBx 1.0 . 5.34 1286 1110 A 16 LEU H A 13 SER HBy 1.0 . 5.34 1287 1111 A 16 LEU HBx A 13 SER HBx 1.0 . 5.16 1288 1111 A 16 LEU HBx A 13 SER HBy 1.0 . 5.16 1289 1112 A 13 SER HBx A 16 LEU HDy% 1.0 . 5.28 1290 1112 A 13 SER HBy A 16 LEU HDy% 1.0 . 5.28 1291 1112 A 16 LEU HDx% A 13 SER HBx 1.0 . 5.28 1292 1112 A 13 SER HBy A 16 LEU HDx% 1.0 . 5.28 1293 1113 A 14 ASP H A 14 ASP HBy 1.0 . 3.27 1294 1113 A 14 ASP H A 14 ASP HBx 1.0 . 3.27 1295 1114 A 15 HIS HD2 A 14 ASP HBy 1.0 . 3.35 1296 1114 A 15 HIS HD2 A 14 ASP HBx 1.0 . 3.35 1297 1115 A 16 LEU H A 16 LEU HDy% 1.0 . 4.32 1298 1115 A 16 LEU H A 16 LEU HDx% 1.0 . 4.32 1299 1116 A 16 LEU HA A 16 LEU HDy% 1.0 . 3.40 1300 1116 A 16 LEU HA A 16 LEU HDx% 1.0 . 3.40 1301 1117 A 16 LEU HG A 57 ARG HGy 1.0 . 4.70 1302 1117 A 16 LEU HG A 57 ARG HGx 1.0 . 4.70 1303 1118 A 53 ARG HA A 16 LEU HDy% 1.0 . 4.89 1304 1118 A 53 ARG HA A 16 LEU HDx% 1.0 . 4.89 1305 1119 A 16 LEU HDx% A 53 ARG HGx 1.0 . 5.01 1306 1119 A 16 LEU HDy% A 53 ARG HGx 1.0 . 5.01 1307 1119 A 53 ARG HGy A 16 LEU HDy% 1.0 . 5.01 1308 1119 A 53 ARG HGy A 16 LEU HDx% 1.0 . 5.01 1309 1120 A 56 GLN HBy A 16 LEU HDy% 1.0 . 4.85 1310 1120 A 56 GLN HBy A 16 LEU HDx% 1.0 . 4.85 1311 1121 A 16 LEU HDx% A 56 GLN HGx 1.0 . 4.67 1312 1121 A 16 LEU HDy% A 56 GLN HGx 1.0 . 4.67 1313 1121 A 56 GLN HGy A 16 LEU HDy% 1.0 . 4.67 1314 1121 A 56 GLN HGy A 16 LEU HDx% 1.0 . 4.67 1315 1122 A 57 ARG H A 16 LEU HDy% 1.0 . 4.89 1316 1122 A 57 ARG H A 16 LEU HDx% 1.0 . 4.89 1317 1123 A 57 ARG HA A 16 LEU HDy% 1.0 . 3.55 1318 1123 A 57 ARG HA A 16 LEU HDx% 1.0 . 3.55 1319 1124 A 16 LEU HDx% A 57 ARG HGy 1.0 . 3.95 1320 1124 A 16 LEU HDy% A 57 ARG HGy 1.0 . 3.95 1321 1124 A 57 ARG HGx A 16 LEU HDy% 1.0 . 3.95 1322 1124 A 16 LEU HDx% A 57 ARG HGx 1.0 . 3.95 1323 1125 A 16 LEU HDx% A 57 ARG HDy 1.0 . 5.05 1324 1125 A 16 LEU HDy% A 57 ARG HDy 1.0 . 5.05 1325 1125 A 57 ARG HDx A 16 LEU HDy% 1.0 . 5.05 1326 1125 A 16 LEU HDx% A 57 ARG HDx 1.0 . 5.05 1327 1126 A 60 GLN HBy A 16 LEU HDy% 1.0 . 5.44 1328 1126 A 60 GLN HBy A 16 LEU HDx% 1.0 . 5.44 1329 1127 A 79 VAL HA A 16 LEU HDy% 1.0 . 4.48 1330 1127 A 79 VAL HA A 16 LEU HDx% 1.0 . 4.48 1331 1128 A 19 SER H A 19 SER HBx 1.0 . 3.69 1332 1128 A 19 SER H A 19 SER HBy 1.0 . 3.69 1333 1129 A 20 ASN H A 19 SER HBx 1.0 . 3.83 1334 1129 A 20 ASN H A 19 SER HBy 1.0 . 3.83 1335 1130 A 19 SER HBy A 20 ASN HBx 1.0 . 4.76 1336 1130 A 19 SER HBx A 20 ASN HBx 1.0 . 4.76 1337 1130 A 20 ASN HBy A 19 SER HBx 1.0 . 4.76 1338 1130 A 19 SER HBy A 20 ASN HBy 1.0 . 4.76 1339 1131 A 19 SER HBy A 20 ASN HD2x 1.0 . 4.76 1340 1131 A 19 SER HBx A 20 ASN HD2x 1.0 . 4.76 1341 1131 A 20 ASN HD2y A 19 SER HBx 1.0 . 4.76 1342 1131 A 19 SER HBy A 20 ASN HD2y 1.0 . 4.76 1343 1132 A 20 ASN H A 20 ASN HBx 1.0 . 3.23 1344 1132 A 20 ASN H A 20 ASN HBy 1.0 . 3.23 1345 1133 A 20 ASN H A 20 ASN HD2x 1.0 . 4.97 1346 1133 A 20 ASN H A 20 ASN HD2y 1.0 . 4.97 1347 1134 A 20 ASN HBx A 20 ASN HD2x 1.0 . 3.14 1348 1134 A 20 ASN HD2y A 20 ASN HBx 1.0 . 3.14 1349 1134 A 20 ASN HBy A 20 ASN HD2y 1.0 . 3.14 1350 1134 A 20 ASN HBy A 20 ASN HD2x 1.0 . 3.14 1351 1135 A 21 PHE H A 21 PHE HBy 1.0 . 3.08 1352 1135 A 21 PHE H A 21 PHE HBx 1.0 . 3.08 1353 1136 A 21 PHE HBx A 22 ASP HBx 1.0 . 5.12 1354 1136 A 21 PHE HBy A 22 ASP HBx 1.0 . 5.12 1355 1136 A 22 ASP HBy A 21 PHE HBy 1.0 . 5.12 1356 1136 A 21 PHE HBx A 22 ASP HBy 1.0 . 5.12 1357 1137 A 21 PHE HD% A 50 LEU HDy% 1.0 . 4.34 1358 1137 A 21 PHE HD% A 50 LEU HDx% 1.0 . 4.34 1359 1138 A 21 PHE HE% A 49 VAL HGy% 1.0 . 3.73 1360 1138 A 21 PHE HE% A 49 VAL HGx% 1.0 . 3.73 1361 1139 A 21 PHE HE% A 50 LEU HDy% 1.0 . 3.41 1362 1139 A 21 PHE HE% A 50 LEU HDx% 1.0 . 3.41 1363 1140 A 21 PHE HZ A 49 VAL HGy% 1.0 . 3.73 1364 1140 A 21 PHE HZ A 49 VAL HGx% 1.0 . 3.73 1365 1141 A 22 ASP H A 22 ASP HBx 1.0 . 3.59 1366 1141 A 22 ASP H A 22 ASP HBy 1.0 . 3.59 1367 1142 A 23 ILE H A 22 ASP HBx 1.0 . 4.40 1368 1142 A 23 ILE H A 22 ASP HBy 1.0 . 4.40 1369 1143 A 24 ALA H A 22 ASP HBx 1.0 . 4.68 1370 1143 A 24 ALA H A 22 ASP HBy 1.0 . 4.68 1371 1144 A 24 ALA HB% A 22 ASP HBx 1.0 . 5.32 1372 1144 A 24 ALA HB% A 22 ASP HBy 1.0 . 5.32 1373 1145 A 25 SER H A 22 ASP HBx 1.0 . 4.43 1374 1145 A 25 SER H A 22 ASP HBy 1.0 . 4.43 1375 1146 A 23 ILE H A 23 ILE HG1y 1.0 . 4.80 1376 1146 A 23 ILE H A 23 ILE HG1x 1.0 . 4.80 1377 1147 A 23 ILE HA A 23 ILE HG1y 1.0 . 3.70 1378 1147 A 23 ILE HA A 23 ILE HG1x 1.0 . 3.70 1379 1148 A 23 ILE HG2% A 34 PRO HBy 1.0 . 3.83 1380 1148 A 23 ILE HG2% A 34 PRO HBx 1.0 . 3.83 1381 1149 A 23 ILE HG2% A 49 VAL HGy% 1.0 . 5.44 1382 1149 A 23 ILE HG2% A 49 VAL HGx% 1.0 . 5.44 1383 1150 A 26 VAL HGx% A 23 ILE HG1y 1.0 . 4.33 1384 1150 A 26 VAL HGx% A 23 ILE HG1x 1.0 . 4.33 1385 1151 A 26 VAL HGy% A 23 ILE HG1y 1.0 . 5.34 1386 1151 A 26 VAL HGy% A 23 ILE HG1x 1.0 . 5.34 1387 1152 A 27 ALA HB% A 23 ILE HG1y 1.0 . 4.15 1388 1152 A 27 ALA HB% A 23 ILE HG1x 1.0 . 4.15 1389 1153 A 23 ILE HG1x A 37 LEU HDy% 1.0 . 4.76 1390 1153 A 37 LEU HDx% A 23 ILE HG1y 1.0 . 4.76 1391 1153 A 37 LEU HDx% A 23 ILE HG1x 1.0 . 4.76 1392 1153 A 23 ILE HG1y A 37 LEU HDy% 1.0 . 4.76 1393 1154 A 23 ILE HG1y A 49 VAL HGy% 1.0 . 3.59 1394 1154 A 23 ILE HG1x A 49 VAL HGy% 1.0 . 3.59 1395 1154 A 49 VAL HGx% A 23 ILE HG1y 1.0 . 3.59 1396 1154 A 49 VAL HGx% A 23 ILE HG1x 1.0 . 3.59 1397 1155 A 23 ILE HD1% A 34 PRO HBy 1.0 . 5.26 1398 1155 A 23 ILE HD1% A 34 PRO HBx 1.0 . 5.26 1399 1156 A 23 ILE HD1% A 49 VAL HGy% 1.0 . 3.70 1400 1156 A 23 ILE HD1% A 49 VAL HGx% 1.0 . 3.70 1401 1157 A 24 ALA HB% A 34 PRO HBy 1.0 . 4.79 1402 1157 A 24 ALA HB% A 34 PRO HBx 1.0 . 4.79 1403 1158 A 25 SER H A 25 SER HBx 1.0 . 3.70 1404 1158 A 25 SER H A 25 SER HBy 1.0 . 3.70 1405 1159 A 25 SER HA A 28 GLN HBx 1.0 . 3.97 1406 1159 A 25 SER HA A 28 GLN HBy 1.0 . 3.97 1407 1160 A 25 SER HA A 28 GLN HGx 1.0 . 4.79 1408 1160 A 25 SER HA A 28 GLN HGy 1.0 . 4.79 1409 1161 A 26 VAL HA A 29 HIS HBy 1.0 . 4.58 1410 1161 A 26 VAL HA A 29 HIS HBx 1.0 . 4.58 1411 1162 A 26 VAL HB A 37 LEU HDy% 1.0 . 4.13 1412 1162 A 26 VAL HB A 37 LEU HDx% 1.0 . 4.13 1413 1163 A 26 VAL HGx% A 29 HIS HBy 1.0 . 4.71 1414 1163 A 26 VAL HGx% A 29 HIS HBx 1.0 . 4.71 1415 1164 A 26 VAL HGx% A 37 LEU HDy% 1.0 . 3.53 1416 1164 A 26 VAL HGx% A 37 LEU HDx% 1.0 . 3.53 1417 1165 A 26 VAL HGx% A 49 VAL HGy% 1.0 . 4.60 1418 1165 A 26 VAL HGx% A 49 VAL HGx% 1.0 . 4.60 1419 1166 A 26 VAL HGy% A 49 VAL HGy% 1.0 . 4.50 1420 1166 A 26 VAL HGy% A 49 VAL HGx% 1.0 . 4.50 1421 1167 A 27 ALA H A 37 LEU HDy% 1.0 . 4.26 1422 1167 A 27 ALA H A 37 LEU HDx% 1.0 . 4.26 1423 1168 A 27 ALA HA A 37 LEU HDy% 1.0 . 3.44 1424 1168 A 27 ALA HA A 37 LEU HDx% 1.0 . 3.44 1425 1169 A 27 ALA HB% A 34 PRO HBy 1.0 . 3.84 1426 1169 A 27 ALA HB% A 34 PRO HBx 1.0 . 3.84 1427 1170 A 27 ALA HB% A 37 LEU HDy% 1.0 . 4.17 1428 1170 A 27 ALA HB% A 37 LEU HDx% 1.0 . 4.17 1429 1171 A 28 GLN H A 28 GLN HBx 1.0 . 3.14 1430 1171 A 28 GLN H A 28 GLN HBy 1.0 . 3.14 1431 1172 A 28 GLN H A 28 GLN HGx 1.0 . 4.41 1432 1172 A 28 GLN H A 28 GLN HGy 1.0 . 4.41 1433 1173 A 28 GLN HA A 28 GLN HGx 1.0 . 3.62 1434 1173 A 28 GLN HA A 28 GLN HGy 1.0 . 3.62 1435 1174 A 29 HIS H A 28 GLN HBx 1.0 . 4.10 1436 1174 A 29 HIS H A 28 GLN HBy 1.0 . 4.10 1437 1175 A 29 HIS HA A 28 GLN HGx 1.0 . 5.11 1438 1175 A 29 HIS HA A 28 GLN HGy 1.0 . 5.11 1439 1176 A 28 GLN HGx A 29 HIS HBy 1.0 . 4.61 1440 1176 A 28 GLN HGy A 29 HIS HBy 1.0 . 4.61 1441 1176 A 29 HIS HBx A 28 GLN HGx 1.0 . 4.61 1442 1176 A 29 HIS HBx A 28 GLN HGy 1.0 . 4.61 1443 1177 A 29 HIS HD2 A 29 HIS HBy 1.0 . 3.39 1444 1177 A 29 HIS HD2 A 29 HIS HBx 1.0 . 3.39 1445 1178 A 30 VAL HA A 29 HIS HBy 1.0 . 5.32 1446 1178 A 30 VAL HA A 29 HIS HBx 1.0 . 5.32 1447 1179 A 30 VAL HGx% A 29 HIS HBy 1.0 . 4.46 1448 1179 A 30 VAL HGx% A 29 HIS HBx 1.0 . 4.46 1449 1180 A 30 VAL HGy% A 29 HIS HBy 1.0 . 5.34 1450 1180 A 30 VAL HGy% A 29 HIS HBx 1.0 . 5.34 1451 1181 A 30 VAL HGy% A 32 LEU HBx 1.0 . 3.42 1452 1181 A 30 VAL HGy% A 32 LEU HBy 1.0 . 3.42 1453 1182 A 30 VAL HGy% A 32 LEU HDy% 1.0 . 3.50 1454 1182 A 30 VAL HGy% A 32 LEU HDx% 1.0 . 3.50 1455 1183 A 32 LEU H A 32 LEU HBx 1.0 . 3.40 1456 1183 A 32 LEU H A 32 LEU HBy 1.0 . 3.40 1457 1184 A 32 LEU HA A 32 LEU HDy% 1.0 . 3.11 1458 1184 A 32 LEU HA A 32 LEU HDx% 1.0 . 3.11 1459 1185 A 33 SER H A 32 LEU HBx 1.0 . 3.66 1460 1185 A 33 SER H A 32 LEU HBy 1.0 . 3.66 1461 1186 A 32 LEU HBx A 36 ARG HBx 1.0 . 4.72 1462 1186 A 36 ARG HBy A 32 LEU HBx 1.0 . 4.72 1463 1186 A 36 ARG HBy A 32 LEU HBy 1.0 . 4.72 1464 1186 A 32 LEU HBy A 36 ARG HBx 1.0 . 4.72 1465 1187 A 37 LEU H A 32 LEU HBx 1.0 . 4.87 1466 1187 A 37 LEU H A 32 LEU HBy 1.0 . 4.87 1467 1188 A 37 LEU HBx A 32 LEU HBx 1.0 . 4.35 1468 1188 A 37 LEU HBx A 32 LEU HBy 1.0 . 4.35 1469 1189 A 37 LEU HBy A 32 LEU HBx 1.0 . 5.27 1470 1189 A 37 LEU HBy A 32 LEU HBy 1.0 . 5.27 1471 1190 A 33 SER H A 32 LEU HDy% 1.0 . 4.17 1472 1190 A 33 SER H A 32 LEU HDx% 1.0 . 4.17 1473 1191 A 32 LEU HDx% A 36 ARG HBx 1.0 . 3.78 1474 1191 A 36 ARG HBy A 32 LEU HDy% 1.0 . 3.78 1475 1191 A 36 ARG HBy A 32 LEU HDx% 1.0 . 3.78 1476 1191 A 32 LEU HDy% A 36 ARG HBx 1.0 . 3.78 1477 1192 A 32 LEU HDx% A 36 ARG HGx 1.0 . 3.31 1478 1192 A 36 ARG HGy A 32 LEU HDy% 1.0 . 3.31 1479 1192 A 32 LEU HDx% A 36 ARG HGy 1.0 . 3.31 1480 1192 A 32 LEU HDy% A 36 ARG HGx 1.0 . 3.31 1481 1193 A 32 LEU HDy% A 36 ARG HDy 1.0 . 4.34 1482 1193 A 32 LEU HDx% A 36 ARG HDy 1.0 . 4.34 1483 1193 A 36 ARG HDx A 32 LEU HDy% 1.0 . 4.34 1484 1193 A 32 LEU HDx% A 36 ARG HDx 1.0 . 4.34 1485 1194 A 37 LEU H A 32 LEU HDy% 1.0 . 4.66 1486 1194 A 37 LEU H A 32 LEU HDx% 1.0 . 4.66 1487 1195 A 37 LEU HA A 32 LEU HDy% 1.0 . 3.70 1488 1195 A 37 LEU HA A 32 LEU HDx% 1.0 . 3.70 1489 1196 A 34 PRO HA A 37 LEU HDy% 1.0 . 4.52 1490 1196 A 34 PRO HA A 37 LEU HDx% 1.0 . 4.52 1491 1197 A 35 SER H A 34 PRO HBy 1.0 . 3.88 1492 1197 A 35 SER H A 34 PRO HBx 1.0 . 3.88 1493 1198 A 36 ARG H A 36 ARG HGx 1.0 . 4.46 1494 1198 A 36 ARG H A 36 ARG HGy 1.0 . 4.46 1495 1199 A 36 ARG HA A 36 ARG HGx 1.0 . 3.38 1496 1199 A 36 ARG HA A 36 ARG HGy 1.0 . 3.38 1497 1200 A 36 ARG HA A 36 ARG HDy 1.0 . 3.48 1498 1200 A 36 ARG HA A 36 ARG HDx 1.0 . 3.48 1499 1201 A 36 ARG HBx A 36 ARG HDy 1.0 . 3.61 1500 1201 A 36 ARG HBy A 36 ARG HDy 1.0 . 3.61 1501 1201 A 36 ARG HDx A 36 ARG HBx 1.0 . 3.61 1502 1201 A 36 ARG HBy A 36 ARG HDx 1.0 . 3.61 1503 1202 A 36 ARG HDx A 40 LEU HDy% 1.0 . 5.17 1504 1202 A 36 ARG HDy A 40 LEU HDy% 1.0 . 5.17 1505 1202 A 40 LEU HDx% A 36 ARG HDy 1.0 . 5.17 1506 1202 A 40 LEU HDx% A 36 ARG HDx 1.0 . 5.17 1507 1203 A 37 LEU H A 37 LEU HDy% 1.0 . 4.35 1508 1203 A 37 LEU H A 37 LEU HDx% 1.0 . 4.35 1509 1204 A 37 LEU HA A 37 LEU HDy% 1.0 . 3.39 1510 1204 A 37 LEU HA A 37 LEU HDx% 1.0 . 3.39 1511 1205 A 37 LEU HA A 40 LEU HBy 1.0 . 3.94 1512 1205 A 37 LEU HA A 40 LEU HBx 1.0 . 3.94 1513 1206 A 37 LEU HA A 40 LEU HDy% 1.0 . 4.02 1514 1206 A 37 LEU HA A 40 LEU HDx% 1.0 . 4.02 1515 1207 A 37 LEU HBx A 37 LEU HDy% 1.0 . 3.12 1516 1207 A 37 LEU HBx A 37 LEU HDx% 1.0 . 3.12 1517 1208 A 37 LEU HG A 49 VAL HGy% 1.0 . 4.76 1518 1208 A 37 LEU HG A 49 VAL HGx% 1.0 . 4.76 1519 1209 A 38 SER H A 37 LEU HDy% 1.0 . 4.19 1520 1209 A 38 SER H A 37 LEU HDx% 1.0 . 4.19 1521 1210 A 38 SER HA A 37 LEU HDy% 1.0 . 5.44 1522 1210 A 38 SER HA A 37 LEU HDx% 1.0 . 5.44 1523 1211 A 41 PHE H A 37 LEU HDy% 1.0 . 4.84 1524 1211 A 41 PHE H A 37 LEU HDx% 1.0 . 4.84 1525 1212 A 41 PHE HA A 37 LEU HDy% 1.0 . 5.14 1526 1212 A 41 PHE HA A 37 LEU HDx% 1.0 . 5.14 1527 1213 A 41 PHE HBx A 37 LEU HDy% 1.0 . 4.37 1528 1213 A 41 PHE HBx A 37 LEU HDx% 1.0 . 4.37 1529 1214 A 41 PHE HD% A 37 LEU HDy% 1.0 . 3.55 1530 1214 A 41 PHE HD% A 37 LEU HDx% 1.0 . 3.55 1531 1215 A 41 PHE HE% A 37 LEU HDy% 1.0 . 3.44 1532 1215 A 41 PHE HE% A 37 LEU HDx% 1.0 . 3.44 1533 1216 A 37 LEU HDx% A 49 VAL HGy% 1.0 . 3.84 1534 1216 A 37 LEU HDy% A 49 VAL HGy% 1.0 . 3.84 1535 1216 A 49 VAL HGx% A 37 LEU HDy% 1.0 . 3.84 1536 1216 A 37 LEU HDx% A 49 VAL HGx% 1.0 . 3.84 1537 1217 A 38 SER HA A 49 VAL HGy% 1.0 . 3.85 1538 1217 A 38 SER HA A 49 VAL HGx% 1.0 . 3.85 1539 1218 A 39 HIS H A 40 LEU HDy% 1.0 . 5.44 1540 1218 A 39 HIS H A 40 LEU HDx% 1.0 . 5.44 1541 1219 A 39 HIS HA A 42 ARG HBy 1.0 . 4.07 1542 1219 A 39 HIS HA A 42 ARG HBx 1.0 . 4.07 1543 1220 A 39 HIS HD2 A 40 LEU HDy% 1.0 . 4.32 1544 1220 A 39 HIS HD2 A 40 LEU HDx% 1.0 . 4.32 1545 1221 A 40 LEU H A 40 LEU HBy 1.0 . 3.14 1546 1221 A 40 LEU H A 40 LEU HBx 1.0 . 3.14 1547 1222 A 40 LEU H A 40 LEU HDy% 1.0 . 3.91 1548 1222 A 40 LEU H A 40 LEU HDx% 1.0 . 3.91 1549 1223 A 40 LEU HA A 40 LEU HDy% 1.0 . 3.14 1550 1223 A 40 LEU HA A 40 LEU HDx% 1.0 . 3.14 1551 1224 A 40 LEU HA A 43 GLN HBy 1.0 . 3.69 1552 1224 A 40 LEU HA A 43 GLN HBx 1.0 . 3.69 1553 1225 A 40 LEU HA A 43 GLN HGy 1.0 . 4.94 1554 1225 A 40 LEU HA A 43 GLN HGx 1.0 . 4.94 1555 1226 A 40 LEU HA A 44 GLN HGy 1.0 . 5.13 1556 1226 A 40 LEU HA A 44 GLN HGx 1.0 . 5.13 1557 1227 A 40 LEU HBx A 40 LEU HDy% 1.0 . 2.82 1558 1227 A 40 LEU HBy A 40 LEU HDy% 1.0 . 2.82 1559 1227 A 40 LEU HDx% A 40 LEU HBy 1.0 . 2.82 1560 1227 A 40 LEU HDx% A 40 LEU HBx 1.0 . 2.82 1561 1228 A 41 PHE HA A 40 LEU HBy 1.0 . 4.76 1562 1228 A 41 PHE HA A 40 LEU HBx 1.0 . 4.76 1563 1229 A 40 LEU HDx% A 43 GLN HBy 1.0 . 4.73 1564 1229 A 43 GLN HBx A 40 LEU HDy% 1.0 . 4.73 1565 1229 A 40 LEU HDx% A 43 GLN HBx 1.0 . 4.73 1566 1229 A 40 LEU HDy% A 43 GLN HBy 1.0 . 4.73 1567 1230 A 40 LEU HDy% A 44 GLN HGy 1.0 . 3.96 1568 1230 A 44 GLN HGx A 40 LEU HDy% 1.0 . 3.96 1569 1230 A 40 LEU HDx% A 44 GLN HGx 1.0 . 3.96 1570 1230 A 40 LEU HDx% A 44 GLN HGy 1.0 . 3.96 1571 1231 A 40 LEU HDx% A 44 GLN HE2x 1.0 . 3.80 1572 1231 A 40 LEU HDy% A 44 GLN HE2x 1.0 . 3.80 1573 1231 A 44 GLN HE2y A 40 LEU HDy% 1.0 . 3.80 1574 1231 A 40 LEU HDx% A 44 GLN HE2y 1.0 . 3.80 1575 1232 A 41 PHE HA A 45 LEU HDy% 1.0 . 5.37 1576 1232 A 41 PHE HA A 45 LEU HDx% 1.0 . 5.37 1577 1233 A 41 PHE HBx A 49 VAL HGy% 1.0 . 4.43 1578 1233 A 41 PHE HBx A 49 VAL HGx% 1.0 . 4.43 1579 1234 A 41 PHE HBy A 49 VAL HGy% 1.0 . 4.38 1580 1234 A 41 PHE HBy A 49 VAL HGx% 1.0 . 4.38 1581 1235 A 41 PHE HD% A 49 VAL HGy% 1.0 . 3.78 1582 1235 A 41 PHE HD% A 49 VAL HGx% 1.0 . 3.78 1583 1236 A 41 PHE HE% A 45 LEU HDy% 1.0 . 3.96 1584 1236 A 41 PHE HE% A 45 LEU HDx% 1.0 . 3.96 1585 1237 A 41 PHE HE% A 49 VAL HGy% 1.0 . 3.99 1586 1237 A 41 PHE HE% A 49 VAL HGx% 1.0 . 3.99 1587 1238 A 41 PHE HZ A 49 VAL HGy% 1.0 . 4.27 1588 1238 A 41 PHE HZ A 49 VAL HGx% 1.0 . 4.27 1589 1239 A 42 ARG H A 42 ARG HBy 1.0 . 3.16 1590 1239 A 42 ARG H A 42 ARG HBx 1.0 . 3.16 1591 1240 A 42 ARG HA A 42 ARG HDx 1.0 . 3.79 1592 1240 A 42 ARG HA A 42 ARG HDy 1.0 . 3.79 1593 1241 A 43 GLN H A 42 ARG HBy 1.0 . 3.54 1594 1241 A 43 GLN H A 42 ARG HBx 1.0 . 3.54 1595 1242 A 47 ILE HA A 42 ARG HGy 1.0 . 4.40 1596 1242 A 47 ILE HA A 42 ARG HGx 1.0 . 4.40 1597 1243 A 48 SER H A 42 ARG HGy 1.0 . 4.88 1598 1243 A 48 SER H A 42 ARG HGx 1.0 . 4.88 1599 1244 A 43 GLN H A 43 GLN HBy 1.0 . 3.03 1600 1244 A 43 GLN H A 43 GLN HBx 1.0 . 3.03 1601 1245 A 43 GLN HA A 43 GLN HGy 1.0 . 3.44 1602 1245 A 43 GLN HA A 43 GLN HGx 1.0 . 3.44 1603 1246 A 44 GLN H A 44 GLN HBy 1.0 . 3.13 1604 1246 A 44 GLN H A 44 GLN HBx 1.0 . 3.13 1605 1247 A 44 GLN H A 44 GLN HGy 1.0 . 3.51 1606 1247 A 44 GLN H A 44 GLN HGx 1.0 . 3.51 1607 1248 A 44 GLN HA A 44 GLN HGy 1.0 . 3.33 1608 1248 A 44 GLN HA A 44 GLN HGx 1.0 . 3.33 1609 1249 A 44 GLN HBx A 44 GLN HE2x 1.0 . 4.68 1610 1249 A 44 GLN HBy A 44 GLN HE2x 1.0 . 4.68 1611 1249 A 44 GLN HE2y A 44 GLN HBy 1.0 . 4.68 1612 1249 A 44 GLN HBx A 44 GLN HE2y 1.0 . 4.68 1613 1250 A 45 LEU H A 44 GLN HBy 1.0 . 3.84 1614 1250 A 45 LEU H A 44 GLN HBx 1.0 . 3.84 1615 1251 A 45 LEU HA A 44 GLN HBy 1.0 . 5.34 1616 1251 A 45 LEU HA A 44 GLN HBx 1.0 . 5.34 1617 1252 A 44 GLN HBx A 45 LEU HDy% 1.0 . 4.57 1618 1252 A 44 GLN HBy A 45 LEU HDy% 1.0 . 4.57 1619 1252 A 45 LEU HDx% A 44 GLN HBy 1.0 . 4.57 1620 1252 A 44 GLN HBx A 45 LEU HDx% 1.0 . 4.57 1621 1253 A 44 GLN HE2y A 44 GLN HGy 1.0 . 3.11 1622 1253 A 44 GLN HE2x A 44 GLN HGy 1.0 . 3.11 1623 1253 A 44 GLN HGx A 44 GLN HE2x 1.0 . 3.11 1624 1253 A 44 GLN HGx A 44 GLN HE2y 1.0 . 3.11 1625 1254 A 45 LEU H A 44 GLN HGy 1.0 . 5.14 1626 1254 A 45 LEU H A 44 GLN HGx 1.0 . 5.14 1627 1255 A 45 LEU H A 45 LEU HDy% 1.0 . 5.22 1628 1255 A 45 LEU H A 45 LEU HDx% 1.0 . 5.22 1629 1256 A 45 LEU H A 46 GLY HAx 1.0 . 5.30 1630 1256 A 45 LEU H A 46 GLY HAy 1.0 . 5.30 1631 1257 A 45 LEU HA A 45 LEU HDy% 1.0 . 3.53 1632 1257 A 45 LEU HA A 45 LEU HDx% 1.0 . 3.53 1633 1258 A 47 ILE HD1% A 45 LEU HDy% 1.0 . 4.49 1634 1258 A 47 ILE HD1% A 45 LEU HDx% 1.0 . 4.49 1635 1259 A 52 TRP HBy A 45 LEU HDy% 1.0 . 5.44 1636 1259 A 52 TRP HBy A 45 LEU HDx% 1.0 . 5.44 1637 1260 A 52 TRP HD1 A 45 LEU HDy% 1.0 . 3.93 1638 1260 A 52 TRP HD1 A 45 LEU HDx% 1.0 . 3.93 1639 1261 A 47 ILE HA A 46 GLY HAx 1.0 . 4.55 1640 1261 A 47 ILE HA A 46 GLY HAy 1.0 . 4.55 1641 1262 A 47 ILE H A 47 ILE HG1y 1.0 . 4.21 1642 1262 A 47 ILE H A 47 ILE HG1x 1.0 . 4.21 1643 1263 A 47 ILE HB A 51 SER HBx 1.0 . 4.29 1644 1263 A 47 ILE HB A 51 SER HBy 1.0 . 4.29 1645 1264 A 48 SER H A 47 ILE HG1y 1.0 . 4.07 1646 1264 A 48 SER H A 47 ILE HG1x 1.0 . 4.07 1647 1265 A 47 ILE HG1x A 51 SER HBx 1.0 . 4.59 1648 1265 A 47 ILE HG1y A 51 SER HBx 1.0 . 4.59 1649 1265 A 51 SER HBy A 47 ILE HG1y 1.0 . 4.59 1650 1265 A 47 ILE HG1x A 51 SER HBy 1.0 . 4.59 1651 1266 A 52 TRP HA A 47 ILE HG1y 1.0 . 5.03 1652 1266 A 52 TRP HA A 47 ILE HG1x 1.0 . 5.03 1653 1267 A 52 TRP HD1 A 47 ILE HG1y 1.0 . 4.76 1654 1267 A 52 TRP HD1 A 47 ILE HG1x 1.0 . 4.76 1655 1268 A 48 SER H A 48 SER HBx 1.0 . 3.11 1656 1268 A 48 SER H A 48 SER HBy 1.0 . 3.11 1657 1269 A 49 VAL H A 48 SER HBx 1.0 . 3.37 1658 1269 A 49 VAL H A 48 SER HBy 1.0 . 3.37 1659 1270 A 50 LEU H A 48 SER HBx 1.0 . 4.20 1660 1270 A 50 LEU H A 48 SER HBy 1.0 . 4.20 1661 1271 A 51 SER H A 48 SER HBx 1.0 . 3.76 1662 1271 A 51 SER H A 48 SER HBy 1.0 . 3.76 1663 1272 A 49 VAL H A 49 VAL HGy% 1.0 . 3.27 1664 1272 A 49 VAL H A 49 VAL HGx% 1.0 . 3.27 1665 1273 A 49 VAL HA A 49 VAL HGy% 1.0 . 3.14 1666 1273 A 49 VAL HA A 49 VAL HGx% 1.0 . 3.14 1667 1274 A 50 LEU H A 49 VAL HGy% 1.0 . 3.99 1668 1274 A 50 LEU H A 49 VAL HGx% 1.0 . 3.99 1669 1275 A 50 LEU HA A 49 VAL HGy% 1.0 . 4.36 1670 1275 A 50 LEU HA A 49 VAL HGx% 1.0 . 4.36 1671 1276 A 49 VAL HGx% A 50 LEU HDy% 1.0 . 4.82 1672 1276 A 49 VAL HGy% A 50 LEU HDy% 1.0 . 4.82 1673 1276 A 50 LEU HDx% A 49 VAL HGy% 1.0 . 4.82 1674 1276 A 49 VAL HGx% A 50 LEU HDx% 1.0 . 4.82 1675 1277 A 50 LEU H A 50 LEU HBx 1.0 . 3.63 1676 1277 A 50 LEU H A 50 LEU HBy 1.0 . 3.63 1677 1278 A 50 LEU H A 50 LEU HDy% 1.0 . 4.31 1678 1278 A 50 LEU H A 50 LEU HDx% 1.0 . 4.31 1679 1279 A 50 LEU HA A 50 LEU HDy% 1.0 . 3.22 1680 1279 A 50 LEU HA A 50 LEU HDx% 1.0 . 3.22 1681 1280 A 50 LEU HBx A 50 LEU HDy% 1.0 . 2.71 1682 1280 A 50 LEU HBy A 50 LEU HDy% 1.0 . 2.71 1683 1280 A 50 LEU HDx% A 50 LEU HBx 1.0 . 2.71 1684 1280 A 50 LEU HDx% A 50 LEU HBy 1.0 . 2.71 1685 1281 A 51 SER H A 50 LEU HBx 1.0 . 3.70 1686 1281 A 51 SER H A 50 LEU HBy 1.0 . 3.70 1687 1282 A 51 SER HA A 50 LEU HBx 1.0 . 4.74 1688 1282 A 51 SER HA A 50 LEU HBy 1.0 . 4.74 1689 1283 A 51 SER HA A 54 GLU HBy 1.0 . 4.14 1690 1283 A 51 SER HA A 54 GLU HBx 1.0 . 4.14 1691 1284 A 52 TRP H A 51 SER HBx 1.0 . 3.91 1692 1284 A 52 TRP H A 51 SER HBy 1.0 . 3.91 1693 1285 A 52 TRP HZ2 A 56 GLN HE2y 1.0 . 5.22 1694 1285 A 52 TRP HZ2 A 56 GLN HE2x 1.0 . 5.22 1695 1286 A 56 GLN H A 53 ARG HGx 1.0 . 5.34 1696 1286 A 56 GLN H A 53 ARG HGy 1.0 . 5.34 1697 1287 A 56 GLN HBx A 53 ARG HGx 1.0 . 4.53 1698 1287 A 56 GLN HBx A 53 ARG HGy 1.0 . 4.53 1699 1288 A 53 ARG HGx A 57 ARG HDy 1.0 . 4.32 1700 1288 A 53 ARG HGy A 57 ARG HDy 1.0 . 4.32 1701 1288 A 57 ARG HDx A 53 ARG HGx 1.0 . 4.32 1702 1288 A 53 ARG HGy A 57 ARG HDx 1.0 . 4.32 1703 1289 A 53 ARG HDx A 57 ARG HGy 1.0 . 4.98 1704 1289 A 53 ARG HDy A 57 ARG HGy 1.0 . 4.98 1705 1289 A 57 ARG HGx A 53 ARG HDx 1.0 . 4.98 1706 1289 A 53 ARG HDy A 57 ARG HGx 1.0 . 4.98 1707 1290 A 54 GLU H A 54 GLU HBy 1.0 . 3.27 1708 1290 A 54 GLU H A 54 GLU HBx 1.0 . 3.27 1709 1291 A 54 GLU H A 54 GLU HGx 1.0 . 4.32 1710 1291 A 54 GLU H A 54 GLU HGy 1.0 . 4.32 1711 1292 A 54 GLU H A 57 ARG HGy 1.0 . 5.09 1712 1292 A 54 GLU H A 57 ARG HGx 1.0 . 5.09 1713 1293 A 54 GLU HA A 54 GLU HGx 1.0 . 3.42 1714 1293 A 54 GLU HA A 54 GLU HGy 1.0 . 3.42 1715 1294 A 54 GLU HA A 57 ARG HBx 1.0 . 4.04 1716 1294 A 54 GLU HA A 57 ARG HBy 1.0 . 4.04 1717 1295 A 54 GLU HA A 57 ARG HGy 1.0 . 4.48 1718 1295 A 54 GLU HA A 57 ARG HGx 1.0 . 4.48 1719 1296 A 54 GLU HA A 57 ARG HDy 1.0 . 3.87 1720 1296 A 54 GLU HA A 57 ARG HDx 1.0 . 3.87 1721 1297 A 55 ASP H A 54 GLU HBy 1.0 . 3.77 1722 1297 A 55 ASP H A 54 GLU HBx 1.0 . 3.77 1723 1298 A 54 GLU HBy A 90 VAL HGy% 1.0 . 5.28 1724 1298 A 54 GLU HBx A 90 VAL HGy% 1.0 . 5.28 1725 1298 A 90 VAL HGx% A 54 GLU HBy 1.0 . 5.28 1726 1298 A 54 GLU HBx A 90 VAL HGx% 1.0 . 5.28 1727 1299 A 54 GLU HGx A 90 VAL HGy% 1.0 . 4.24 1728 1299 A 54 GLU HGy A 90 VAL HGy% 1.0 . 4.24 1729 1299 A 90 VAL HGx% A 54 GLU HGx 1.0 . 4.24 1730 1299 A 54 GLU HGy A 90 VAL HGx% 1.0 . 4.24 1731 1300 A 56 GLN H A 56 GLN HE2y 1.0 . 5.16 1732 1300 A 56 GLN H A 56 GLN HE2x 1.0 . 5.16 1733 1301 A 56 GLN H A 57 ARG HDy 1.0 . 5.34 1734 1301 A 56 GLN H A 57 ARG HDx 1.0 . 5.34 1735 1302 A 56 GLN HA A 56 GLN HE2y 1.0 . 4.66 1736 1302 A 56 GLN HE2x A 56 GLN HA 1.0 . 4.66 1737 1303 A 57 ARG H A 57 ARG HBx 1.0 . 3.45 1738 1303 A 57 ARG H A 57 ARG HBy 1.0 . 3.45 1739 1304 A 57 ARG H A 57 ARG HGy 1.0 . 3.92 1740 1304 A 57 ARG H A 57 ARG HGx 1.0 . 3.92 1741 1305 A 57 ARG H A 57 ARG HDy 1.0 . 5.19 1742 1305 A 57 ARG H A 57 ARG HDx 1.0 . 5.19 1743 1306 A 57 ARG HA A 57 ARG HGy 1.0 . 3.60 1744 1306 A 57 ARG HA A 57 ARG HGx 1.0 . 3.60 1745 1307 A 58 ILE H A 57 ARG HBx 1.0 . 3.54 1746 1307 A 58 ILE H A 57 ARG HBy 1.0 . 3.54 1747 1308 A 79 VAL HA A 57 ARG HBx 1.0 . 5.06 1748 1308 A 79 VAL HA A 57 ARG HBy 1.0 . 5.06 1749 1309 A 79 VAL HGx% A 57 ARG HBx 1.0 . 4.45 1750 1309 A 79 VAL HGx% A 57 ARG HBy 1.0 . 4.45 1751 1310 A 79 VAL HGy% A 57 ARG HBx 1.0 . 4.20 1752 1310 A 79 VAL HGy% A 57 ARG HBy 1.0 . 4.20 1753 1311 A 79 VAL HGx% A 57 ARG HGy 1.0 . 4.76 1754 1311 A 79 VAL HGx% A 57 ARG HGx 1.0 . 4.76 1755 1312 A 58 ILE H A 58 ILE HG1y 1.0 . 3.42 1756 1312 A 58 ILE H A 58 ILE HG1x 1.0 . 3.42 1757 1313 A 58 ILE HG2% A 62 LYS HGx 1.0 . 4.32 1758 1313 A 58 ILE HG2% A 62 LYS HGy 1.0 . 4.32 1759 1314 A 58 ILE HG2% A 62 LYS HEy 1.0 . 3.96 1760 1314 A 58 ILE HG2% A 62 LYS HEx 1.0 . 3.96 1761 1315 A 59 SER H A 58 ILE HG1y 1.0 . 4.55 1762 1315 A 59 SER H A 58 ILE HG1x 1.0 . 4.55 1763 1316 A 58 ILE HG1y A 94 CYS HBy 1.0 . 4.56 1764 1316 A 58 ILE HG1x A 94 CYS HBy 1.0 . 4.56 1765 1316 A 94 CYS HBx A 58 ILE HG1y 1.0 . 4.56 1766 1316 A 58 ILE HG1x A 94 CYS HBx 1.0 . 4.56 1767 1317 A 59 SER HA A 62 LYS HBy 1.0 . 4.51 1768 1317 A 59 SER HA A 62 LYS HBx 1.0 . 4.51 1769 1318 A 59 SER HA A 62 LYS HEy 1.0 . 4.33 1770 1318 A 59 SER HA A 62 LYS HEx 1.0 . 4.33 1771 1319 A 60 GLN H A 60 GLN HGx 1.0 . 4.52 1772 1319 A 60 GLN H A 60 GLN HGy 1.0 . 4.52 1773 1320 A 60 GLN HA A 60 GLN HGx 1.0 . 3.63 1774 1320 A 60 GLN HA A 60 GLN HGy 1.0 . 3.63 1775 1321 A 60 GLN HA A 60 GLN HE2x 1.0 . 5.01 1776 1321 A 60 GLN HA A 60 GLN HE2y 1.0 . 5.01 1777 1322 A 60 GLN HA A 63 LEU HBx 1.0 . 3.69 1778 1322 A 60 GLN HA A 63 LEU HBy 1.0 . 3.69 1779 1323 A 60 GLN HA A 63 LEU HDy% 1.0 . 4.39 1780 1323 A 60 GLN HA A 63 LEU HDx% 1.0 . 4.39 1781 1324 A 61 ALA HA A 60 GLN HGx 1.0 . 5.34 1782 1324 A 61 ALA HA A 60 GLN HGy 1.0 . 5.34 1783 1325 A 60 GLN HGx A 64 LEU HDy% 1.0 . 4.28 1784 1325 A 64 LEU HDx% A 60 GLN HGx 1.0 . 4.28 1785 1325 A 60 GLN HGy A 64 LEU HDx% 1.0 . 4.28 1786 1325 A 60 GLN HGy A 64 LEU HDy% 1.0 . 4.28 1787 1326 A 79 VAL HGx% A 60 GLN HGx 1.0 . 4.33 1788 1326 A 79 VAL HGx% A 60 GLN HGy 1.0 . 4.33 1789 1327 A 63 LEU H A 60 GLN HE2x 1.0 . 5.34 1790 1327 A 63 LEU H A 60 GLN HE2y 1.0 . 5.34 1791 1328 A 60 GLN HE2x A 63 LEU HBx 1.0 . 5.18 1792 1328 A 60 GLN HE2y A 63 LEU HBx 1.0 . 5.18 1793 1328 A 63 LEU HBy A 60 GLN HE2x 1.0 . 5.18 1794 1328 A 60 GLN HE2y A 63 LEU HBy 1.0 . 5.18 1795 1329 A 60 GLN HE2y A 63 LEU HDy% 1.0 . 4.35 1796 1329 A 60 GLN HE2x A 63 LEU HDy% 1.0 . 4.35 1797 1329 A 63 LEU HDx% A 60 GLN HE2x 1.0 . 4.35 1798 1329 A 60 GLN HE2y A 63 LEU HDx% 1.0 . 4.35 1799 1330 A 64 LEU HG A 60 GLN HE2x 1.0 . 4.57 1800 1330 A 64 LEU HG A 60 GLN HE2y 1.0 . 4.57 1801 1331 A 60 GLN HE2y A 64 LEU HDy% 1.0 . 4.05 1802 1331 A 64 LEU HDx% A 60 GLN HE2x 1.0 . 4.05 1803 1331 A 60 GLN HE2y A 64 LEU HDx% 1.0 . 4.05 1804 1331 A 60 GLN HE2x A 64 LEU HDy% 1.0 . 4.05 1805 1332 A 61 ALA HA A 64 LEU HBx 1.0 . 4.63 1806 1332 A 61 ALA HA A 64 LEU HBy 1.0 . 4.63 1807 1333 A 61 ALA HA A 64 LEU HDy% 1.0 . 3.52 1808 1333 A 61 ALA HA A 64 LEU HDx% 1.0 . 3.52 1809 1334 A 61 ALA HB% A 65 LEU HDy% 1.0 . 4.99 1810 1334 A 61 ALA HB% A 65 LEU HDx% 1.0 . 4.99 1811 1335 A 62 LYS H A 62 LYS HBy 1.0 . 3.52 1812 1335 A 62 LYS H A 62 LYS HBx 1.0 . 3.52 1813 1336 A 62 LYS H A 62 LYS HGx 1.0 . 3.72 1814 1336 A 62 LYS H A 62 LYS HGy 1.0 . 3.72 1815 1337 A 62 LYS HA A 65 LEU HBx 1.0 . 4.24 1816 1337 A 62 LYS HA A 65 LEU HBy 1.0 . 4.24 1817 1338 A 62 LYS HA A 65 LEU HDy% 1.0 . 4.08 1818 1338 A 62 LYS HA A 65 LEU HDx% 1.0 . 4.08 1819 1339 A 95 THR HG2% A 62 LYS HEy 1.0 . 3.85 1820 1339 A 95 THR HG2% A 62 LYS HEx 1.0 . 3.85 1821 1340 A 63 LEU H A 63 LEU HBx 1.0 . 2.89 1822 1340 A 63 LEU H A 63 LEU HBy 1.0 . 2.89 1823 1341 A 63 LEU H A 63 LEU HDy% 1.0 . 4.40 1824 1341 A 63 LEU H A 63 LEU HDx% 1.0 . 4.40 1825 1342 A 63 LEU HA A 63 LEU HDy% 1.0 . 3.25 1826 1342 A 63 LEU HA A 63 LEU HDx% 1.0 . 3.25 1827 1343 A 64 LEU H A 63 LEU HBx 1.0 . 4.17 1828 1343 A 64 LEU H A 63 LEU HBy 1.0 . 4.17 1829 1344 A 67 THR HG2% A 63 LEU HBx 1.0 . 5.06 1830 1344 A 67 THR HG2% A 63 LEU HBy 1.0 . 5.06 1831 1345 A 67 THR HG2% A 63 LEU HDy% 1.0 . 3.32 1832 1345 A 67 THR HG2% A 63 LEU HDx% 1.0 . 3.32 1833 1346 A 64 LEU H A 64 LEU HDy% 1.0 . 4.28 1834 1346 A 64 LEU H A 64 LEU HDx% 1.0 . 4.28 1835 1347 A 64 LEU HA A 64 LEU HDy% 1.0 . 3.37 1836 1347 A 64 LEU HA A 64 LEU HDx% 1.0 . 3.37 1837 1348 A 65 LEU H A 64 LEU HBx 1.0 . 4.05 1838 1348 A 65 LEU H A 64 LEU HBy 1.0 . 4.05 1839 1349 A 75 VAL HGx% A 64 LEU HBx 1.0 . 4.39 1840 1349 A 75 VAL HGx% A 64 LEU HBy 1.0 . 4.39 1841 1350 A 65 LEU H A 64 LEU HDy% 1.0 . 4.72 1842 1350 A 65 LEU H A 64 LEU HDx% 1.0 . 4.72 1843 1351 A 66 SER H A 64 LEU HDy% 1.0 . 5.44 1844 1351 A 66 SER H A 64 LEU HDx% 1.0 . 5.44 1845 1352 A 67 THR HG2% A 64 LEU HDy% 1.0 . 4.11 1846 1352 A 67 THR HG2% A 64 LEU HDx% 1.0 . 4.11 1847 1353 A 68 THR H A 64 LEU HDy% 1.0 . 5.44 1848 1353 A 68 THR H A 64 LEU HDx% 1.0 . 5.44 1849 1354 A 68 THR HG2% A 64 LEU HDy% 1.0 . 3.28 1850 1354 A 68 THR HG2% A 64 LEU HDx% 1.0 . 3.28 1851 1355 A 70 MET HE% A 64 LEU HDy% 1.0 . 4.08 1852 1355 A 70 MET HE% A 64 LEU HDx% 1.0 . 4.08 1853 1356 A 75 VAL HA A 64 LEU HDy% 1.0 . 4.78 1854 1356 A 75 VAL HA A 64 LEU HDx% 1.0 . 4.78 1855 1357 A 78 ASN H A 64 LEU HDy% 1.0 . 5.44 1856 1357 A 78 ASN H A 64 LEU HDx% 1.0 . 5.44 1857 1358 A 64 LEU HDy% A 78 ASN HBy 1.0 . 3.56 1858 1358 A 64 LEU HDx% A 78 ASN HBy 1.0 . 3.56 1859 1358 A 78 ASN HBx A 64 LEU HDy% 1.0 . 3.56 1860 1358 A 64 LEU HDx% A 78 ASN HBx 1.0 . 3.56 1861 1359 A 78 ASN HD2x A 64 LEU HDx% 1.0 . 4.66 1862 1359 A 78 ASN HD2y A 64 LEU HDx% 1.0 . 4.66 1863 1359 A 78 ASN HD2y A 64 LEU HDy% 1.0 . 4.66 1864 1359 A 78 ASN HD2x A 64 LEU HDy% 1.0 . 4.66 1865 1360 A 65 LEU H A 65 LEU HBx 1.0 . 3.64 1866 1360 A 65 LEU H A 65 LEU HBy 1.0 . 3.64 1867 1361 A 65 LEU H A 65 LEU HDy% 1.0 . 4.46 1868 1361 A 65 LEU H A 65 LEU HDx% 1.0 . 4.46 1869 1362 A 65 LEU HA A 65 LEU HDy% 1.0 . 3.29 1870 1362 A 65 LEU HA A 65 LEU HDx% 1.0 . 3.29 1871 1363 A 66 SER H A 65 LEU HBx 1.0 . 4.32 1872 1363 A 66 SER H A 65 LEU HBy 1.0 . 4.32 1873 1364 A 75 VAL HGx% A 65 LEU HBx 1.0 . 4.43 1874 1364 A 75 VAL HGx% A 65 LEU HBy 1.0 . 4.43 1875 1365 A 75 VAL HGy% A 65 LEU HBx 1.0 . 4.03 1876 1365 A 75 VAL HGy% A 65 LEU HBy 1.0 . 4.03 1877 1366 A 66 SER H A 65 LEU HDy% 1.0 . 5.44 1878 1366 A 66 SER H A 65 LEU HDx% 1.0 . 5.44 1879 1367 A 68 THR H A 65 LEU HDy% 1.0 . 5.44 1880 1367 A 68 THR H A 65 LEU HDx% 1.0 . 5.44 1881 1368 A 72 ILE HA A 65 LEU HDy% 1.0 . 4.45 1882 1368 A 72 ILE HA A 65 LEU HDx% 1.0 . 4.45 1883 1369 A 72 ILE HG2% A 65 LEU HDy% 1.0 . 4.39 1884 1369 A 72 ILE HG2% A 65 LEU HDx% 1.0 . 4.39 1885 1370 A 75 VAL HA A 65 LEU HDy% 1.0 . 5.44 1886 1370 A 75 VAL HA A 65 LEU HDx% 1.0 . 5.44 1887 1371 A 75 VAL HGx% A 65 LEU HDy% 1.0 . 4.01 1888 1371 A 75 VAL HGx% A 65 LEU HDx% 1.0 . 4.01 1889 1372 A 87 PHE HZ A 65 LEU HDy% 1.0 . 4.10 1890 1372 A 87 PHE HZ A 65 LEU HDx% 1.0 . 4.10 1891 1373 A 99 PRO HA A 65 LEU HDy% 1.0 . 4.69 1892 1373 A 99 PRO HA A 65 LEU HDx% 1.0 . 4.69 1893 1374 A 99 PRO HBx A 65 LEU HDy% 1.0 . 4.10 1894 1374 A 99 PRO HBx A 65 LEU HDx% 1.0 . 4.10 1895 1375 A 99 PRO HBy A 65 LEU HDy% 1.0 . 4.05 1896 1375 A 99 PRO HBy A 65 LEU HDx% 1.0 . 4.05 1897 1376 A 102 PHE HBy A 65 LEU HDy% 1.0 . 5.44 1898 1376 A 102 PHE HBy A 65 LEU HDx% 1.0 . 5.44 1899 1377 A 65 LEU HDy% A 103 ARG HDy 1.0 . 4.13 1900 1377 A 65 LEU HDx% A 103 ARG HDy 1.0 . 4.13 1901 1377 A 103 ARG HDx A 65 LEU HDy% 1.0 . 4.13 1902 1377 A 65 LEU HDx% A 103 ARG HDx 1.0 . 4.13 1903 1378 A 66 SER H A 66 SER HBx 1.0 . 3.62 1904 1378 A 66 SER H A 66 SER HBy 1.0 . 3.62 1905 1379 A 67 THR HA A 66 SER HBx 1.0 . 5.06 1906 1379 A 67 THR HA A 66 SER HBy 1.0 . 5.06 1907 1380 A 67 THR HG2% A 66 SER HBx 1.0 . 4.71 1908 1380 A 67 THR HG2% A 66 SER HBy 1.0 . 4.71 1909 1381 A 69 ARG H A 69 ARG HGx 1.0 . 4.55 1910 1381 A 69 ARG H A 69 ARG HGy 1.0 . 4.55 1911 1382 A 69 ARG HA A 69 ARG HGx 1.0 . 3.67 1912 1382 A 69 ARG HA A 69 ARG HGy 1.0 . 3.67 1913 1383 A 69 ARG HBx A 69 ARG HDx 1.0 . 3.55 1914 1383 A 69 ARG HBy A 69 ARG HDx 1.0 . 3.55 1915 1383 A 69 ARG HDy A 69 ARG HBx 1.0 . 3.55 1916 1383 A 69 ARG HDy A 69 ARG HBy 1.0 . 3.55 1917 1384 A 70 MET H A 69 ARG HGx 1.0 . 5.34 1918 1384 A 70 MET H A 69 ARG HGy 1.0 . 5.34 1919 1385 A 74 THR H A 71 PRO HGx 1.0 . 4.47 1920 1385 A 74 THR H A 71 PRO HGy 1.0 . 4.47 1921 1386 A 72 ILE H A 72 ILE HG1y 1.0 . 3.32 1922 1386 A 72 ILE H A 72 ILE HG1x 1.0 . 3.32 1923 1387 A 72 ILE HB A 84 GLN HGy 1.0 . 5.34 1924 1387 A 72 ILE HB A 84 GLN HGx 1.0 . 5.34 1925 1388 A 72 ILE HG2% A 72 ILE HG1y 1.0 . 3.36 1926 1388 A 72 ILE HG2% A 72 ILE HG1x 1.0 . 3.36 1927 1389 A 72 ILE HG2% A 84 GLN HBy 1.0 . 4.87 1928 1389 A 72 ILE HG2% A 84 GLN HBx 1.0 . 4.87 1929 1390 A 72 ILE HG2% A 84 GLN HGy 1.0 . 4.40 1930 1390 A 72 ILE HG2% A 84 GLN HGx 1.0 . 4.40 1931 1391 A 72 ILE HG2% A 84 GLN HE2x 1.0 . 5.29 1932 1391 A 72 ILE HG2% A 84 GLN HE2y 1.0 . 5.29 1933 1392 A 72 ILE HG2% A 99 PRO HGx 1.0 . 3.94 1934 1392 A 72 ILE HG2% A 99 PRO HGy 1.0 . 3.94 1935 1393 A 99 PRO HBx A 72 ILE HG1y 1.0 . 4.72 1936 1393 A 99 PRO HBx A 72 ILE HG1x 1.0 . 4.72 1937 1394 A 72 ILE HD1% A 84 GLN HBy 1.0 . 5.34 1938 1394 A 72 ILE HD1% A 84 GLN HBx 1.0 . 5.34 1939 1395 A 72 ILE HD1% A 99 PRO HGx 1.0 . 4.18 1940 1395 A 72 ILE HD1% A 99 PRO HGy 1.0 . 4.18 1941 1396 A 73 ALA HA A 84 GLN HBy 1.0 . 3.76 1942 1396 A 73 ALA HA A 84 GLN HBx 1.0 . 3.76 1943 1397 A 73 ALA HA A 84 GLN HGy 1.0 . 4.62 1944 1397 A 73 ALA HA A 84 GLN HGx 1.0 . 4.62 1945 1398 A 73 ALA HB% A 84 GLN HGy 1.0 . 4.28 1946 1398 A 73 ALA HB% A 84 GLN HGx 1.0 . 4.28 1947 1399 A 73 ALA HB% A 84 GLN HE2x 1.0 . 4.67 1948 1399 A 73 ALA HB% A 84 GLN HE2y 1.0 . 4.67 1949 1400 A 75 VAL HA A 78 ASN HBy 1.0 . 3.83 1950 1400 A 75 VAL HA A 78 ASN HBx 1.0 . 3.83 1951 1401 A 75 VAL HGx% A 78 ASN HBy 1.0 . 4.79 1952 1401 A 75 VAL HGx% A 78 ASN HBx 1.0 . 4.79 1953 1402 A 75 VAL HGx% A 78 ASN HD2x 1.0 . 5.34 1954 1402 A 75 VAL HGx% A 78 ASN HD2y 1.0 . 5.34 1955 1403 A 79 VAL HGy% A 76 GLY HAy 1.0 . 3.60 1956 1403 A 79 VAL HGy% A 76 GLY HAx 1.0 . 3.60 1957 1404 A 81 PHE HBx A 76 GLY HAy 1.0 . 4.04 1958 1404 A 81 PHE HBx A 76 GLY HAx 1.0 . 4.04 1959 1405 A 81 PHE HD% A 76 GLY HAy 1.0 . 4.07 1960 1405 A 81 PHE HD% A 76 GLY HAx 1.0 . 4.07 1961 1406 A 77 ARG H A 77 ARG HGy 1.0 . 4.49 1962 1406 A 77 ARG H A 77 ARG HGx 1.0 . 4.49 1963 1407 A 77 ARG HA A 77 ARG HGy 1.0 . 3.56 1964 1407 A 77 ARG HA A 77 ARG HGx 1.0 . 3.56 1965 1408 A 77 ARG HA A 77 ARG HDy 1.0 . 4.83 1966 1408 A 77 ARG HA A 77 ARG HDx 1.0 . 4.83 1967 1409 A 78 ASN H A 78 ASN HBy 1.0 . 3.16 1968 1409 A 78 ASN H A 78 ASN HBx 1.0 . 3.16 1969 1410 A 78 ASN H A 78 ASN HD2y 1.0 . 4.89 1970 1410 A 78 ASN H A 78 ASN HD2x 1.0 . 4.89 1971 1411 A 79 VAL HGx% A 78 ASN HBy 1.0 . 4.29 1972 1411 A 79 VAL HGx% A 78 ASN HBx 1.0 . 4.29 1973 1412 A 81 PHE HBx A 87 PHE HBx 1.0 . 4.80 1974 1412 A 81 PHE HBx A 87 PHE HBy 1.0 . 4.80 1975 1413 A 81 PHE HBy A 87 PHE HBx 1.0 . 4.85 1976 1413 A 81 PHE HBy A 87 PHE HBy 1.0 . 4.85 1977 1414 A 81 PHE HD% A 87 PHE HBx 1.0 . 4.02 1978 1414 A 81 PHE HD% A 87 PHE HBy 1.0 . 4.02 1979 1415 A 83 ASP H A 83 ASP HBx 1.0 . 3.26 1980 1415 A 83 ASP H A 83 ASP HBy 1.0 . 3.26 1981 1416 A 83 ASP H A 86 TYR HBy 1.0 . 4.56 1982 1416 A 83 ASP H A 86 TYR HBx 1.0 . 4.56 1983 1417 A 85 LEU H A 83 ASP HBx 1.0 . 4.88 1984 1417 A 85 LEU H A 83 ASP HBy 1.0 . 4.88 1985 1418 A 86 TYR H A 83 ASP HBx 1.0 . 4.06 1986 1418 A 86 TYR H A 83 ASP HBy 1.0 . 4.06 1987 1419 A 83 ASP HBx A 86 TYR HBy 1.0 . 4.60 1988 1419 A 83 ASP HBy A 86 TYR HBy 1.0 . 4.60 1989 1419 A 86 TYR HBx A 83 ASP HBx 1.0 . 4.60 1990 1419 A 83 ASP HBy A 86 TYR HBx 1.0 . 4.60 1991 1420 A 84 GLN H A 84 GLN HGy 1.0 . 4.40 1992 1420 A 84 GLN H A 84 GLN HGx 1.0 . 4.40 1993 1421 A 84 GLN HA A 87 PHE HBx 1.0 . 3.56 1994 1421 A 84 GLN HA A 87 PHE HBy 1.0 . 3.56 1995 1422 A 85 LEU H A 84 GLN HBy 1.0 . 3.88 1996 1422 A 85 LEU H A 84 GLN HBx 1.0 . 3.88 1997 1423 A 84 GLN HE2x A 84 GLN HGy 1.0 . 3.17 1998 1423 A 84 GLN HE2y A 84 GLN HGy 1.0 . 3.17 1999 1423 A 84 GLN HGx A 84 GLN HE2x 1.0 . 3.17 2000 1423 A 84 GLN HGx A 84 GLN HE2y 1.0 . 3.17 2001 1424 A 85 LEU H A 84 GLN HGy 1.0 . 4.35 2002 1424 A 85 LEU H A 84 GLN HGx 1.0 . 4.35 2003 1425 A 84 GLN HGy A 85 LEU HDy% 1.0 . 4.77 2004 1425 A 84 GLN HGx A 85 LEU HDy% 1.0 . 4.77 2005 1425 A 85 LEU HDx% A 84 GLN HGy 1.0 . 4.77 2006 1425 A 84 GLN HGx A 85 LEU HDx% 1.0 . 4.77 2007 1426 A 84 GLN HE2y A 85 LEU HDy% 1.0 . 4.49 2008 1426 A 84 GLN HE2x A 85 LEU HDy% 1.0 . 4.49 2009 1426 A 85 LEU HDx% A 84 GLN HE2x 1.0 . 4.49 2010 1426 A 84 GLN HE2y A 85 LEU HDx% 1.0 . 4.49 2011 1427 A 85 LEU H A 85 LEU HDy% 1.0 . 4.42 2012 1427 A 85 LEU H A 85 LEU HDx% 1.0 . 4.42 2013 1428 A 85 LEU H A 86 TYR HBy 1.0 . 4.72 2014 1428 A 85 LEU H A 86 TYR HBx 1.0 . 4.72 2015 1429 A 85 LEU HA A 85 LEU HDy% 1.0 . 3.23 2016 1429 A 85 LEU HA A 85 LEU HDx% 1.0 . 3.23 2017 1430 A 85 LEU HA A 88 SER HBx 1.0 . 4.93 2018 1430 A 85 LEU HA A 88 SER HBy 1.0 . 4.93 2019 1431 A 85 LEU HA A 89 ARG HGy 1.0 . 4.95 2020 1431 A 85 LEU HA A 89 ARG HGx 1.0 . 4.95 2021 1432 A 85 LEU HBx A 86 TYR HBy 1.0 . 4.84 2022 1432 A 85 LEU HBx A 86 TYR HBx 1.0 . 4.84 2023 1433 A 85 LEU HBy A 89 ARG HGy 1.0 . 4.24 2024 1433 A 85 LEU HBy A 89 ARG HGx 1.0 . 4.24 2025 1434 A 85 LEU HBy A 89 ARG HDy 1.0 . 4.77 2026 1434 A 85 LEU HBy A 89 ARG HDx 1.0 . 4.77 2027 1435 A 86 TYR H A 86 TYR HBy 1.0 . 2.99 2028 1435 A 86 TYR H A 86 TYR HBx 1.0 . 2.99 2029 1436 A 89 ARG HBx A 86 TYR HBy 1.0 . 5.34 2030 1436 A 89 ARG HBx A 86 TYR HBx 1.0 . 5.34 2031 1437 A 86 TYR HD% A 90 VAL HGy% 1.0 . 3.51 2032 1437 A 86 TYR HD% A 90 VAL HGx% 1.0 . 3.51 2033 1438 A 86 TYR HE% A 90 VAL HGy% 1.0 . 3.24 2034 1438 A 86 TYR HE% A 90 VAL HGx% 1.0 . 3.24 2035 1439 A 87 PHE H A 87 PHE HBx 1.0 . 3.11 2036 1439 A 87 PHE H A 87 PHE HBy 1.0 . 3.11 2037 1440 A 87 PHE HA A 90 VAL HGy% 1.0 . 4.22 2038 1440 A 87 PHE HA A 90 VAL HGx% 1.0 . 4.22 2039 1441 A 88 SER H A 87 PHE HBx 1.0 . 3.44 2040 1441 A 88 SER H A 87 PHE HBy 1.0 . 3.44 2041 1442 A 87 PHE HD% A 91 PHE HBx 1.0 . 3.83 2042 1442 A 87 PHE HD% A 91 PHE HBy 1.0 . 3.83 2043 1443 A 87 PHE HD% A 99 PRO HGx 1.0 . 4.15 2044 1443 A 87 PHE HD% A 99 PRO HGy 1.0 . 4.15 2045 1444 A 87 PHE HE% A 91 PHE HBx 1.0 . 3.70 2046 1444 A 87 PHE HE% A 91 PHE HBy 1.0 . 3.70 2047 1445 A 87 PHE HZ A 91 PHE HBx 1.0 . 4.28 2048 1445 A 87 PHE HZ A 91 PHE HBy 1.0 . 4.28 2049 1446 A 88 SER H A 88 SER HBx 1.0 . 3.39 2050 1446 A 88 SER H A 88 SER HBy 1.0 . 3.39 2051 1447 A 88 SER HA A 91 PHE HBx 1.0 . 4.88 2052 1447 A 88 SER HA A 91 PHE HBy 1.0 . 4.88 2053 1448 A 88 SER HA A 99 PRO HGx 1.0 . 4.21 2054 1448 A 88 SER HA A 99 PRO HGy 1.0 . 4.21 2055 1449 A 89 ARG H A 88 SER HBx 1.0 . 4.15 2056 1449 A 89 ARG H A 88 SER HBy 1.0 . 4.15 2057 1450 A 88 SER HBy A 99 PRO HGx 1.0 . 4.44 2058 1450 A 88 SER HBx A 99 PRO HGx 1.0 . 4.44 2059 1450 A 99 PRO HGy A 88 SER HBx 1.0 . 4.44 2060 1450 A 99 PRO HGy A 88 SER HBy 1.0 . 4.44 2061 1451 A 88 SER HBx A 99 PRO HDy 1.0 . 4.33 2062 1451 A 88 SER HBy A 99 PRO HDy 1.0 . 4.33 2063 1451 A 99 PRO HDx A 88 SER HBx 1.0 . 4.33 2064 1451 A 88 SER HBy A 99 PRO HDx 1.0 . 4.33 2065 1452 A 89 ARG H A 89 ARG HGy 1.0 . 3.86 2066 1452 A 89 ARG H A 89 ARG HGx 1.0 . 3.86 2067 1453 A 89 ARG H A 89 ARG HDy 1.0 . 4.66 2068 1453 A 89 ARG H A 89 ARG HDx 1.0 . 4.66 2069 1454 A 89 ARG HA A 89 ARG HGy 1.0 . 3.71 2070 1454 A 89 ARG HA A 89 ARG HGx 1.0 . 3.71 2071 1455 A 89 ARG HA A 92 LYS HGx 1.0 . 5.34 2072 1455 A 89 ARG HA A 92 LYS HGy 1.0 . 5.34 2073 1456 A 89 ARG HA A 92 LYS HEx 1.0 . 5.34 2074 1456 A 89 ARG HA A 92 LYS HEy 1.0 . 5.34 2075 1457 A 89 ARG HBx A 90 VAL HGy% 1.0 . 4.89 2076 1457 A 89 ARG HBx A 90 VAL HGx% 1.0 . 4.89 2077 1458 A 89 ARG HBy A 89 ARG HDy 1.0 . 3.64 2078 1458 A 89 ARG HBy A 89 ARG HDx 1.0 . 3.64 2079 1459 A 89 ARG HBy A 90 VAL HGy% 1.0 . 4.97 2080 1459 A 89 ARG HBy A 90 VAL HGx% 1.0 . 4.97 2081 1460 A 90 VAL H A 90 VAL HGy% 1.0 . 3.18 2082 1460 A 90 VAL H A 90 VAL HGx% 1.0 . 3.18 2083 1461 A 90 VAL HA A 90 VAL HGy% 1.0 . 3.04 2084 1461 A 90 VAL HA A 90 VAL HGx% 1.0 . 3.04 2085 1462 A 90 VAL HA A 93 LYS HBy 1.0 . 3.77 2086 1462 A 90 VAL HA A 93 LYS HBx 1.0 . 3.77 2087 1463 A 90 VAL HA A 93 LYS HGx 1.0 . 4.98 2088 1463 A 90 VAL HA A 93 LYS HGy 1.0 . 4.98 2089 1464 A 90 VAL HA A 93 LYS HEx 1.0 . 4.56 2090 1464 A 90 VAL HA A 93 LYS HEy 1.0 . 4.56 2091 1465 A 90 VAL HGy% A 93 LYS HBy 1.0 . 4.57 2092 1465 A 90 VAL HGx% A 93 LYS HBy 1.0 . 4.57 2093 1465 A 93 LYS HBx A 90 VAL HGy% 1.0 . 4.57 2094 1465 A 90 VAL HGx% A 93 LYS HBx 1.0 . 4.57 2095 1466 A 90 VAL HGx% A 93 LYS HEx 1.0 . 4.41 2096 1466 A 90 VAL HGy% A 93 LYS HEx 1.0 . 4.41 2097 1466 A 93 LYS HEy A 90 VAL HGy% 1.0 . 4.41 2098 1466 A 90 VAL HGx% A 93 LYS HEy 1.0 . 4.41 2099 1467 A 91 PHE H A 91 PHE HBx 1.0 . 3.12 2100 1467 A 91 PHE H A 91 PHE HBy 1.0 . 3.12 2101 1468 A 91 PHE HA A 94 CYS HBy 1.0 . 4.54 2102 1468 A 91 PHE HA A 94 CYS HBx 1.0 . 4.54 2103 1469 A 92 LYS H A 91 PHE HBx 1.0 . 3.69 2104 1469 A 92 LYS H A 91 PHE HBy 1.0 . 3.69 2105 1470 A 92 LYS HBx A 99 PRO HDy 1.0 . 5.05 2106 1470 A 92 LYS HBx A 99 PRO HDx 1.0 . 5.05 2107 1471 A 92 LYS HBy A 92 LYS HEx 1.0 . 4.56 2108 1471 A 92 LYS HBy A 92 LYS HEy 1.0 . 4.56 2109 1472 A 92 LYS HBy A 93 LYS HDx 1.0 . 4.95 2110 1472 A 92 LYS HBy A 93 LYS HDy 1.0 . 4.95 2111 1473 A 92 LYS HEx A 92 LYS HGx 1.0 . 3.16 2112 1473 A 92 LYS HEy A 92 LYS HGx 1.0 . 3.16 2113 1473 A 92 LYS HGy A 92 LYS HEx 1.0 . 3.16 2114 1473 A 92 LYS HGy A 92 LYS HEy 1.0 . 3.16 2115 1474 A 93 LYS HA A 92 LYS HGx 1.0 . 5.34 2116 1474 A 92 LYS HGy A 93 LYS HA 1.0 . 5.34 2117 1475 A 93 LYS HA A 92 LYS HEx 1.0 . 5.34 2118 1475 A 92 LYS HEy A 93 LYS HA 1.0 . 5.34 2119 1476 A 96 GLY HAx A 92 LYS HEx 1.0 . 5.34 2120 1476 A 92 LYS HEy A 96 GLY HAx 1.0 . 5.34 2121 1477 A 97 ALA HA A 92 LYS HEx 1.0 . 4.98 2122 1477 A 97 ALA HA A 92 LYS HEy 1.0 . 4.98 2123 1478 A 93 LYS H A 93 LYS HBy 1.0 . 3.19 2124 1478 A 93 LYS H A 93 LYS HBx 1.0 . 3.19 2125 1479 A 93 LYS H A 93 LYS HGx 1.0 . 5.34 2126 1479 A 93 LYS H A 93 LYS HGy 1.0 . 5.34 2127 1480 A 93 LYS H A 93 LYS HDx 1.0 . 4.23 2128 1480 A 93 LYS H A 93 LYS HDy 1.0 . 4.23 2129 1481 A 93 LYS HA A 93 LYS HGx 1.0 . 3.70 2130 1481 A 93 LYS HGy A 93 LYS HA 1.0 . 3.70 2131 1482 A 93 LYS HBy A 93 LYS HEx 1.0 . 3.71 2132 1482 A 93 LYS HBx A 93 LYS HEx 1.0 . 3.71 2133 1482 A 93 LYS HEy A 93 LYS HBy 1.0 . 3.71 2134 1482 A 93 LYS HBx A 93 LYS HEy 1.0 . 3.71 2135 1483 A 94 CYS H A 93 LYS HBy 1.0 . 3.52 2136 1483 A 94 CYS H A 93 LYS HBx 1.0 . 3.52 2137 1484 A 93 LYS HEy A 93 LYS HGx 1.0 . 3.23 2138 1484 A 93 LYS HEx A 93 LYS HGx 1.0 . 3.23 2139 1484 A 93 LYS HGy A 93 LYS HEx 1.0 . 3.23 2140 1484 A 93 LYS HGy A 93 LYS HEy 1.0 . 3.23 2141 1485 A 94 CYS H A 94 CYS HBy 1.0 . 3.18 2142 1485 A 94 CYS H A 94 CYS HBx 1.0 . 3.18 2143 1486 A 95 THR H A 94 CYS HBy 1.0 . 3.77 2144 1486 A 95 THR H A 94 CYS HBx 1.0 . 3.77 2145 1487 A 97 ALA HA A 101 GLU HBx 1.0 . 4.72 2146 1487 A 97 ALA HA A 101 GLU HBy 1.0 . 4.72 2147 1488 A 97 ALA HB% A 101 GLU HBx 1.0 . 3.52 2148 1488 A 97 ALA HB% A 101 GLU HBy 1.0 . 3.52 2149 1489 A 97 ALA HB% A 101 GLU HGx 1.0 . 4.07 2150 1489 A 97 ALA HB% A 101 GLU HGy 1.0 . 4.07 2151 1490 A 98 SER H A 101 GLU HBx 1.0 . 3.49 2152 1490 A 98 SER H A 101 GLU HBy 1.0 . 3.49 2153 1491 A 98 SER HA A 99 PRO HDy 1.0 . 3.33 2154 1491 A 98 SER HA A 99 PRO HDx 1.0 . 3.33 2155 1492 A 100 SER H A 99 PRO HGx 1.0 . 4.13 2156 1492 A 100 SER H A 99 PRO HGy 1.0 . 4.13 2157 1493 A 100 SER H A 101 GLU HBx 1.0 . 4.88 2158 1493 A 100 SER H A 101 GLU HBy 1.0 . 4.88 2159 1494 A 101 GLU H A 101 GLU HBx 1.0 . 3.02 2160 1494 A 101 GLU H A 101 GLU HBy 1.0 . 3.02 2161 1495 A 102 PHE H A 101 GLU HBx 1.0 . 3.67 2162 1495 A 102 PHE H A 101 GLU HBy 1.0 . 3.67 2163 1496 A 102 PHE HA A 101 GLU HBx 1.0 . 5.34 2164 1496 A 102 PHE HA A 101 GLU HBy 1.0 . 5.34 2165 1497 A 102 PHE HA A 101 GLU HGx 1.0 . 5.34 2166 1497 A 102 PHE HA A 101 GLU HGy 1.0 . 5.34 2167 1498 A 104 ALA HB% A 101 GLU HGx 1.0 . 5.10 2168 1498 A 104 ALA HB% A 101 GLU HGy 1.0 . 5.10 2169 1499 A 103 ARG HA A 103 ARG HGx 1.0 . 3.67 2170 1499 A 103 ARG HA A 103 ARG HGy 1.0 . 3.67 2171 1500 A 103 ARG HBx A 103 ARG HDy 1.0 . 3.60 2172 1500 A 103 ARG HBy A 103 ARG HDy 1.0 . 3.60 2173 1500 A 103 ARG HDx A 103 ARG HBx 1.0 . 3.60 2174 1500 A 103 ARG HBy A 103 ARG HDx 1.0 . 3.60 2175 1501 A 104 ALA HA A 106 CYS HBy 1.0 . 5.26 2176 1501 A 104 ALA HA A 106 CYS HBx 1.0 . 5.26 2177 1502 A 106 CYS HA A 105 GLY HAx 1.0 . 4.49 2178 1502 A 105 GLY HAy A 106 CYS HA 1.0 . 4.49 2179 1503 A 106 CYS H A 106 CYS HBy 1.0 . 3.31 2180 1503 A 106 CYS H A 106 CYS HBx 1.0 . 3.31 2181 1504 A 107 GLU H A 106 CYS HBy 1.0 . 4.26 2182 1504 A 107 GLU H A 106 CYS HBx 1.0 . 4.26 2183 1505 A 107 GLU H A 107 GLU HBx 1.0 . 3.47 2184 1505 A 107 GLU H A 107 GLU HBy 1.0 . 3.47 2185 1506 A 107 GLU H A 107 GLU HGx 1.0 . 4.41 2186 1506 A 107 GLU H A 107 GLU HGy 1.0 . 4.41 2187 1507 A 107 GLU HA A 107 GLU HGx 1.0 . 3.69 2188 1507 A 107 GLU HGy A 107 GLU HA 1.0 . 3.69 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_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 2 ASP N A 2 ASP CA A 2 ASP C A 3 ASN N 1.0 93.3 148.2 PSI 2 2 A 1 MET C A 2 ASP N A 2 ASP CA A 2 ASP C 1.0 -121.2 -78.8 PHI 3 3 A 3 ASN N A 3 ASN CA A 3 ASN C A 4 ARG N 1.0 -45.5 -22.7 PSI 4 4 A 2 ASP C A 3 ASN N A 3 ASN CA A 3 ASN C 1.0 -64.5 -54.1 PHI 5 5 A 4 ARG N A 4 ARG CA A 4 ARG C A 5 VAL N 1.0 -48.7 -34.6 PSI 6 6 A 3 ASN C A 4 ARG N A 4 ARG CA A 4 ARG C 1.0 -70.6 -55.8 PHI 7 7 A 5 VAL N A 5 VAL CA A 5 VAL C A 6 ARG N 1.0 -50.2 -38.7 PSI 8 8 A 4 ARG C A 5 VAL N A 5 VAL CA A 5 VAL C 1.0 -69.0 -57.5 PHI 9 9 A 6 ARG N A 6 ARG CA A 6 ARG C A 7 GLU N 1.0 -45.7 -34.9 PSI 10 10 A 5 VAL C A 6 ARG N A 6 ARG CA A 6 ARG C 1.0 -68.5 -55.0 PHI 11 11 A 7 GLU N A 7 GLU CA A 7 GLU C A 8 ALA N 1.0 -48.4 -34.2 PSI 12 12 A 6 ARG C A 7 GLU N A 7 GLU CA A 7 GLU C 1.0 -71.0 -62.4 PHI 13 13 A 8 ALA N A 8 ALA CA A 8 ALA C A 9 CYS N 1.0 -46.2 -36.5 PSI 14 14 A 7 GLU C A 8 ALA N A 8 ALA CA A 8 ALA C 1.0 -76.4 -58.7 PHI 15 15 A 9 CYS N A 9 CYS CA A 9 CYS C A 10 GLN N 1.0 -46.5 -34.3 PSI 16 16 A 8 ALA C A 9 CYS N A 9 CYS CA A 9 CYS C 1.0 -71.7 -60.4 PHI 17 17 A 10 GLN N A 10 GLN CA A 10 GLN C A 11 TYR N 1.0 -47.0 -35.7 PSI 18 18 A 9 CYS C A 10 GLN N A 10 GLN CA A 10 GLN C 1.0 -68.5 -61.0 PHI 19 19 A 11 TYR N A 11 TYR CA A 11 TYR C A 12 ILE N 1.0 -48.4 -35.8 PSI 20 20 A 10 GLN C A 11 TYR N A 11 TYR CA A 11 TYR C 1.0 -69.4 -62.4 PHI 21 21 A 12 ILE N A 12 ILE CA A 12 ILE C A 13 SER N 1.0 -46.5 -35.7 PSI 22 22 A 11 TYR C A 12 ILE N A 12 ILE CA A 12 ILE C 1.0 -69.1 -61.2 PHI 23 23 A 13 SER N A 13 SER CA A 13 SER C A 14 ASP N 1.0 -44.8 -34.0 PSI 24 24 A 12 ILE C A 13 SER N A 13 SER CA A 13 SER C 1.0 -66.8 -57.1 PHI 25 25 A 14 ASP N A 14 ASP CA A 14 ASP C A 15 HIS N 1.0 -39.0 -17.7 PSI 26 26 A 13 SER C A 14 ASP N A 14 ASP CA A 14 ASP C 1.0 -67.4 -60.0 PHI 27 27 A 15 HIS N A 15 HIS CA A 15 HIS C A 16 LEU N 1.0 -19.5 17.8 PSI 28 28 A 14 ASP C A 15 HIS N A 15 HIS CA A 15 HIS C 1.0 -111.5 -78.1 PHI 29 29 A 16 LEU N A 16 LEU CA A 16 LEU C A 17 ALA N 1.0 -41.7 -24.9 PSI 30 30 A 15 HIS C A 16 LEU N A 16 LEU CA A 16 LEU C 1.0 -68.3 -50.0 PHI 31 31 A 17 ALA N A 17 ALA CA A 17 ALA C A 18 ASP N 1.0 -20.9 6.3 PSI 32 32 A 16 LEU C A 17 ALA N A 17 ALA CA A 17 ALA C 1.0 -93.9 -71.8 PHI 33 33 A 18 ASP N A 18 ASP CA A 18 ASP C A 19 SER N 1.0 113.7 161.3 PSI 34 34 A 17 ALA C A 18 ASP N A 18 ASP CA A 18 ASP C 1.0 -84.2 -61.9 PHI 35 35 A 19 SER N A 19 SER CA A 19 SER C A 20 ASN N 1.0 -51.5 4.0 PSI 36 36 A 18 ASP C A 19 SER N A 19 SER CA A 19 SER C 1.0 -101.2 -59.2 PHI 37 37 A 20 ASN N A 20 ASN CA A 20 ASN C A 21 PHE N 1.0 94.3 165.2 PSI 38 38 A 19 SER C A 20 ASN N A 20 ASN CA A 20 ASN C 1.0 -116.0 -60.1 PHI 39 39 A 21 PHE N A 21 PHE CA A 21 PHE C A 22 ASP N 1.0 109.3 140.4 PSI 40 40 A 20 ASN C A 21 PHE N A 21 PHE CA A 21 PHE C 1.0 -118.9 -68.7 PHI 41 41 A 22 ASP N A 22 ASP CA A 22 ASP C A 23 ILE N 1.0 93.6 141.4 PSI 42 42 A 21 PHE C A 22 ASP N A 22 ASP CA A 22 ASP C 1.0 -115.8 -80.6 PHI 43 43 A 23 ILE N A 23 ILE CA A 23 ILE C A 24 ALA N 1.0 -44.8 -14.9 PSI 44 44 A 22 ASP C A 23 ILE N A 23 ILE CA A 23 ILE C 1.0 -69.1 -55.0 PHI 45 45 A 24 ALA N A 24 ALA CA A 24 ALA C A 25 SER N 1.0 -44.9 -26.4 PSI 46 46 A 23 ILE C A 24 ALA N A 24 ALA CA A 24 ALA C 1.0 -70.2 -58.8 PHI 47 47 A 25 SER N A 25 SER CA A 25 SER C A 26 VAL N 1.0 -47.2 -29.6 PSI 48 48 A 24 ALA C A 25 SER N A 25 SER CA A 25 SER C 1.0 -76.4 -63.0 PHI 49 49 A 26 VAL N A 26 VAL CA A 26 VAL C A 27 ALA N 1.0 -52.1 -37.3 PSI 50 50 A 25 SER C A 26 VAL N A 26 VAL CA A 26 VAL C 1.0 -69.9 -55.1 PHI 51 51 A 27 ALA N A 27 ALA CA A 27 ALA C A 28 GLN N 1.0 -48.6 -35.1 PSI 52 52 A 26 VAL C A 27 ALA N A 27 ALA CA A 27 ALA C 1.0 -67.1 -54.9 PHI 53 53 A 28 GLN N A 28 GLN CA A 28 GLN C A 29 HIS N 1.0 -45.1 -37.6 PSI 54 54 A 27 ALA C A 28 GLN N A 28 GLN CA A 28 GLN C 1.0 -69.1 -58.9 PHI 55 55 A 29 HIS N A 29 HIS CA A 29 HIS C A 30 VAL N 1.0 -34.5 -17.4 PSI 56 56 A 28 GLN C A 29 HIS N A 29 HIS CA A 29 HIS C 1.0 -76.8 -58.3 PHI 57 57 A 30 VAL N A 30 VAL CA A 30 VAL C A 31 CYS N 1.0 -0.5 26.1 PSI 58 58 A 29 HIS C A 30 VAL N A 30 VAL CA A 30 VAL C 1.0 -114.3 -85.4 PHI 59 59 A 31 CYS N A 31 CYS CA A 31 CYS C A 32 LEU N 1.0 36.8 46.6 PSI 60 60 A 30 VAL C A 31 CYS N A 31 CYS CA A 31 CYS C 1.0 51.5 61.7 PHI 61 61 A 32 LEU N A 32 LEU CA A 32 LEU C A 33 SER N 1.0 137.6 164.0 PSI 62 62 A 31 CYS C A 32 LEU N A 32 LEU CA A 32 LEU C 1.0 -140.9 -105.2 PHI 63 63 A 33 SER N A 33 SER CA A 33 SER C A 34 PRO N 1.0 134.4 177.1 PSI 64 64 A 32 LEU C A 33 SER N A 33 SER CA A 33 SER C 1.0 -100.6 -62.8 PHI 65 65 A 34 PRO N A 34 PRO CA A 34 PRO C A 35 SER N 1.0 -39.0 -28.4 PSI 66 66 A 35 SER N A 35 SER CA A 35 SER C A 36 ARG N 1.0 -46.7 -28.7 PSI 67 67 A 34 PRO C A 35 SER N A 35 SER CA A 35 SER C 1.0 -67.3 -58.2 PHI 68 68 A 36 ARG N A 36 ARG CA A 36 ARG C A 37 LEU N 1.0 -44.8 -35.2 PSI 69 69 A 35 SER C A 36 ARG N A 36 ARG CA A 36 ARG C 1.0 -72.4 -60.7 PHI 70 70 A 37 LEU N A 37 LEU CA A 37 LEU C A 38 SER N 1.0 -43.9 -35.8 PSI 71 71 A 36 ARG C A 37 LEU N A 37 LEU CA A 37 LEU C 1.0 -69.4 -59.1 PHI 72 72 A 38 SER N A 38 SER CA A 38 SER C A 39 HIS N 1.0 -46.7 -37.1 PSI 73 73 A 37 LEU C A 38 SER N A 38 SER CA A 38 SER C 1.0 -65.8 -60.9 PHI 74 74 A 39 HIS N A 39 HIS CA A 39 HIS C A 40 LEU N 1.0 -48.5 -39.5 PSI 75 75 A 38 SER C A 39 HIS N A 39 HIS CA A 39 HIS C 1.0 -69.5 -59.8 PHI 76 76 A 40 LEU N A 40 LEU CA A 40 LEU C A 41 PHE N 1.0 -47.8 -33.1 PSI 77 77 A 39 HIS C A 40 LEU N A 40 LEU CA A 40 LEU C 1.0 -70.1 -60.5 PHI 78 78 A 41 PHE N A 41 PHE CA A 41 PHE C A 42 ARG N 1.0 -47.9 -35.4 PSI 79 79 A 40 LEU C A 41 PHE N A 41 PHE CA A 41 PHE C 1.0 -70.5 -57.6 PHI 80 80 A 42 ARG N A 42 ARG CA A 42 ARG C A 43 GLN N 1.0 -46.1 -28.3 PSI 81 81 A 41 PHE C A 42 ARG N A 42 ARG CA A 42 ARG C 1.0 -67.1 -57.6 PHI 82 82 A 43 GLN N A 43 GLN CA A 43 GLN C A 44 GLN N 1.0 -44.8 -33.8 PSI 83 83 A 42 ARG C A 43 GLN N A 43 GLN CA A 43 GLN C 1.0 -69.3 -58.9 PHI 84 84 A 44 GLN N A 44 GLN CA A 44 GLN C A 45 LEU N 1.0 -36.1 -18.0 PSI 85 85 A 43 GLN C A 44 GLN N A 44 GLN CA A 44 GLN C 1.0 -78.4 -62.1 PHI 86 86 A 45 LEU N A 45 LEU CA A 45 LEU C A 46 GLY N 1.0 -16.5 16.8 PSI 87 87 A 44 GLN C A 45 LEU N A 45 LEU CA A 45 LEU C 1.0 -111.2 -90.2 PHI 88 88 A 46 GLY N A 46 GLY CA A 46 GLY C A 47 ILE N 1.0 -0.8 36.3 PSI 89 89 A 45 LEU C A 46 GLY N A 46 GLY CA A 46 GLY C 1.0 66.3 88.3 PHI 90 90 A 47 ILE N A 47 ILE CA A 47 ILE C A 48 SER N 1.0 142.1 176.9 PSI 91 91 A 46 GLY C A 47 ILE N A 47 ILE CA A 47 ILE C 1.0 -149.4 -101.9 PHI 92 92 A 48 SER N A 48 SER CA A 48 SER C A 49 VAL N 1.0 141.0 172.7 PSI 93 93 A 47 ILE C A 48 SER N A 48 SER CA A 48 SER C 1.0 -124.8 -79.1 PHI 94 94 A 49 VAL N A 49 VAL CA A 49 VAL C A 50 LEU N 1.0 -45.1 -30.3 PSI 95 95 A 48 SER C A 49 VAL N A 49 VAL CA A 49 VAL C 1.0 -68.0 -54.8 PHI 96 96 A 50 LEU N A 50 LEU CA A 50 LEU C A 51 SER N 1.0 -48.4 -28.3 PSI 97 97 A 49 VAL C A 50 LEU N A 50 LEU CA A 50 LEU C 1.0 -61.9 -54.2 PHI 98 98 A 51 SER N A 51 SER CA A 51 SER C A 52 TRP N 1.0 -47.9 -33.1 PSI 99 99 A 50 LEU C A 51 SER N A 51 SER CA A 51 SER C 1.0 -72.6 -61.1 PHI 100 100 A 52 TRP N A 52 TRP CA A 52 TRP C A 53 ARG N 1.0 -48.9 -40.6 PSI 101 101 A 51 SER C A 52 TRP N A 52 TRP CA A 52 TRP C 1.0 -68.8 -59.2 PHI 102 102 A 53 ARG N A 53 ARG CA A 53 ARG C A 54 GLU N 1.0 -47.0 -37.3 PSI 103 103 A 52 TRP C A 53 ARG N A 53 ARG CA A 53 ARG C 1.0 -65.1 -58.3 PHI 104 104 A 54 GLU N A 54 GLU CA A 54 GLU C A 55 ASP N 1.0 -46.7 -38.1 PSI 105 105 A 53 ARG C A 54 GLU N A 54 GLU CA A 54 GLU C 1.0 -65.8 -56.7 PHI 106 106 A 55 ASP N A 55 ASP CA A 55 ASP C A 56 GLN N 1.0 -49.7 -37.6 PSI 107 107 A 54 GLU C A 55 ASP N A 55 ASP CA A 55 ASP C 1.0 -66.5 -54.5 PHI 108 108 A 56 GLN N A 56 GLN CA A 56 GLN C A 57 ARG N 1.0 -44.4 -34.8 PSI 109 109 A 55 ASP C A 56 GLN N A 56 GLN CA A 56 GLN C 1.0 -70.1 -59.8 PHI 110 110 A 57 ARG N A 57 ARG CA A 57 ARG C A 58 ILE N 1.0 -46.7 -40.5 PSI 111 111 A 56 GLN C A 57 ARG N A 57 ARG CA A 57 ARG C 1.0 -70.9 -57.8 PHI 112 112 A 58 ILE N A 58 ILE CA A 58 ILE C A 59 SER N 1.0 -45.4 -32.6 PSI 113 113 A 57 ARG C A 58 ILE N A 58 ILE CA A 58 ILE C 1.0 -73.1 -59.0 PHI 114 114 A 59 SER N A 59 SER CA A 59 SER C A 60 GLN N 1.0 -48.3 -31.0 PSI 115 115 A 58 ILE C A 59 SER N A 59 SER CA A 59 SER C 1.0 -70.5 -56.7 PHI 116 116 A 60 GLN N A 60 GLN CA A 60 GLN C A 61 ALA N 1.0 -44.3 -38.3 PSI 117 117 A 59 SER C A 60 GLN N A 60 GLN CA A 60 GLN C 1.0 -71.4 -60.1 PHI 118 118 A 61 ALA N A 61 ALA CA A 61 ALA C A 62 LYS N 1.0 -46.1 -35.6 PSI 119 119 A 60 GLN C A 61 ALA N A 61 ALA CA A 61 ALA C 1.0 -70.5 -56.9 PHI 120 120 A 62 LYS N A 62 LYS CA A 62 LYS C A 63 LEU N 1.0 -47.1 -33.4 PSI 121 121 A 61 ALA C A 62 LYS N A 62 LYS CA A 62 LYS C 1.0 -70.6 -57.8 PHI 122 122 A 63 LEU N A 63 LEU CA A 63 LEU C A 64 LEU N 1.0 -49.7 -33.9 PSI 123 123 A 62 LYS C A 63 LEU N A 63 LEU CA A 63 LEU C 1.0 -67.8 -58.1 PHI 124 124 A 64 LEU N A 64 LEU CA A 64 LEU C A 65 LEU N 1.0 -47.0 -38.5 PSI 125 125 A 63 LEU C A 64 LEU N A 64 LEU CA A 64 LEU C 1.0 -69.9 -60.9 PHI 126 126 A 65 LEU N A 65 LEU CA A 65 LEU C A 66 SER N 1.0 -48.7 -29.1 PSI 127 127 A 64 LEU C A 65 LEU N A 65 LEU CA A 65 LEU C 1.0 -69.2 -55.0 PHI 128 128 A 66 SER N A 66 SER CA A 66 SER C A 67 THR N 1.0 -39.5 -16.2 PSI 129 129 A 65 LEU C A 66 SER N A 66 SER CA A 66 SER C 1.0 -90.1 -66.4 PHI 130 130 A 67 THR N A 67 THR CA A 67 THR C A 68 THR N 1.0 -14.6 11.2 PSI 131 131 A 66 SER C A 67 THR N A 67 THR CA A 67 THR C 1.0 -124.4 -95.3 PHI 132 132 A 68 THR N A 68 THR CA A 68 THR C A 69 ARG N 1.0 144.3 173.5 PSI 133 133 A 67 THR C A 68 THR N A 68 THR CA A 68 THR C 1.0 -133.1 -89.9 PHI 134 134 A 69 ARG N A 69 ARG CA A 69 ARG C A 70 MET N 1.0 0.6 18.2 PSI 135 135 A 68 THR C A 69 ARG N A 69 ARG CA A 69 ARG C 1.0 -122.4 -91.3 PHI 136 136 A 70 MET N A 70 MET CA A 70 MET C A 71 PRO N 1.0 122.8 163.9 PSI 137 137 A 69 ARG C A 70 MET N A 70 MET CA A 70 MET C 1.0 -121.7 -60.8 PHI 138 138 A 71 PRO N A 71 PRO CA A 71 PRO C A 72 ILE N 1.0 133.1 166.4 PSI 139 139 A 72 ILE N A 72 ILE CA A 72 ILE C A 73 ALA N 1.0 -52.5 -31.0 PSI 140 140 A 71 PRO C A 72 ILE N A 72 ILE CA A 72 ILE C 1.0 -63.8 -48.9 PHI 141 141 A 73 ALA N A 73 ALA CA A 73 ALA C A 74 THR N 1.0 -47.1 -32.3 PSI 142 142 A 72 ILE C A 73 ALA N A 73 ALA CA A 73 ALA C 1.0 -69.0 -57.7 PHI 143 143 A 74 THR N A 74 THR CA A 74 THR C A 75 VAL N 1.0 -50.0 -35.7 PSI 144 144 A 73 ALA C A 74 THR N A 74 THR CA A 74 THR C 1.0 -72.2 -61.7 PHI 145 145 A 75 VAL N A 75 VAL CA A 75 VAL C A 76 GLY N 1.0 -50.6 -41.4 PSI 146 146 A 74 THR C A 75 VAL N A 75 VAL CA A 75 VAL C 1.0 -67.9 -56.3 PHI 147 147 A 76 GLY N A 76 GLY CA A 76 GLY C A 77 ARG N 1.0 -43.7 -33.2 PSI 148 148 A 75 VAL C A 76 GLY N A 76 GLY CA A 76 GLY C 1.0 -69.5 -56.9 PHI 149 149 A 77 ARG N A 77 ARG CA A 77 ARG C A 78 ASN N 1.0 -47.8 -36.0 PSI 150 150 A 76 GLY C A 77 ARG N A 77 ARG CA A 77 ARG C 1.0 -69.7 -57.9 PHI 151 151 A 78 ASN N A 78 ASN CA A 78 ASN C A 79 VAL N 1.0 -31.1 -16.2 PSI 152 152 A 77 ARG C A 78 ASN N A 78 ASN CA A 78 ASN C 1.0 -74.2 -61.1 PHI 153 153 A 79 VAL N A 79 VAL CA A 79 VAL C A 80 GLY N 1.0 -17.2 18.8 PSI 154 154 A 78 ASN C A 79 VAL N A 79 VAL CA A 79 VAL C 1.0 -118.8 -89.3 PHI 155 155 A 80 GLY N A 80 GLY CA A 80 GLY C A 81 PHE N 1.0 0.9 27.8 PSI 156 156 A 79 VAL C A 80 GLY N A 80 GLY CA A 80 GLY C 1.0 68.7 93.7 PHI 157 157 A 81 PHE N A 81 PHE CA A 81 PHE C A 82 ASP N 1.0 117.3 149.0 PSI 158 158 A 80 GLY C A 81 PHE N A 81 PHE CA A 81 PHE C 1.0 -122.8 -82.3 PHI 159 159 A 82 ASP N A 82 ASP CA A 82 ASP C A 83 ASP N 1.0 -31.4 6.4 PSI 160 160 A 81 PHE C A 82 ASP N A 82 ASP CA A 82 ASP C 1.0 -111.6 -78.8 PHI 161 161 A 83 ASP N A 83 ASP CA A 83 ASP C A 84 GLN N 1.0 119.3 168.2 PSI 162 162 A 82 ASP C A 83 ASP N A 83 ASP CA A 83 ASP C 1.0 -131.1 -68.3 PHI 163 163 A 84 GLN N A 84 GLN CA A 84 GLN C A 85 LEU N 1.0 -40.6 -28.0 PSI 164 164 A 83 ASP C A 84 GLN N A 84 GLN CA A 84 GLN C 1.0 -62.2 -53.6 PHI 165 165 A 85 LEU N A 85 LEU CA A 85 LEU C A 86 TYR N 1.0 -47.8 -33.2 PSI 166 166 A 84 GLN C A 85 LEU N A 85 LEU CA A 85 LEU C 1.0 -68.8 -62.5 PHI 167 167 A 86 TYR N A 86 TYR CA A 86 TYR C A 87 PHE N 1.0 -48.4 -30.1 PSI 168 168 A 85 LEU C A 86 TYR N A 86 TYR CA A 86 TYR C 1.0 -70.9 -60.2 PHI 169 169 A 87 PHE N A 87 PHE CA A 87 PHE C A 88 SER N 1.0 -52.7 -31.9 PSI 170 170 A 86 TYR C A 87 PHE N A 87 PHE CA A 87 PHE C 1.0 -66.6 -50.8 PHI 171 171 A 88 SER N A 88 SER CA A 88 SER C A 89 ARG N 1.0 -47.3 -37.5 PSI 172 172 A 87 PHE C A 88 SER N A 88 SER CA A 88 SER C 1.0 -65.2 -59.8 PHI 173 173 A 89 ARG N A 89 ARG CA A 89 ARG C A 90 VAL N 1.0 -49.9 -29.7 PSI 174 174 A 88 SER C A 89 ARG N A 89 ARG CA A 89 ARG C 1.0 -68.4 -60.4 PHI 175 175 A 90 VAL N A 90 VAL CA A 90 VAL C A 91 PHE N 1.0 -46.5 -39.0 PSI 176 176 A 89 ARG C A 90 VAL N A 90 VAL CA A 90 VAL C 1.0 -69.9 -60.6 PHI 177 177 A 91 PHE N A 91 PHE CA A 91 PHE C A 92 LYS N 1.0 -47.7 -37.2 PSI 178 178 A 90 VAL C A 91 PHE N A 91 PHE CA A 91 PHE C 1.0 -65.4 -61.5 PHI 179 179 A 92 LYS N A 92 LYS CA A 92 LYS C A 93 LYS N 1.0 -48.2 -26.0 PSI 180 180 A 91 PHE C A 92 LYS N A 92 LYS CA A 92 LYS C 1.0 -67.9 -58.3 PHI 181 181 A 93 LYS N A 93 LYS CA A 93 LYS C A 94 CYS N 1.0 -45.1 -26.4 PSI 182 182 A 92 LYS C A 93 LYS N A 93 LYS CA A 93 LYS C 1.0 -72.9 -56.6 PHI 183 183 A 94 CYS N A 94 CYS CA A 94 CYS C A 95 THR N 1.0 -48.4 -18.4 PSI 184 184 A 93 LYS C A 94 CYS N A 94 CYS CA A 94 CYS C 1.0 -83.3 -55.7 PHI 185 185 A 95 THR N A 95 THR CA A 95 THR C A 96 GLY N 1.0 -24.0 13.0 PSI 186 186 A 94 CYS C A 95 THR N A 95 THR CA A 95 THR C 1.0 -127.0 -96.3 PHI 187 187 A 96 GLY N A 96 GLY CA A 96 GLY C A 97 ALA N 1.0 -8.9 17.2 PSI 188 188 A 95 THR C A 96 GLY N A 96 GLY CA A 96 GLY C 1.0 67.5 94.8 PHI 189 189 A 97 ALA N A 97 ALA CA A 97 ALA C A 98 SER N 1.0 146.3 168.7 PSI 190 190 A 96 GLY C A 97 ALA N A 97 ALA CA A 97 ALA C 1.0 -137.2 -110.5 PHI 191 191 A 98 SER N A 98 SER CA A 98 SER C A 99 PRO N 1.0 126.0 169.0 PSI 192 192 A 97 ALA C A 98 SER N A 98 SER CA A 98 SER C 1.0 -98.2 -66.0 PHI 193 193 A 99 PRO N A 99 PRO CA A 99 PRO C A 100 SER N 1.0 -41.4 -27.0 PSI 194 194 A 100 SER N A 100 SER CA A 100 SER C A 101 GLU N 1.0 -46.0 -34.2 PSI 195 195 A 99 PRO C A 100 SER N A 100 SER CA A 100 SER C 1.0 -67.1 -56.1 PHI 196 196 A 101 GLU N A 101 GLU CA A 101 GLU C A 102 PHE N 1.0 -47.1 -32.0 PSI 197 197 A 100 SER C A 101 GLU N A 101 GLU CA A 101 GLU C 1.0 -74.4 -62.3 PHI 198 198 A 102 PHE N A 102 PHE CA A 102 PHE C A 103 ARG N 1.0 -47.4 -37.4 PSI 199 199 A 101 GLU C A 102 PHE N A 102 PHE CA A 102 PHE C 1.0 -65.6 -58.5 PHI 200 200 A 103 ARG N A 103 ARG CA A 103 ARG C A 104 ALA N 1.0 -43.2 -30.1 PSI 201 201 A 102 PHE C A 103 ARG N A 103 ARG CA A 103 ARG C 1.0 -75.7 -58.1 PHI 202 202 A 104 ALA N A 104 ALA CA A 104 ALA C A 105 GLY N 1.0 -36.5 -13.3 PSI 203 203 A 103 ARG C A 104 ALA N A 104 ALA CA A 104 ALA C 1.0 -80.9 -60.5 PHI 204 204 A 105 GLY N A 105 GLY CA A 105 GLY C A 106 CYS N 1.0 -9.1 11.9 PSI 205 205 A 104 ALA C A 105 GLY N A 105 GLY CA A 105 GLY C 1.0 81.0 97.1 PHI 206 206 A 106 CYS N A 106 CYS CA A 106 CYS C A 107 GLU N 1.0 120.5 138.3 PSI 207 207 A 105 GLY C A 106 CYS N A 106 CYS CA A 106 CYS C 1.0 -89.6 -54.0 PHI 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 12800 2 1H 8035 3 15N 2200 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 12800 2 1H 8699 3 13C 6633 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 8012.8 2 1H 6800 3 13C 4000 stop_ save_