data_nef_c25848_2n8f 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 2N8F stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 4 CYS SG 1 19 CYS SG 1 11 CYS SG 1 24 CYS SG 1 18 CYS SG 1 34 CYS SG 1 41 CYS SG 1 56 CYS SG 1 48 CYS SG 1 61 CYS SG 1 55 CYS SG 1 72 CYS SG stop_ 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 SER start . . 2 A 2 ASN middle . . 3 A 3 GLU middle . . 4 A 4 CYS middle -HG . 5 A 5 ILE middle . . 6 A 6 ARG middle . . 7 A 7 LYS middle . . 8 A 8 TRP middle . . 9 A 9 LEU middle . . 10 A 10 SER middle . . 11 A 11 CYS middle -HG . 12 A 12 VAL middle . . 13 A 13 ASP middle . . 14 A 14 ARG middle . . 15 A 15 LYS middle . . 16 A 16 ASN middle . . 17 A 17 ASP middle . . 18 A 18 CYS middle -HG . 19 A 19 CYS middle -HG . 20 A 20 GLU middle . . 21 A 21 GLY middle . false 22 A 22 LEU middle . . 23 A 23 GLU middle . . 24 A 24 CYS middle -HG . 25 A 25 TYR middle . . 26 A 26 LYS middle . . 27 A 27 ARG middle . . 28 A 28 ARG middle . . 29 A 29 HIS middle . . 30 A 30 SER middle . . 31 A 31 PHE middle . . 32 A 32 GLU middle . . 33 A 33 VAL middle . . 34 A 34 CYS middle -HG . 35 A 35 VAL middle . . 36 A 36 PRO middle . false 37 A 37 ILE middle . . 38 A 38 PRO middle . false 39 A 39 GLY middle . false 40 A 40 PHE middle . . 41 A 41 CYS middle -HG . 42 A 42 LEU middle . . 43 A 43 VAL middle . . 44 A 44 LYS middle . . 45 A 45 TRP middle . . 46 A 46 LYS middle . . 47 A 47 GLN middle . . 48 A 48 CYS middle -HG . 49 A 49 ASP middle . . 50 A 50 GLY middle . false 51 A 51 ARG middle . . 52 A 52 GLU middle . . 53 A 53 ARG middle . . 54 A 54 ASP middle . . 55 A 55 CYS middle -HG . 56 A 56 CYS middle -HG . 57 A 57 ALA middle . . 58 A 58 GLY middle . false 59 A 59 LEU middle . . 60 A 60 GLU middle . . 61 A 61 CYS middle -HG . 62 A 62 TRP middle . . 63 A 63 LYS middle . . 64 A 64 ARG middle . . 65 A 65 SER middle . . 66 A 66 GLY middle . false 67 A 67 ASN middle . . 68 A 68 LYS middle . . 69 A 69 SER middle . . 70 A 70 SER middle . . 71 A 71 VAL middle . . 72 A 72 CYS middle -HG . 73 A 73 ALA middle . . 74 A 74 PRO middle . false 75 A 75 ILE middle . . 76 A 76 THR 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 SER HA H 1 4.145 0.02 A 1 SER HBx H 1 3.965 0.02 A 1 SER HBy H 1 3.965 0.02 A 1 SER C C 13 170.743 0.3 A 1 SER CA C 13 57.396 0.3 A 1 SER CB C 13 62.993 0.3 A 2 ASN HA H 1 4.711 0.02 A 2 ASN HBy H 1 2.843 0.02 A 2 ASN HBx H 1 2.692 0.02 A 2 ASN HD2y H 1 7.594 0.02 A 2 ASN HD2x H 1 6.910 0.02 A 2 ASN C C 13 174.785 0.3 A 2 ASN CB C 13 38.820 0.3 A 2 ASN ND2 N 15 112.907 0.2 A 3 GLU H H 1 8.470 0.02 A 3 GLU HA H 1 4.348 0.02 A 3 GLU HBy H 1 2.083 0.02 A 3 GLU HBx H 1 1.916 0.02 A 3 GLU HGx H 1 2.292 0.02 A 3 GLU HGy H 1 2.292 0.02 A 3 GLU C C 13 176.060 0.3 A 3 GLU CA C 13 56.267 0.3 A 3 GLU CB C 13 30.187 0.3 A 3 GLU CG C 13 35.961 0.3 A 3 GLU N N 15 121.744 0.2 A 4 CYS H H 1 8.317 0.02 A 4 CYS HA H 1 4.797 0.02 A 4 CYS HBx H 1 3.023 0.02 A 4 CYS HBy H 1 3.151 0.02 A 4 CYS C C 13 173.263 0.3 A 4 CYS CB C 13 42.301 0.3 A 4 CYS N N 15 119.765 0.2 A 5 ILE H H 1 8.912 0.02 A 5 ILE HA H 1 3.888 0.02 A 5 ILE HB H 1 1.680 0.02 A 5 ILE HD1% H 1 0.885 0.02 A 5 ILE HG1y H 1 1.532 0.02 A 5 ILE HG1x H 1 0.872 0.02 A 5 ILE HG2% H 1 0.979 0.02 A 5 ILE C C 13 173.890 0.3 A 5 ILE CA C 13 62.516 0.3 A 5 ILE CB C 13 39.280 0.3 A 5 ILE CD1 C 13 14.806 0.3 A 5 ILE CG1 C 13 27.231 0.3 A 5 ILE CG2 C 13 20.705 0.3 A 5 ILE N N 15 122.940 0.2 A 6 ARG H H 1 7.528 0.02 A 6 ARG HA H 1 3.862 0.02 A 6 ARG HBy H 1 1.987 0.02 A 6 ARG HBx H 1 1.663 0.02 A 6 ARG HDx H 1 3.205 0.02 A 6 ARG HDy H 1 3.205 0.02 A 6 ARG HGy H 1 1.799 0.02 A 6 ARG HGx H 1 1.669 0.02 A 6 ARG C C 13 174.259 0.3 A 6 ARG CA C 13 56.018 0.3 A 6 ARG CB C 13 31.777 0.3 A 6 ARG CD C 13 43.510 0.3 A 6 ARG CG C 13 28.695 0.3 A 6 ARG N N 15 125.981 0.2 A 7 LYS H H 1 7.558 0.02 A 7 LYS HA H 1 3.286 0.02 A 7 LYS HBy H 1 1.268 0.02 A 7 LYS HBx H 1 1.137 0.02 A 7 LYS HDx H 1 1.304 0.02 A 7 LYS HDy H 1 1.304 0.02 A 7 LYS HEx H 1 2.570 0.02 A 7 LYS HEy H 1 2.570 0.02 A 7 LYS HGy H 1 0.625 0.02 A 7 LYS HGx H 1 0.298 0.02 A 7 LYS C C 13 175.417 0.3 A 7 LYS CA C 13 58.323 0.3 A 7 LYS CB C 13 32.671 0.3 A 7 LYS CD C 13 29.631 0.3 A 7 LYS CE C 13 41.235 0.3 A 7 LYS CG C 13 23.202 0.3 A 7 LYS N N 15 116.267 0.2 A 8 TRP H H 1 9.357 0.02 A 8 TRP HA H 1 4.260 0.02 A 8 TRP HBy H 1 3.698 0.02 A 8 TRP HBx H 1 3.527 0.02 A 8 TRP HD1 H 1 7.130 0.02 A 8 TRP HE1 H 1 10.243 0.02 A 8 TRP HE3 H 1 7.521 0.02 A 8 TRP HH2 H 1 7.242 0.02 A 8 TRP HZ2 H 1 7.535 0.02 A 8 TRP HZ3 H 1 7.096 0.02 A 8 TRP C C 13 175.069 0.3 A 8 TRP CA C 13 58.008 0.3 A 8 TRP CB C 13 27.687 0.3 A 8 TRP CD1 C 13 127.221 0.3 A 8 TRP CE3 C 13 121.483 0.3 A 8 TRP CH2 C 13 124.820 0.3 A 8 TRP CZ3 C 13 121.545 0.3 A 8 TRP N N 15 115.300 0.2 A 8 TRP NE1 N 15 127.904 0.2 A 9 LEU H H 1 7.701 0.02 A 9 LEU HA H 1 4.697 0.02 A 9 LEU HBy H 1 1.984 0.02 A 9 LEU HBx H 1 1.473 0.02 A 9 LEU HDx% H 1 0.900 0.02 A 9 LEU HDy% H 1 0.918 0.02 A 9 LEU HG H 1 1.553 0.02 A 9 LEU C C 13 176.636 0.3 A 9 LEU CB C 13 42.248 0.3 A 9 LEU CDx C 13 22.678 0.3 A 9 LEU CDy C 13 26.010 0.3 A 9 LEU CG C 13 27.244 0.3 A 9 LEU N N 15 120.240 0.2 A 10 SER H H 1 8.148 0.02 A 10 SER HA H 1 4.704 0.02 A 10 SER HBx H 1 3.744 0.02 A 10 SER HBy H 1 3.990 0.02 A 10 SER CB C 13 64.064 0.3 A 10 SER N N 15 110.077 0.2 A 11 CYS H H 1 8.580 0.02 A 11 CYS HA H 1 4.870 0.02 A 11 CYS HBy H 1 3.442 0.02 A 11 CYS HBx H 1 3.209 0.02 A 11 CYS CB C 13 44.031 0.3 A 11 CYS N N 15 121.141 0.2 A 12 VAL H H 1 7.776 0.02 A 12 VAL HA H 1 3.565 0.02 A 12 VAL HB H 1 1.774 0.02 A 12 VAL HGx% H 1 1.205 0.02 A 12 VAL HGy% H 1 0.879 0.02 A 12 VAL CA C 13 65.197 0.3 A 12 VAL CGy C 13 22.637 0.3 A 12 VAL CGx C 13 20.471 0.3 A 14 ARG HDy H 1 3.211 0.02 A 14 ARG HDx H 1 3.058 0.02 A 14 ARG HE H 1 7.935 0.02 A 14 ARG HGy H 1 1.628 0.02 A 14 ARG HGx H 1 1.484 0.02 A 14 ARG CD C 13 44.008 0.3 A 14 ARG CG C 13 26.732 0.3 A 14 ARG NE N 15 85.457 0.2 A 15 LYS H H 1 7.936 0.02 A 15 LYS HA H 1 4.359 0.02 A 15 LYS HBx H 1 1.797 0.02 A 15 LYS HBy H 1 1.797 0.02 A 15 LYS HDx H 1 1.681 0.02 A 15 LYS HDy H 1 1.681 0.02 A 15 LYS HEx H 1 3.004 0.02 A 15 LYS HEy H 1 3.004 0.02 A 15 LYS HGy H 1 1.499 0.02 A 15 LYS HGx H 1 1.367 0.02 A 15 LYS C C 13 177.505 0.3 A 15 LYS CA C 13 59.442 0.3 A 15 LYS CB C 13 32.571 0.3 A 15 LYS CD C 13 29.433 0.3 A 15 LYS CE C 13 42.098 0.3 A 15 LYS CG C 13 24.441 0.3 A 15 LYS N N 15 117.195 0.2 A 16 ASN H H 1 8.644 0.02 A 16 ASN HA H 1 5.075 0.02 A 16 ASN HBy H 1 3.048 0.02 A 16 ASN HBx H 1 2.642 0.02 A 16 ASN HD2y H 1 7.617 0.02 A 16 ASN HD2x H 1 6.908 0.02 A 16 ASN C C 13 176.707 0.3 A 16 ASN CA C 13 53.010 0.3 A 16 ASN CB C 13 39.169 0.3 A 16 ASN N N 15 115.005 0.2 A 16 ASN ND2 N 15 113.443 0.2 A 17 ASP H H 1 7.592 0.02 A 17 ASP HA H 1 4.863 0.02 A 17 ASP HBy H 1 3.189 0.02 A 17 ASP HBx H 1 2.680 0.02 A 17 ASP C C 13 176.756 0.3 A 17 ASP CB C 13 41.010 0.3 A 17 ASP N N 15 118.040 0.2 A 18 CYS H H 1 8.729 0.02 A 18 CYS HA H 1 4.900 0.02 A 18 CYS HBy H 1 2.897 0.02 A 18 CYS HBx H 1 2.760 0.02 A 18 CYS C C 13 176.186 0.3 A 18 CYS CB C 13 38.887 0.3 A 18 CYS N N 15 119.499 0.2 A 19 CYS H H 1 9.086 0.02 A 19 CYS HA H 1 4.415 0.02 A 19 CYS HBx H 1 2.427 0.02 A 19 CYS HBy H 1 3.344 0.02 A 19 CYS C C 13 171.719 0.3 A 19 CYS CA C 13 54.569 0.3 A 19 CYS CB C 13 40.917 0.3 A 19 CYS N N 15 120.655 0.2 A 20 GLU H H 1 8.155 0.02 A 20 GLU HA H 1 3.931 0.02 A 20 GLU HBy H 1 2.003 0.02 A 20 GLU HBx H 1 1.852 0.02 A 20 GLU HGy H 1 2.269 0.02 A 20 GLU HGx H 1 2.167 0.02 A 20 GLU C C 13 176.509 0.3 A 20 GLU CA C 13 57.820 0.3 A 20 GLU CB C 13 29.903 0.3 A 20 GLU CG C 13 35.971 0.3 A 20 GLU N N 15 118.445 0.2 A 21 GLY H H 1 8.719 0.02 A 21 GLY HAx H 1 2.035 0.02 A 21 GLY HAy H 1 3.076 0.02 A 21 GLY C C 13 172.614 0.3 A 21 GLY CA C 13 43.531 0.3 A 21 GLY N N 15 113.662 0.2 A 22 LEU H H 1 7.641 0.02 A 22 LEU HA H 1 5.081 0.02 A 22 LEU HBx H 1 0.861 0.02 A 22 LEU HBy H 1 2.013 0.02 A 22 LEU HDx% H 1 0.619 0.02 A 22 LEU HDy% H 1 0.340 0.02 A 22 LEU HG H 1 1.079 0.02 A 22 LEU C C 13 174.927 0.3 A 22 LEU CA C 13 52.450 0.3 A 22 LEU CB C 13 44.511 0.3 A 22 LEU CDy C 13 26.481 0.3 A 22 LEU CDx C 13 22.992 0.3 A 22 LEU CG C 13 26.429 0.3 A 22 LEU N N 15 120.372 0.2 A 23 GLU H H 1 9.299 0.02 A 23 GLU HA H 1 4.708 0.02 A 23 GLU HBy H 1 1.952 0.02 A 23 GLU HBx H 1 1.812 0.02 A 23 GLU HGy H 1 2.122 0.02 A 23 GLU HGx H 1 2.057 0.02 A 23 GLU C C 13 173.821 0.3 A 23 GLU CA C 13 53.332 0.3 A 23 GLU CB C 13 32.486 0.3 A 23 GLU CG C 13 33.869 0.3 A 23 GLU N N 15 117.193 0.2 A 24 CYS H H 1 8.953 0.02 A 24 CYS HA H 1 4.801 0.02 A 24 CYS HBy H 1 3.247 0.02 A 24 CYS HBx H 1 3.075 0.02 A 24 CYS CB C 13 40.295 0.3 A 24 CYS N N 15 123.260 0.2 A 25 TYR H H 1 9.338 0.02 A 25 TYR HA H 1 4.813 0.02 A 25 TYR HBy H 1 3.084 0.02 A 25 TYR HBx H 1 2.885 0.02 A 25 TYR HDx H 1 7.003 0.02 A 25 TYR HDy H 1 7.003 0.02 A 25 TYR HEx H 1 6.813 0.02 A 25 TYR HEy H 1 6.813 0.02 A 25 TYR C C 13 173.768 0.3 A 25 TYR CB C 13 43.346 0.3 A 25 TYR CD1 C 13 133.176 0.3 A 25 TYR CD2 C 13 133.176 0.3 A 25 TYR CE1 C 13 118.229 0.3 A 25 TYR CE2 C 13 118.229 0.3 A 25 TYR N N 15 134.523 0.2 A 26 LYS H H 1 8.176 0.02 A 26 LYS HA H 1 4.096 0.02 A 26 LYS HBy H 1 1.681 0.02 A 26 LYS HBx H 1 1.478 0.02 A 26 LYS HDx H 1 1.572 0.02 A 26 LYS HDy H 1 1.572 0.02 A 26 LYS HEx H 1 2.934 0.02 A 26 LYS HEy H 1 2.934 0.02 A 26 LYS HGx H 1 1.175 0.02 A 26 LYS HGy H 1 1.175 0.02 A 26 LYS C C 13 174.360 0.3 A 26 LYS CA C 13 55.938 0.3 A 26 LYS CB C 13 32.667 0.3 A 26 LYS CD C 13 29.312 0.3 A 26 LYS CE C 13 42.251 0.3 A 26 LYS CG C 13 24.938 0.3 A 26 LYS N N 15 127.496 0.2 A 27 ARG H H 1 7.493 0.02 A 27 ARG HA H 1 4.225 0.02 A 27 ARG HBx H 1 1.606 0.02 A 27 ARG HBy H 1 1.606 0.02 A 27 ARG HDx H 1 3.173 0.02 A 27 ARG HDy H 1 3.173 0.02 A 27 ARG HGx H 1 1.743 0.02 A 27 ARG HGy H 1 1.743 0.02 A 27 ARG C C 13 174.385 0.3 A 27 ARG CA C 13 55.989 0.3 A 27 ARG CB C 13 32.009 0.3 A 27 ARG CG C 13 27.322 0.3 A 27 ARG N N 15 125.899 0.2 A 28 ARG H H 1 8.519 0.02 A 28 ARG HA H 1 3.912 0.02 A 28 ARG HBy H 1 1.706 0.02 A 28 ARG HBx H 1 1.618 0.02 A 28 ARG HDx H 1 3.105 0.02 A 28 ARG HDy H 1 3.105 0.02 A 28 ARG HGx H 1 1.487 0.02 A 28 ARG HGy H 1 1.487 0.02 A 28 ARG C C 13 176.613 0.3 A 28 ARG CA C 13 57.614 0.3 A 28 ARG CB C 13 29.675 0.3 A 28 ARG CD C 13 43.202 0.3 A 28 ARG CG C 13 27.157 0.3 A 28 ARG N N 15 121.214 0.2 A 29 HIS H H 1 8.771 0.02 A 29 HIS HA H 1 4.480 0.02 A 29 HIS HBy H 1 3.384 0.02 A 29 HIS HBx H 1 3.234 0.02 A 29 HIS HD2 H 1 7.207 0.02 A 29 HIS HE1 H 1 8.484 0.02 A 29 HIS C C 13 174.166 0.3 A 29 HIS CA C 13 56.020 0.3 A 29 HIS CB C 13 28.134 0.3 A 29 HIS CD2 C 13 119.756 0.3 A 29 HIS CE1 C 13 136.623 0.3 A 29 HIS N N 15 116.413 0.2 A 30 SER H H 1 7.826 0.02 A 30 SER HA H 1 4.469 0.02 A 30 SER HBy H 1 3.669 0.02 A 30 SER HBx H 1 3.506 0.02 A 30 SER C C 13 173.332 0.3 A 30 SER CA C 13 57.257 0.3 A 30 SER CB C 13 63.559 0.3 A 30 SER N N 15 113.403 0.2 A 31 PHE H H 1 7.801 0.02 A 31 PHE HA H 1 4.793 0.02 A 31 PHE HBy H 1 3.169 0.02 A 31 PHE HBx H 1 3.109 0.02 A 31 PHE HDx H 1 7.310 0.02 A 31 PHE HDy H 1 7.310 0.02 A 31 PHE HEx H 1 7.307 0.02 A 31 PHE HEy H 1 7.307 0.02 A 31 PHE HZ H 1 7.323 0.02 A 31 PHE CB C 13 40.312 0.3 A 31 PHE CD1 C 13 132.459 0.3 A 31 PHE CD2 C 13 132.459 0.3 A 31 PHE CE1 C 13 131.354 0.3 A 31 PHE CE2 C 13 131.354 0.3 A 31 PHE CZ C 13 130.413 0.3 A 31 PHE N N 15 118.662 0.2 A 32 GLU HA H 1 4.610 0.02 A 32 GLU HBx H 1 1.765 0.02 A 32 GLU HBy H 1 1.765 0.02 A 32 GLU HGy H 1 2.394 0.02 A 32 GLU HGx H 1 2.070 0.02 A 32 GLU CB C 13 30.289 0.3 A 32 GLU CG C 13 36.479 0.3 A 33 VAL H H 1 8.581 0.02 A 33 VAL HA H 1 5.101 0.02 A 33 VAL HB H 1 1.770 0.02 A 33 VAL HGx% H 1 0.803 0.02 A 33 VAL HGy% H 1 0.843 0.02 A 33 VAL C C 13 175.754 0.3 A 33 VAL CA C 13 58.545 0.3 A 33 VAL CB C 13 37.464 0.3 A 33 VAL CGy C 13 22.551 0.3 A 33 VAL CGx C 13 18.088 0.3 A 33 VAL N N 15 121.027 0.2 A 34 CYS H H 1 7.968 0.02 A 34 CYS HA H 1 5.064 0.02 A 34 CYS HBy H 1 2.870 0.02 A 34 CYS HBx H 1 2.574 0.02 A 34 CYS C C 13 174.853 0.3 A 34 CYS CA C 13 54.695 0.3 A 34 CYS CB C 13 39.974 0.3 A 34 CYS N N 15 119.365 0.2 A 35 VAL H H 1 9.611 0.02 A 35 VAL HA H 1 4.468 0.02 A 35 VAL HB H 1 2.186 0.02 A 35 VAL HGx% H 1 1.084 0.02 A 35 VAL HGy% H 1 0.870 0.02 A 35 VAL CA C 13 58.030 0.3 A 35 VAL CB C 13 33.216 0.3 A 35 VAL CGy C 13 21.924 0.3 A 35 VAL CGx C 13 20.247 0.3 A 35 VAL N N 15 122.141 0.2 A 36 PRO HA H 1 4.398 0.02 A 36 PRO HBx H 1 1.728 0.02 A 36 PRO HBy H 1 2.183 0.02 A 36 PRO HDy H 1 3.461 0.02 A 36 PRO HDx H 1 2.749 0.02 A 36 PRO HGy H 1 2.082 0.02 A 36 PRO HGx H 1 1.538 0.02 A 36 PRO C C 13 176.509 0.3 A 36 PRO CA C 13 63.320 0.3 A 36 PRO CB C 13 32.112 0.3 A 36 PRO CD C 13 50.683 0.3 A 36 PRO CG C 13 27.714 0.3 A 37 ILE H H 1 7.927 0.02 A 37 ILE HA H 1 4.131 0.02 A 37 ILE HB H 1 1.526 0.02 A 37 ILE HD1% H 1 0.630 0.02 A 37 ILE HG1y H 1 1.235 0.02 A 37 ILE HG1x H 1 0.864 0.02 A 37 ILE HG2% H 1 0.896 0.02 A 37 ILE CA C 13 59.790 0.3 A 37 ILE CB C 13 39.566 0.3 A 37 ILE CD1 C 13 13.939 0.3 A 37 ILE CG1 C 13 28.265 0.3 A 37 ILE CG2 C 13 16.304 0.3 A 37 ILE N N 15 125.294 0.2 A 38 PRO HA H 1 4.337 0.02 A 38 PRO HBy H 1 2.284 0.02 A 38 PRO HBx H 1 1.901 0.02 A 38 PRO HDx H 1 3.625 0.02 A 38 PRO HDy H 1 4.123 0.02 A 38 PRO HGx H 1 1.929 0.02 A 38 PRO HGy H 1 2.114 0.02 A 38 PRO C C 13 177.800 0.3 A 38 PRO CA C 13 64.094 0.3 A 38 PRO CB C 13 31.731 0.3 A 38 PRO CD C 13 51.421 0.3 A 38 PRO CG C 13 27.769 0.3 A 39 GLY H H 1 8.843 0.02 A 39 GLY HAy H 1 4.099 0.02 A 39 GLY HAx H 1 3.664 0.02 A 39 GLY C C 13 174.463 0.3 A 39 GLY CA C 13 45.463 0.3 A 39 GLY N N 15 112.745 0.2 A 40 PHE H H 1 7.762 0.02 A 40 PHE HA H 1 4.321 0.02 A 40 PHE HBy H 1 3.062 0.02 A 40 PHE HBx H 1 2.974 0.02 A 40 PHE HDx H 1 7.237 0.02 A 40 PHE HDy H 1 7.237 0.02 A 40 PHE HEx H 1 7.196 0.02 A 40 PHE HEy H 1 7.196 0.02 A 40 PHE HZ H 1 7.237 0.02 A 40 PHE C C 13 174.706 0.3 A 40 PHE CA C 13 59.668 0.3 A 40 PHE CB C 13 39.815 0.3 A 40 PHE CD1 C 13 132.188 0.3 A 40 PHE CD2 C 13 132.188 0.3 A 40 PHE CE1 C 13 131.446 0.3 A 40 PHE CE2 C 13 131.446 0.3 A 40 PHE CZ C 13 130.228 0.3 A 40 PHE N N 15 120.803 0.2 A 41 CYS H H 1 7.040 0.02 A 41 CYS HA H 1 4.574 0.02 A 41 CYS HBx H 1 2.820 0.02 A 41 CYS HBy H 1 3.039 0.02 A 41 CYS C C 13 171.732 0.3 A 41 CYS CA C 13 53.666 0.3 A 41 CYS CB C 13 44.109 0.3 A 41 CYS N N 15 120.807 0.2 A 42 LEU H H 1 8.728 0.02 A 42 LEU HA H 1 4.272 0.02 A 42 LEU HBy H 1 1.902 0.02 A 42 LEU HBx H 1 1.204 0.02 A 42 LEU HDx% H 1 0.885 0.02 A 42 LEU HDy% H 1 0.842 0.02 A 42 LEU HG H 1 1.502 0.02 A 42 LEU C C 13 173.872 0.3 A 42 LEU CA C 13 54.003 0.3 A 42 LEU CB C 13 43.826 0.3 A 42 LEU CDx C 13 22.686 0.3 A 42 LEU CDy C 13 26.284 0.3 A 42 LEU CG C 13 26.424 0.3 A 42 LEU N N 15 119.987 0.2 A 43 VAL H H 1 7.192 0.02 A 43 VAL HA H 1 3.808 0.02 A 43 VAL HB H 1 2.382 0.02 A 43 VAL HGx% H 1 0.983 0.02 A 43 VAL HGy% H 1 0.878 0.02 A 43 VAL C C 13 173.751 0.3 A 43 VAL CA C 13 60.258 0.3 A 43 VAL CB C 13 32.857 0.3 A 43 VAL CGy C 13 21.571 0.3 A 43 VAL CGx C 13 18.220 0.3 A 43 VAL N N 15 115.632 0.2 A 44 LYS H H 1 7.531 0.02 A 44 LYS HA H 1 3.230 0.02 A 44 LYS HBx H 1 1.192 0.02 A 44 LYS HBy H 1 1.192 0.02 A 44 LYS HDy H 1 1.308 0.02 A 44 LYS HDx H 1 1.266 0.02 A 44 LYS HEx H 1 2.634 0.02 A 44 LYS HEy H 1 2.634 0.02 A 44 LYS HGy H 1 0.556 0.02 A 44 LYS HGx H 1 -0.018 0.02 A 44 LYS C C 13 176.385 0.3 A 44 LYS CA C 13 58.773 0.3 A 44 LYS CB C 13 32.031 0.3 A 44 LYS CD C 13 29.638 0.3 A 44 LYS CE C 13 41.268 0.3 A 44 LYS CG C 13 23.429 0.3 A 44 LYS N N 15 117.023 0.2 A 45 TRP H H 1 9.364 0.02 A 45 TRP HA H 1 4.447 0.02 A 45 TRP HBy H 1 3.702 0.02 A 45 TRP HBx H 1 3.521 0.02 A 45 TRP HD1 H 1 7.127 0.02 A 45 TRP HE1 H 1 10.239 0.02 A 45 TRP HE3 H 1 7.519 0.02 A 45 TRP HH2 H 1 7.253 0.02 A 45 TRP HZ2 H 1 7.536 0.02 A 45 TRP HZ3 H 1 7.128 0.02 A 45 TRP C C 13 175.675 0.3 A 45 TRP CA C 13 58.021 0.3 A 45 TRP CB C 13 27.995 0.3 A 45 TRP CD1 C 13 127.813 0.3 A 45 TRP CE3 C 13 121.156 0.3 A 45 TRP CH2 C 13 124.820 0.3 A 45 TRP CZ2 C 13 114.626 0.3 A 45 TRP CZ3 C 13 121.933 0.3 A 45 TRP N N 15 117.377 0.2 A 45 TRP NE1 N 15 128.047 0.2 A 46 LYS H H 1 7.985 0.02 A 46 LYS HA H 1 4.390 0.02 A 46 LYS HBy H 1 2.027 0.02 A 46 LYS HBx H 1 1.715 0.02 A 46 LYS HDy H 1 1.852 0.02 A 46 LYS HDx H 1 1.735 0.02 A 46 LYS HEy H 1 3.085 0.02 A 46 LYS HEx H 1 2.969 0.02 A 46 LYS HGx H 1 1.368 0.02 A 46 LYS HGy H 1 1.520 0.02 A 46 LYS C C 13 176.776 0.3 A 46 LYS CA C 13 55.161 0.3 A 46 LYS CB C 13 33.666 0.3 A 46 LYS CD C 13 28.771 0.3 A 46 LYS CE C 13 42.196 0.3 A 46 LYS CG C 13 25.738 0.3 A 46 LYS N N 15 119.913 0.2 A 47 GLN H H 1 8.623 0.02 A 47 GLN HA H 1 4.879 0.02 A 47 GLN HBx H 1 2.108 0.02 A 47 GLN HBy H 1 2.243 0.02 A 47 GLN HE2y H 1 7.953 0.02 A 47 GLN HE2x H 1 6.908 0.02 A 47 GLN HGx H 1 2.589 0.02 A 47 GLN HGy H 1 2.782 0.02 A 47 GLN C C 13 177.118 0.3 A 47 GLN CB C 13 28.555 0.3 A 47 GLN CG C 13 34.472 0.3 A 47 GLN N N 15 121.031 0.2 A 47 GLN NE2 N 15 111.956 0.2 A 48 CYS H H 1 8.365 0.02 A 48 CYS HA H 1 4.756 0.02 A 48 CYS HBy H 1 3.384 0.02 A 48 CYS HBx H 1 2.938 0.02 A 48 CYS C C 13 173.978 0.3 A 48 CYS CB C 13 43.989 0.3 A 48 CYS N N 15 115.456 0.2 A 49 ASP H H 1 7.839 0.02 A 49 ASP HA H 1 4.448 0.02 A 49 ASP HBx H 1 2.544 0.02 A 49 ASP HBy H 1 2.730 0.02 A 49 ASP C C 13 177.773 0.3 A 49 ASP CA C 13 56.988 0.3 A 49 ASP CB C 13 41.080 0.3 A 49 ASP N N 15 123.208 0.2 A 50 GLY H H 1 9.371 0.02 A 50 GLY HAy H 1 4.160 0.02 A 50 GLY HAx H 1 3.886 0.02 A 50 GLY C C 13 173.522 0.3 A 50 GLY CA C 13 46.284 0.3 A 50 GLY N N 15 115.583 0.2 A 51 ARG H H 1 8.199 0.02 A 51 ARG HA H 1 4.658 0.02 A 51 ARG HBx H 1 1.371 0.02 A 51 ARG HBy H 1 2.143 0.02 A 51 ARG HDy H 1 3.199 0.02 A 51 ARG HDx H 1 3.127 0.02 A 51 ARG HGy H 1 1.605 0.02 A 51 ARG HGx H 1 1.382 0.02 A 51 ARG C C 13 176.977 0.3 A 51 ARG CA C 13 54.752 0.3 A 51 ARG CB C 13 31.083 0.3 A 51 ARG CD C 13 43.946 0.3 A 51 ARG CG C 13 26.268 0.3 A 51 ARG N N 15 122.794 0.2 A 52 GLU H H 1 8.992 0.02 A 52 GLU HA H 1 4.074 0.02 A 52 GLU HBx H 1 2.038 0.02 A 52 GLU HBy H 1 2.038 0.02 A 52 GLU HGx H 1 2.577 0.02 A 52 GLU HGy H 1 2.577 0.02 A 52 GLU C C 13 178.254 0.3 A 52 GLU CA C 13 61.230 0.3 A 52 GLU CB C 13 28.808 0.3 A 52 GLU CG C 13 37.417 0.3 A 52 GLU N N 15 117.957 0.2 A 53 ARG H H 1 8.513 0.02 A 53 ARG HA H 1 4.564 0.02 A 53 ARG HBy H 1 2.125 0.02 A 53 ARG HBx H 1 1.711 0.02 A 53 ARG HDy H 1 3.171 0.02 A 53 ARG HDx H 1 3.145 0.02 A 53 ARG HGy H 1 1.665 0.02 A 53 ARG HGx H 1 1.544 0.02 A 53 ARG C C 13 177.327 0.3 A 53 ARG CA C 13 55.480 0.3 A 53 ARG CB C 13 29.265 0.3 A 53 ARG CD C 13 43.208 0.3 A 53 ARG CG C 13 27.321 0.3 A 53 ARG N N 15 116.423 0.2 A 54 ASP H H 1 7.933 0.02 A 54 ASP HA H 1 4.815 0.02 A 54 ASP HBy H 1 3.030 0.02 A 54 ASP HBx H 1 2.877 0.02 A 54 ASP C C 13 176.941 0.3 A 54 ASP CB C 13 40.747 0.3 A 54 ASP N N 15 118.043 0.2 A 55 CYS H H 1 8.222 0.02 A 55 CYS HA H 1 4.977 0.02 A 55 CYS HBx H 1 2.756 0.02 A 55 CYS HBy H 1 2.870 0.02 A 55 CYS C C 13 175.757 0.3 A 55 CYS CA C 13 55.989 0.3 A 55 CYS CB C 13 38.434 0.3 A 55 CYS N N 15 118.999 0.2 A 56 CYS H H 1 8.999 0.02 A 56 CYS HA H 1 4.334 0.02 A 56 CYS HBx H 1 2.415 0.02 A 56 CYS HBy H 1 3.296 0.02 A 56 CYS C C 13 171.957 0.3 A 56 CYS CA C 13 54.491 0.3 A 56 CYS CB C 13 41.013 0.3 A 56 CYS N N 15 121.139 0.2 A 57 ALA H H 1 8.084 0.02 A 57 ALA HA H 1 4.073 0.02 A 57 ALA HB% H 1 1.278 0.02 A 57 ALA C C 13 178.248 0.3 A 57 ALA CA C 13 53.764 0.3 A 57 ALA CB C 13 18.397 0.3 A 57 ALA N N 15 120.553 0.2 A 58 GLY H H 1 8.713 0.02 A 58 GLY HAx H 1 3.581 0.02 A 58 GLY HAy H 1 4.191 0.02 A 58 GLY C C 13 173.204 0.3 A 58 GLY CA C 13 44.758 0.3 A 58 GLY N N 15 110.247 0.2 A 59 LEU H H 1 7.901 0.02 A 59 LEU HA H 1 4.966 0.02 A 59 LEU HBy H 1 2.034 0.02 A 59 LEU HBx H 1 0.887 0.02 A 59 LEU HDx% H 1 0.594 0.02 A 59 LEU HDy% H 1 0.357 0.02 A 59 LEU HG H 1 1.216 0.02 A 59 LEU C C 13 175.349 0.3 A 59 LEU CA C 13 52.445 0.3 A 59 LEU CB C 13 44.484 0.3 A 59 LEU CDy C 13 26.494 0.3 A 59 LEU CDx C 13 22.469 0.3 A 59 LEU CG C 13 26.298 0.3 A 59 LEU N N 15 120.155 0.2 A 60 GLU H H 1 9.145 0.02 A 60 GLU HA H 1 4.679 0.02 A 60 GLU HBx H 1 1.875 0.02 A 60 GLU HBy H 1 1.875 0.02 A 60 GLU HGy H 1 2.184 0.02 A 60 GLU HGx H 1 2.097 0.02 A 60 GLU C C 13 174.016 0.3 A 60 GLU CB C 13 32.595 0.3 A 60 GLU CG C 13 33.983 0.3 A 60 GLU N N 15 117.726 0.2 A 61 CYS H H 1 9.064 0.02 A 61 CYS HA H 1 4.846 0.02 A 61 CYS HBy H 1 3.187 0.02 A 61 CYS HBx H 1 3.020 0.02 A 61 CYS C C 13 173.374 0.3 A 61 CYS CB C 13 39.474 0.3 A 61 CYS N N 15 122.299 0.2 A 62 TRP H H 1 9.434 0.02 A 62 TRP HA H 1 4.898 0.02 A 62 TRP HBy H 1 3.642 0.02 A 62 TRP HBx H 1 3.110 0.02 A 62 TRP HD1 H 1 7.239 0.02 A 62 TRP HE1 H 1 9.993 0.02 A 62 TRP HE3 H 1 7.516 0.02 A 62 TRP HH2 H 1 7.236 0.02 A 62 TRP HZ2 H 1 7.525 0.02 A 62 TRP HZ3 H 1 7.119 0.02 A 62 TRP C C 13 174.430 0.3 A 62 TRP CA C 13 56.466 0.3 A 62 TRP CB C 13 30.985 0.3 A 62 TRP CD1 C 13 126.505 0.3 A 62 TRP CE3 C 13 120.629 0.3 A 62 TRP CH2 C 13 124.474 0.3 A 62 TRP CZ2 C 13 114.668 0.3 A 62 TRP CZ3 C 13 121.620 0.3 A 62 TRP N N 15 135.668 0.2 A 62 TRP NE1 N 15 129.170 0.2 A 63 LYS H H 1 8.392 0.02 A 63 LYS HA H 1 4.347 0.02 A 63 LYS HBy H 1 1.711 0.02 A 63 LYS HBx H 1 1.646 0.02 A 63 LYS HDx H 1 1.618 0.02 A 63 LYS HDy H 1 1.618 0.02 A 63 LYS HEx H 1 2.934 0.02 A 63 LYS HEy H 1 2.934 0.02 A 63 LYS HGx H 1 1.288 0.02 A 63 LYS HGy H 1 1.288 0.02 A 63 LYS C C 13 175.409 0.3 A 63 LYS CA C 13 55.621 0.3 A 63 LYS CB C 13 32.518 0.3 A 63 LYS CD C 13 29.142 0.3 A 63 LYS CE C 13 42.185 0.3 A 63 LYS CG C 13 24.427 0.3 A 63 LYS N N 15 128.624 0.2 A 64 ARG H H 1 7.877 0.02 A 64 ARG HA H 1 3.935 0.02 A 64 ARG HBx H 1 1.408 0.02 A 64 ARG HBy H 1 1.462 0.02 A 64 ARG HDx H 1 2.797 0.02 A 64 ARG HDy H 1 2.797 0.02 A 64 ARG HGy H 1 1.309 0.02 A 64 ARG HGx H 1 0.888 0.02 A 64 ARG C C 13 175.704 0.3 A 64 ARG CA C 13 55.854 0.3 A 64 ARG CB C 13 32.496 0.3 A 64 ARG CD C 13 43.801 0.3 A 64 ARG CG C 13 26.958 0.3 A 64 ARG N N 15 125.507 0.2 A 65 SER H H 1 8.198 0.02 A 65 SER HA H 1 4.306 0.02 A 65 SER HBy H 1 3.883 0.02 A 65 SER HBx H 1 3.858 0.02 A 65 SER C C 13 175.289 0.3 A 65 SER CA C 13 58.778 0.3 A 65 SER CB C 13 63.667 0.3 A 65 SER N N 15 115.709 0.2 A 66 GLY H H 1 8.675 0.02 A 66 GLY HAy H 1 4.002 0.02 A 66 GLY HAx H 1 3.743 0.02 A 66 GLY C C 13 174.634 0.3 A 66 GLY CA C 13 46.080 0.3 A 66 GLY N N 15 110.671 0.2 A 67 ASN H H 1 8.374 0.02 A 67 ASN HA H 1 4.662 0.02 A 67 ASN HBy H 1 2.929 0.02 A 67 ASN HBx H 1 2.832 0.02 A 67 ASN HD2y H 1 7.531 0.02 A 67 ASN HD2x H 1 6.882 0.02 A 67 ASN C C 13 175.108 0.3 A 67 ASN CA C 13 52.755 0.3 A 67 ASN CB C 13 38.500 0.3 A 67 ASN N N 15 118.608 0.2 A 67 ASN ND2 N 15 112.136 0.2 A 68 LYS H H 1 7.816 0.02 A 68 LYS HA H 1 4.330 0.02 A 68 LYS HBy H 1 1.764 0.02 A 68 LYS HBx H 1 1.698 0.02 A 68 LYS HDx H 1 1.603 0.02 A 68 LYS HDy H 1 1.603 0.02 A 68 LYS HEx H 1 2.946 0.02 A 68 LYS HEy H 1 2.946 0.02 A 68 LYS HGy H 1 1.460 0.02 A 68 LYS HGx H 1 1.375 0.02 A 68 LYS C C 13 176.405 0.3 A 68 LYS CA C 13 56.407 0.3 A 68 LYS CB C 13 33.907 0.3 A 68 LYS CD C 13 29.172 0.3 A 68 LYS CE C 13 42.240 0.3 A 68 LYS CG C 13 25.233 0.3 A 68 LYS N N 15 119.218 0.2 A 69 SER H H 1 8.176 0.02 A 69 SER HA H 1 4.615 0.02 A 69 SER HBx H 1 3.916 0.02 A 69 SER HBy H 1 3.916 0.02 A 69 SER C C 13 174.381 0.3 A 69 SER CA C 13 57.773 0.3 A 69 SER CB C 13 64.533 0.3 A 69 SER N N 15 115.165 0.2 A 70 SER H H 1 9.539 0.02 A 70 SER HA H 1 5.011 0.02 A 70 SER HBy H 1 3.712 0.02 A 70 SER HBx H 1 3.447 0.02 A 70 SER C C 13 175.256 0.3 A 70 SER CA C 13 58.455 0.3 A 70 SER CB C 13 63.987 0.3 A 70 SER N N 15 121.583 0.2 A 71 VAL H H 1 8.502 0.02 A 71 VAL HA H 1 5.338 0.02 A 71 VAL HB H 1 1.892 0.02 A 71 VAL HGx% H 1 0.836 0.02 A 71 VAL HGy% H 1 1.125 0.02 A 71 VAL C C 13 176.220 0.3 A 71 VAL CA C 13 58.655 0.3 A 71 VAL CB C 13 37.422 0.3 A 71 VAL CGy C 13 22.047 0.3 A 71 VAL CGx C 13 18.558 0.3 A 71 VAL N N 15 115.977 0.2 A 72 CYS H H 1 8.557 0.02 A 72 CYS HA H 1 5.025 0.02 A 72 CYS HBy H 1 2.855 0.02 A 72 CYS HBx H 1 2.552 0.02 A 72 CYS C C 13 174.142 0.3 A 72 CYS CA C 13 54.465 0.3 A 72 CYS CB C 13 38.458 0.3 A 72 CYS N N 15 120.794 0.2 A 73 ALA H H 1 9.629 0.02 A 73 ALA HA H 1 4.460 0.02 A 73 ALA HB% H 1 1.331 0.02 A 73 ALA CA C 13 49.597 0.3 A 73 ALA CB C 13 21.534 0.3 A 73 ALA N N 15 130.318 0.2 A 74 PRO HA H 1 4.500 0.02 A 74 PRO HBx H 1 1.838 0.02 A 74 PRO HBy H 1 2.166 0.02 A 74 PRO HDy H 1 3.399 0.02 A 74 PRO HDx H 1 2.759 0.02 A 74 PRO HGy H 1 2.049 0.02 A 74 PRO HGx H 1 1.667 0.02 A 74 PRO C C 13 176.504 0.3 A 74 PRO CA C 13 63.219 0.3 A 74 PRO CB C 13 31.903 0.3 A 74 PRO CD C 13 50.312 0.3 A 74 PRO CG C 13 27.598 0.3 A 75 ILE H H 1 7.769 0.02 A 75 ILE HA H 1 3.944 0.02 A 75 ILE HB H 1 1.639 0.02 A 75 ILE HD1% H 1 0.708 0.02 A 75 ILE HG1x H 1 0.904 0.02 A 75 ILE HG1y H 1 1.284 0.02 A 75 ILE HG2% H 1 0.777 0.02 A 75 ILE C C 13 175.793 0.3 A 75 ILE CA C 13 62.346 0.3 A 75 ILE CB C 13 38.969 0.3 A 75 ILE CD1 C 13 13.647 0.3 A 75 ILE CG1 C 13 27.905 0.3 A 75 ILE CG2 C 13 17.465 0.3 A 75 ILE N N 15 122.019 0.2 A 76 THR H H 1 7.683 0.02 A 76 THR HA H 1 4.116 0.02 A 76 THR HB H 1 4.137 0.02 A 76 THR HG2% H 1 1.092 0.02 A 76 THR CA C 13 63.035 0.3 A 76 THR CB C 13 70.801 0.3 A 76 THR CG2 C 13 21.742 0.3 A 76 THR N N 15 122.950 0.2 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin 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 19 CYS H A 20 GLU H 1.0 . 4.54 2 2 A 21 GLY H A 22 LEU H 1.0 . 3.21 3 3 A 3 GLU H A 3 GLU HGx 1.0 . 3.19 4 3 A 3 GLU H A 3 GLU HGy 1.0 . 3.19 5 4 A 3 GLU H A 3 GLU HBx 1.0 . 3.66 6 5 A 3 GLU H A 2 ASN HBy 1.0 . 4.54 7 6 A 3 GLU H A 2 ASN HBx 1.0 . 4.54 8 7 A 4 CYS H A 3 GLU HBy 1.0 . 3.79 9 8 A 4 CYS H A 3 GLU HBx 1.0 . 3.79 10 9 A 4 CYS H A 4 CYS HBy 1.0 . 3.09 11 10 A 4 CYS H A 3 GLU HA 1.0 . 2.59 12 11 A 5 ILE H A 18 CYS HA 1.0 . 3.70 13 12 A 5 ILE H A 4 CYS HBx 1.0 . 3.29 14 13 A 5 ILE H A 5 ILE HB 1.0 . 3.16 15 14 A 6 ARG HBy A 7 LYS H 1.0 . 3.99 16 15 A 7 LYS H A 6 ARG HA 1.0 . 3.37 17 16 A 37 ILE HG2% A 40 PHE H 1.0 . 3.64 18 17 A 42 LEU H A 42 LEU HDy% 1.0 . 3.58 19 18 A 43 VAL H A 43 VAL HGy% 1.0 . 2.61 20 19 A 42 LEU H A 42 LEU HBy 1.0 . 3.32 21 20 A 42 LEU H A 42 LEU HG 1.0 . 3.21 22 21 A 41 CYS H A 41 CYS HBy 1.0 . 3.98 23 22 A 41 CYS H A 40 PHE HA 1.0 . 2.71 24 23 A 40 PHE H A 39 GLY HAy 1.0 . 3.56 25 24 A 40 PHE H A 39 GLY HAx 1.0 . 3.56 26 25 A 39 GLY H A 38 PRO HBx 1.0 . 4.10 27 26 A 39 GLY H A 38 PRO HBy 1.0 . 4.10 28 27 A 39 GLY H A 38 PRO HA 1.0 . 2.73 29 28 A 40 PHE H A 39 GLY H 1.0 . 3.44 30 29 A 41 CYS H A 40 PHE HD% 1.0 . 3.55 31 30 A 40 PHE H A 40 PHE HD% 1.0 . 4.09 32 31 A 42 LEU H A 43 VAL H 1.0 . 4.59 33 32 A 42 LEU H A 41 CYS HBx 1.0 . 3.25 34 33 A 43 VAL H A 46 LYS HGy 1.0 . 3.36 35 34 A 42 LEU H A 55 CYS HA 1.0 . 3.40 36 35 A 50 GLY H A 51 ARG H 1.0 . 3.21 37 36 A 52 GLU H A 53 ARG H 1.0 . 3.38 38 37 A 59 LEU H A 60 GLU H 1.0 . 4.58 39 38 A 60 GLU H A 73 ALA H 1.0 . 3.31 40 39 A 66 GLY H A 67 ASN H 1.0 . 3.30 41 40 A 5 ILE H A 4 CYS HA 1.0 . 3.21 42 41 A 4 CYS H A 3 GLU HGx 1.0 . 3.85 43 41 A 3 GLU HGy A 4 CYS H 1.0 . 3.85 44 42 A 46 LYS HA A 47 GLN H 1.0 . 2.64 45 43 A 47 GLN HBx A 48 CYS H 1.0 . 4.42 46 44 A 48 CYS H A 47 GLN HA 1.0 . 2.92 47 45 A 52 GLU H A 51 ARG HA 1.0 . 3.31 48 46 A 57 ALA H A 57 ALA HB% 1.0 . 2.60 49 47 A 60 GLU H A 59 LEU HA 1.0 . 2.85 50 48 A 60 GLU H A 60 GLU HBx 1.0 . 3.28 51 48 A 60 GLU H A 60 GLU HBy 1.0 . 3.28 52 49 A 60 GLU H A 60 GLU HGy 1.0 . 3.22 53 50 A 31 PHE H A 31 PHE HD% 1.0 . 3.68 54 51 A 74 PRO HA A 75 ILE H 1.0 . 2.79 55 52 A 75 ILE H A 74 PRO HBy 1.0 . 3.51 56 53 A 75 ILE H A 74 PRO HBx 1.0 . 3.71 57 54 A 75 ILE H A 75 ILE HB 1.0 . 3.61 58 55 A 75 ILE H A 75 ILE HG1x 1.0 . 3.14 59 56 A 75 ILE H A 75 ILE HG1y 1.0 . 3.27 60 57 A 75 ILE H A 75 ILE HG2% 1.0 . 3.37 61 58 A 33 VAL HB A 34 CYS H 1.0 . 3.76 62 59 A 37 ILE H A 37 ILE HB 1.0 . 3.64 63 60 A 10 SER H A 10 SER HBy 1.0 . 4.11 64 61 A 31 PHE H A 30 SER HBy 1.0 . 4.48 65 62 A 31 PHE H A 30 SER HBx 1.0 . 4.48 66 63 A 35 VAL H A 35 VAL HB 1.0 . 3.93 67 64 A 43 VAL HB A 44 LYS H 1.0 . 2.90 68 65 A 26 LYS H A 26 LYS HBx 1.0 . 3.80 69 66 A 26 LYS H A 26 LYS HGx 1.0 . 4.27 70 66 A 26 LYS H A 26 LYS HGy 1.0 . 4.27 71 67 A 21 GLY H A 22 LEU HG 1.0 . 4.83 72 68 A 21 GLY H A 22 LEU HBx 1.0 . 4.85 73 69 A 21 GLY H A 37 ILE HD1% 1.0 . 4.01 74 70 A 22 LEU H A 22 LEU HDy% 1.0 . 3.85 75 71 A 22 LEU H A 22 LEU HG 1.0 . 3.36 76 72 A 22 LEU H A 22 LEU HBx 1.0 . 3.43 77 73 A 22 LEU H A 20 GLU HA 1.0 . 3.85 78 74 A 21 GLY H A 22 LEU HDy% 1.0 . 5.26 79 75 A 20 GLU H A 20 GLU HBx 1.0 . 3.05 80 76 A 20 GLU H A 20 GLU HBy 1.0 . 3.05 81 77 A 20 GLU H A 19 CYS HBx 1.0 . 3.66 82 78 A 20 GLU H A 19 CYS HBy 1.0 . 3.11 83 79 A 20 GLU H A 19 CYS HA 1.0 . 2.92 84 80 A 20 GLU H A 21 GLY H 1.0 . 4.51 85 81 A 22 LEU HA A 23 GLU H 1.0 . 3.10 86 82 A 23 GLU H A 35 VAL HGy% 1.0 . 3.23 87 83 A 37 ILE HD1% A 23 GLU H 1.0 . 3.86 88 84 A 23 GLU HA A 24 CYS H 1.0 . 3.22 89 85 A 47 GLN HE2x A 69 SER HBx 1.0 . 4.04 90 85 A 47 GLN HE2x A 69 SER HBy 1.0 . 4.04 91 86 A 47 GLN HE2x A 47 GLN HGy 1.0 . 3.67 92 87 A 62 TRP HA A 62 TRP HE1 1.0 . 4.67 93 88 A 62 TRP HE1 A 64 ARG HDx 1.0 . 4.72 94 88 A 62 TRP HE1 A 64 ARG HDy 1.0 . 4.72 95 89 A 62 TRP H A 62 TRP HBy 1.0 . 3.15 96 90 A 62 TRP H A 62 TRP HBx 1.0 . 3.22 97 91 A 62 TRP H A 71 VAL HGy% 1.0 . 4.60 98 92 A 62 TRP H A 72 CYS HA 1.0 . 3.53 99 93 A 62 TRP H A 62 TRP HE3 1.0 . 5.06 100 94 A 62 TRP H A 71 VAL H 1.0 . 4.64 101 95 A 44 LYS HGy A 45 TRP HE1 1.0 . 4.21 102 96 A 18 CYS H A 18 CYS HBy 1.0 . 3.85 103 97 A 18 CYS H A 18 CYS HBx 1.0 . 3.85 104 98 A 19 CYS H A 18 CYS H 1.0 . 4.58 105 99 A 19 CYS H A 19 CYS HBy 1.0 . 3.74 106 100 A 69 SER H A 68 LYS HBy 1.0 . 3.92 107 101 A 69 SER H A 71 VAL HGx% 1.0 . 4.45 108 102 A 69 SER H A 69 SER HBx 1.0 . 3.04 109 102 A 69 SER HBy A 69 SER H 1.0 . 3.04 110 103 A 69 SER H A 68 LYS HA 1.0 . 2.84 111 104 A 35 VAL HGy% A 25 TYR H 1.0 . 4.41 112 105 A 3 GLU H A 3 GLU HBy 1.0 . 3.66 113 106 A 4 CYS H A 5 ILE H 1.0 . 4.60 114 107 A 5 ILE H A 6 ARG H 1.0 . 4.70 115 108 A 7 LYS H A 6 ARG HGy 1.0 . 4.76 116 109 A 8 TRP H A 9 LEU H 1.0 . 3.98 117 110 A 19 CYS H A 22 LEU HBx 1.0 . 3.81 118 111 A 37 ILE H A 23 GLU H 1.0 . 4.55 119 112 A 26 LYS H A 25 TYR H 1.0 . 4.88 120 113 A 15 LYS H A 15 LYS HBx 1.0 . 3.83 121 113 A 15 LYS H A 15 LYS HBy 1.0 . 3.83 122 114 A 62 TRP H A 61 CYS H 1.0 . 4.27 123 115 A 61 CYS H A 60 GLU HA 1.0 . 3.04 124 116 A 61 CYS H A 61 CYS HBy 1.0 . 3.12 125 117 A 63 LYS H A 64 ARG H 1.0 . 4.13 126 118 A 62 TRP HBy A 63 LYS H 1.0 . 4.42 127 119 A 62 TRP HBx A 63 LYS H 1.0 . 4.00 128 120 A 62 TRP HA A 63 LYS H 1.0 . 2.86 129 121 A 73 ALA H A 62 TRP H 1.0 . 4.36 130 122 A 45 TRP H A 72 CYS H 1.0 . 4.98 131 123 A 44 LYS H A 45 TRP H 1.0 . 3.60 132 124 A 45 TRP H A 45 TRP HD1 1.0 . 4.24 133 125 A 43 VAL HGy% A 45 TRP H 1.0 . 3.71 134 126 A 44 LYS HGy A 45 TRP H 1.0 . 3.85 135 127 A 40 PHE H A 37 ILE HB 1.0 . 4.11 136 128 A 39 GLY H A 40 PHE HBx 1.0 . 4.65 137 129 A 42 LEU H A 41 CYS H 1.0 . 4.59 138 130 A 42 LEU H A 41 CYS HA 1.0 . 3.08 139 131 A 42 LEU H A 43 VAL HGx% 1.0 . 5.11 140 132 A 42 LEU H A 42 LEU HBx 1.0 . 3.91 141 133 A 42 LEU H A 42 LEU HDx% 1.0 . 3.99 142 134 A 43 VAL H A 42 LEU HBx 1.0 . 3.65 143 135 A 43 VAL H A 46 LYS HGx 1.0 . 3.96 144 136 A 45 TRP H A 46 LYS H 1.0 . 3.43 145 137 A 72 CYS H A 46 LYS H 1.0 . 3.59 146 138 A 44 LYS H A 46 LYS H 1.0 . 4.51 147 139 A 43 VAL H A 46 LYS H 1.0 . 4.16 148 140 A 46 LYS H A 44 LYS HA 1.0 . 3.95 149 141 A 46 LYS H A 72 CYS HBy 1.0 . 3.59 150 142 A 46 LYS H A 71 VAL HB 1.0 . 3.93 151 143 A 43 VAL HGy% A 46 LYS H 1.0 . 3.34 152 144 A 46 LYS H A 59 LEU HDx% 1.0 . 5.50 153 145 A 47 GLN H A 48 CYS H 1.0 . 4.78 154 146 A 47 GLN H A 47 GLN HGx 1.0 . 4.48 155 147 A 47 GLN H A 47 GLN HGy 1.0 . 3.34 156 148 A 47 GLN H A 46 LYS HGx 1.0 . 4.29 157 149 A 48 CYS H A 71 VAL HA 1.0 . 3.22 158 150 A 48 CYS H A 49 ASP HA 1.0 . 4.75 159 151 A 48 CYS H A 49 ASP H 1.0 . 3.14 160 152 A 48 CYS H A 48 CYS HBy 1.0 . 3.76 161 153 A 49 ASP H A 69 SER HBx 1.0 . 5.48 162 153 A 69 SER HBy A 49 ASP H 1.0 . 5.48 163 154 A 49 ASP H A 70 SER HBx 1.0 . 4.68 164 155 A 48 CYS H A 48 CYS HBx 1.0 . 3.87 165 156 A 48 CYS H A 47 GLN HGy 1.0 . 4.22 166 157 A 48 CYS H A 47 GLN HGx 1.0 . 3.63 167 158 A 48 CYS H A 47 GLN HBy 1.0 . 3.80 168 159 A 48 CYS H A 71 VAL HB 1.0 . 4.98 169 160 A 48 CYS H A 71 VAL HGx% 1.0 . 3.95 170 161 A 51 ARG H A 49 ASP HA 1.0 . 3.90 171 162 A 51 ARG H A 52 GLU H 1.0 . 3.08 172 163 A 50 GLY H A 52 GLU H 1.0 . 4.16 173 164 A 52 GLU H A 49 ASP HA 1.0 . 5.03 174 165 A 52 GLU H A 61 CYS HBy 1.0 . 5.50 175 166 A 52 GLU H A 48 CYS HBy 1.0 . 5.08 176 167 A 52 GLU H A 52 GLU HBx 1.0 . 2.89 177 167 A 52 GLU H A 52 GLU HBy 1.0 . 2.89 178 168 A 52 GLU H A 52 GLU HGx 1.0 . 3.11 179 168 A 52 GLU H A 52 GLU HGy 1.0 . 3.11 180 169 A 52 GLU H A 51 ARG HBx 1.0 . 4.31 181 170 A 53 ARG H A 52 GLU HBx 1.0 . 3.74 182 170 A 53 ARG H A 52 GLU HBy 1.0 . 3.74 183 171 A 53 ARG H A 52 GLU HGx 1.0 . 3.91 184 171 A 53 ARG H A 52 GLU HGy 1.0 . 3.91 185 172 A 53 ARG HA A 54 ASP H 1.0 . 3.44 186 173 A 42 LEU HDx% A 54 ASP H 1.0 . 3.70 187 174 A 54 ASP H A 55 CYS H 1.0 . 3.14 188 175 A 53 ARG HA A 55 CYS H 1.0 . 3.99 189 176 A 55 CYS H A 55 CYS HBx 1.0 . 3.18 190 177 A 42 LEU HDy% A 55 CYS H 1.0 . 5.13 191 178 A 55 CYS H A 59 LEU HBx 1.0 . 5.50 192 179 A 42 LEU HBy A 55 CYS H 1.0 . 4.71 193 180 A 42 LEU H A 56 CYS H 1.0 . 3.59 194 181 A 55 CYS H A 56 CYS H 1.0 . 4.74 195 182 A 57 ALA H A 56 CYS H 1.0 . 4.57 196 183 A 59 LEU H A 56 CYS H 1.0 . 5.00 197 184 A 55 CYS HA A 56 CYS H 1.0 . 3.05 198 185 A 56 CYS H A 43 VAL HA 1.0 . 4.25 199 186 A 56 CYS H A 56 CYS HBy 1.0 . 3.55 200 187 A 41 CYS HBx A 56 CYS H 1.0 . 3.72 201 188 A 56 CYS H A 56 CYS HBx 1.0 . 3.29 202 189 A 42 LEU HBy A 56 CYS H 1.0 . 3.69 203 190 A 57 ALA H A 56 CYS HBx 1.0 . 3.62 204 191 A 41 CYS HBx A 57 ALA H 1.0 . 4.75 205 192 A 57 ALA H A 56 CYS HBy 1.0 . 2.99 206 193 A 57 ALA H A 56 CYS HA 1.0 . 2.82 207 194 A 57 ALA H A 58 GLY H 1.0 . 4.66 208 195 A 59 LEU H A 74 PRO HA 1.0 . 4.34 209 196 A 59 LEU H A 55 CYS HBx 1.0 . 4.76 210 197 A 59 LEU H A 55 CYS HBy 1.0 . 4.71 211 198 A 60 GLU H A 74 PRO HA 1.0 . 4.30 212 199 A 60 GLU H A 55 CYS HBy 1.0 . 4.34 213 200 A 60 GLU H A 72 CYS HBx 1.0 . 4.21 214 201 A 60 GLU H A 59 LEU HDy% 1.0 . 4.05 215 202 A 60 GLU H A 59 LEU HDx% 1.0 . 4.05 216 203 A 64 ARG H A 65 SER H 1.0 . 4.43 217 204 A 64 ARG H A 70 SER HA 1.0 . 3.49 218 205 A 66 GLY H A 65 SER H 1.0 . 4.52 219 206 A 65 SER H A 64 ARG HGy 1.0 . 4.43 220 207 A 67 ASN H A 65 SER HA 1.0 . 3.65 221 208 A 67 ASN H A 66 GLY HAy 1.0 . 3.53 222 209 A 67 ASN H A 68 LYS H 1.0 . 3.46 223 210 A 69 SER H A 68 LYS H 1.0 . 4.39 224 211 A 69 SER HA A 70 SER H 1.0 . 2.95 225 212 A 70 SER H A 69 SER HBx 1.0 . 3.16 226 212 A 69 SER HBy A 70 SER H 1.0 . 3.16 227 213 A 70 SER H A 70 SER HBx 1.0 . 3.56 228 214 A 49 ASP H A 70 SER H 1.0 . 5.06 229 215 A 69 SER H A 70 SER H 1.0 . 4.58 230 216 A 71 VAL H A 70 SER H 1.0 . 4.74 231 217 A 71 VAL H A 71 VAL HGx% 1.0 . 3.52 232 218 A 71 VAL H A 63 LYS HA 1.0 . 4.34 233 219 A 47 GLN HA A 71 VAL H 1.0 . 4.76 234 220 A 71 VAL H A 70 SER HA 1.0 . 2.89 235 221 A 73 ALA H A 72 CYS H 1.0 . 4.66 236 222 A 72 CYS H A 71 VAL HA 1.0 . 2.87 237 223 A 47 GLN HA A 72 CYS H 1.0 . 4.19 238 224 A 72 CYS H A 45 TRP HA 1.0 . 4.41 239 225 A 72 CYS H A 72 CYS HBy 1.0 . 3.13 240 226 A 72 CYS H A 72 CYS HBx 1.0 . 3.58 241 227 A 72 CYS H A 46 LYS HBy 1.0 . 4.66 242 228 A 72 CYS H A 71 VAL HB 1.0 . 3.02 243 229 A 72 CYS H A 46 LYS HBx 1.0 . 5.25 244 230 A 72 CYS H A 73 ALA HB% 1.0 . 4.97 245 231 A 71 VAL HGy% A 72 CYS H 1.0 . 3.51 246 232 A 71 VAL HGx% A 72 CYS H 1.0 . 3.55 247 233 A 73 ALA H A 59 LEU HBx 1.0 . 4.48 248 234 A 73 ALA H A 59 LEU HDx% 1.0 . 4.58 249 235 A 73 ALA H A 71 VAL HGy% 1.0 . 5.37 250 236 A 73 ALA H A 73 ALA HB% 1.0 . 3.02 251 237 A 73 ALA H A 60 GLU HBx 1.0 . 4.69 252 237 A 73 ALA H A 60 GLU HBy 1.0 . 4.69 253 238 A 73 ALA H A 72 CYS HBx 1.0 . 3.79 254 239 A 73 ALA H A 72 CYS HBy 1.0 . 4.34 255 240 A 73 ALA H A 74 PRO HDx 1.0 . 4.97 256 241 A 73 ALA H A 72 CYS HA 1.0 . 2.79 257 242 A 59 LEU HA A 75 ILE H 1.0 . 4.03 258 243 A 75 ILE HA A 76 THR H 1.0 . 2.67 259 244 A 75 ILE HG2% A 76 THR H 1.0 . 3.55 260 245 A 75 ILE HB A 76 THR H 1.0 . 3.39 261 246 A 75 ILE HG1y A 76 THR H 1.0 . 4.55 262 247 A 23 GLU H A 37 ILE HG1x 1.0 . 5.04 263 248 A 7 LYS H A 8 TRP H 1.0 . 4.76 264 249 A 5 ILE HD1% A 17 ASP H 1.0 . 4.54 265 250 A 18 CYS H A 5 ILE HD1% 1.0 . 4.64 266 251 A 42 LEU HDy% A 41 CYS H 1.0 . 4.38 267 252 A 46 LYS H A 72 CYS HBx 1.0 . 4.57 268 253 A 47 GLN H A 46 LYS H 1.0 . 4.61 269 254 A 48 CYS H A 71 VAL H 1.0 . 4.46 270 255 A 42 LEU HBx A 55 CYS H 1.0 . 5.50 271 256 A 61 CYS H A 52 GLU HA 1.0 . 4.28 272 257 A 71 VAL H A 64 ARG H 1.0 . 4.66 273 258 A 62 TRP HE3 A 71 VAL H 1.0 . 5.13 274 259 A 28 ARG H A 28 ARG HGx 1.0 . 4.33 275 259 A 28 ARG H A 28 ARG HGy 1.0 . 4.33 276 260 A 19 CYS H A 18 CYS HBx 1.0 . 4.10 277 261 A 19 CYS H A 18 CYS HBy 1.0 . 4.10 278 262 A 9 LEU H A 22 LEU HDx% 1.0 . 5.50 279 263 A 33 VAL HB A 9 LEU H 1.0 . 4.55 280 264 A 47 GLN HGy A 70 SER H 1.0 . 5.07 281 265 A 3 GLU H A 2 ASN HA 1.0 . 2.94 282 266 A 5 ILE H A 19 CYS HBx 1.0 . 4.59 283 267 A 33 VAL HB A 11 CYS H 1.0 . 4.13 284 268 A 11 CYS H A 12 VAL H 1.0 . 4.36 285 269 A 7 LYS H A 7 LYS HEx 1.0 . 4.61 286 269 A 7 LYS H A 7 LYS HEy 1.0 . 4.61 287 270 A 7 LYS H A 22 LEU HDx% 1.0 . 3.98 288 271 A 18 CYS H A 17 ASP H 1.0 . 4.16 289 272 A 21 GLY H A 22 LEU HA 1.0 . 5.14 290 273 A 22 LEU H A 37 ILE HD1% 1.0 . 3.38 291 274 A 22 LEU H A 23 GLU H 1.0 . 4.56 292 275 A 22 LEU HG A 23 GLU H 1.0 . 5.40 293 276 A 23 GLU H A 35 VAL HGx% 1.0 . 5.50 294 277 A 23 GLU H A 18 CYS HBx 1.0 . 5.18 295 278 A 23 GLU H A 37 ILE HA 1.0 . 5.50 296 279 A 35 VAL H A 23 GLU H 1.0 . 3.45 297 280 A 23 GLU H A 18 CYS HBy 1.0 . 5.18 298 281 A 23 GLU H A 24 CYS H 1.0 . 4.52 299 282 A 24 CYS H A 24 CYS HBy 1.0 . 3.31 300 283 A 24 CYS H A 24 CYS HBx 1.0 . 3.31 301 284 A 35 VAL HGy% A 24 CYS H 1.0 . 4.80 302 285 A 24 CYS H A 15 LYS HBx 1.0 . 4.51 303 285 A 24 CYS H A 15 LYS HBy 1.0 . 4.51 304 286 A 26 LYS H A 26 LYS HBy 1.0 . 3.80 305 287 A 26 LYS H A 25 TYR HE% 1.0 . 5.50 306 288 A 7 LYS H A 6 ARG H 1.0 . 5.50 307 289 A 27 ARG H A 27 ARG HGx 1.0 . 5.50 308 289 A 27 ARG H A 27 ARG HGy 1.0 . 5.50 309 290 A 28 ARG H A 27 ARG HBx 1.0 . 5.50 310 290 A 28 ARG H A 27 ARG HBy 1.0 . 5.50 311 291 A 28 ARG H A 29 HIS H 1.0 . 5.23 312 292 A 29 HIS H A 28 ARG HBy 1.0 . 4.42 313 293 A 29 HIS H A 28 ARG HBx 1.0 . 4.42 314 294 A 6 ARG H A 5 ILE HG2% 1.0 . 2.87 315 295 A 9 LEU H A 9 LEU HG 1.0 . 5.50 316 296 A 9 LEU H A 9 LEU HBy 1.0 . 3.80 317 297 A 10 SER H A 11 CYS HA 1.0 . 4.53 318 298 A 10 SER H A 9 LEU HBy 1.0 . 3.59 319 299 A 10 SER H A 9 LEU HBx 1.0 . 3.59 320 300 A 10 SER H A 9 LEU HG 1.0 . 4.81 321 301 A 10 SER H A 9 LEU H 1.0 . 4.33 322 302 A 10 SER H A 31 PHE HE% 1.0 . 5.50 323 303 A 17 ASP H A 16 ASN H 1.0 . 4.53 324 304 A 16 ASN H A 15 LYS HBx 1.0 . 4.26 325 304 A 15 LYS HBy A 16 ASN H 1.0 . 4.26 326 305 A 34 CYS H A 33 VAL HGy% 1.0 . 4.03 327 306 A 34 CYS H A 11 CYS HA 1.0 . 4.39 328 307 A 34 CYS H A 9 LEU H 1.0 . 4.29 329 308 A 35 VAL H A 22 LEU HBy 1.0 . 4.52 330 309 A 34 CYS H A 35 VAL H 1.0 . 4.85 331 310 A 37 ILE HG2% A 39 GLY H 1.0 . 4.91 332 311 A 37 ILE H A 22 LEU HA 1.0 . 4.18 333 312 A 37 ILE H A 37 ILE HG1y 1.0 . 3.95 334 313 A 37 ILE H A 37 ILE HG1x 1.0 . 3.73 335 314 A 37 ILE H A 40 PHE HBx 1.0 . 4.81 336 315 A 41 CYS H A 40 PHE HE% 1.0 . 4.08 337 316 A 42 LEU H A 41 CYS HBy 1.0 . 3.60 338 317 A 43 VAL H A 42 LEU HA 1.0 . 2.86 339 318 A 43 VAL H A 55 CYS HA 1.0 . 5.11 340 319 A 43 VAL H A 43 VAL HB 1.0 . 3.86 341 320 A 43 VAL H A 46 LYS HBy 1.0 . 3.93 342 321 A 43 VAL H A 46 LYS HDy 1.0 . 4.48 343 322 A 43 VAL H A 44 LYS H 1.0 . 4.58 344 323 A 43 VAL HGy% A 44 LYS H 1.0 . 3.19 345 324 A 44 LYS H A 45 TRP HA 1.0 . 5.50 346 325 A 44 LYS H A 73 ALA HA 1.0 . 5.50 347 326 A 44 LYS H A 44 LYS HGx 1.0 . 4.13 348 327 A 46 LYS HGy A 47 GLN H 1.0 . 5.18 349 328 A 47 GLN H A 46 LYS HBx 1.0 . 3.01 350 329 A 47 GLN H A 46 LYS HDy 1.0 . 3.69 351 330 A 47 GLN H A 71 VAL HGx% 1.0 . 3.89 352 331 A 48 CYS H A 69 SER HBx 1.0 . 5.49 353 331 A 48 CYS H A 69 SER HBy 1.0 . 5.49 354 332 A 48 CYS H A 72 CYS H 1.0 . 5.50 355 333 A 50 GLY H A 49 ASP H 1.0 . 4.58 356 334 A 71 VAL HA A 49 ASP H 1.0 . 4.42 357 335 A 49 ASP H A 70 SER HBy 1.0 . 4.68 358 336 A 49 ASP H A 49 ASP HBy 1.0 . 3.66 359 337 A 49 ASP H A 49 ASP HBx 1.0 . 3.66 360 338 A 49 ASP H A 47 GLN HBy 1.0 . 4.32 361 339 A 50 GLY H A 49 ASP HA 1.0 . 2.95 362 340 A 50 GLY H A 49 ASP HBx 1.0 . 4.73 363 341 A 51 ARG H A 42 LEU HDx% 1.0 . 4.64 364 342 A 51 ARG H A 52 GLU HBx 1.0 . 4.53 365 342 A 51 ARG H A 52 GLU HBy 1.0 . 4.53 366 343 A 51 ARG H A 51 ARG HBy 1.0 . 3.96 367 344 A 51 ARG H A 48 CYS HBy 1.0 . 4.95 368 345 A 51 ARG H A 52 GLU HA 1.0 . 5.50 369 346 A 52 GLU H A 42 LEU HDx% 1.0 . 4.98 370 347 A 52 GLU H A 51 ARG HBy 1.0 . 4.78 371 348 A 53 ARG H A 54 ASP H 1.0 . 3.16 372 349 A 54 ASP H A 54 ASP HBy 1.0 . 3.21 373 350 A 54 ASP H A 54 ASP HBx 1.0 . 3.21 374 351 A 54 ASP H A 51 ARG HBy 1.0 . 3.62 375 352 A 54 ASP H A 53 ARG HGx 1.0 . 5.13 376 353 A 54 ASP H A 52 GLU HA 1.0 . 4.51 377 354 A 52 GLU H A 54 ASP H 1.0 . 4.77 378 355 A 53 ARG H A 55 CYS H 1.0 . 4.45 379 356 A 41 CYS HA A 56 CYS H 1.0 . 4.88 380 357 A 42 LEU HG A 56 CYS H 1.0 . 4.41 381 358 A 43 VAL H A 56 CYS H 1.0 . 5.12 382 359 A 59 LEU H A 59 LEU HBy 1.0 . 3.31 383 360 A 56 CYS H A 59 LEU HBy 1.0 . 4.06 384 361 A 59 LEU HBx A 56 CYS H 1.0 . 4.17 385 362 A 43 VAL HGx% A 56 CYS H 1.0 . 5.19 386 363 A 59 LEU H A 58 GLY H 1.0 . 3.05 387 364 A 75 ILE H A 75 ILE HD1% 1.0 . 3.71 388 365 A 59 LEU H A 57 ALA HB% 1.0 . 5.50 389 366 A 60 GLU H A 59 LEU HBx 1.0 . 3.09 390 367 A 60 GLU H A 59 LEU HG 1.0 . 5.50 391 368 A 61 CYS H A 52 GLU HGx 1.0 . 5.50 392 368 A 61 CYS H A 52 GLU HGy 1.0 . 5.50 393 369 A 72 CYS HA A 61 CYS H 1.0 . 5.07 394 370 A 62 TRP H A 61 CYS HA 1.0 . 3.10 395 371 A 60 GLU HGy A 61 CYS H 1.0 . 4.48 396 372 A 61 CYS H A 60 GLU HGx 1.0 . 3.86 397 373 A 62 TRP H A 60 GLU HGx 1.0 . 4.92 398 374 A 62 TRP H A 63 LYS H 1.0 . 4.69 399 375 A 62 TRP H A 61 CYS HBy 1.0 . 4.81 400 376 A 62 TRP HE1 A 73 ALA HB% 1.0 . 4.71 401 377 A 65 SER H A 64 ARG HA 1.0 . 2.70 402 378 A 65 SER H A 64 ARG HDx 1.0 . 5.39 403 378 A 64 ARG HDy A 65 SER H 1.0 . 5.39 404 379 A 65 SER H A 64 ARG HGx 1.0 . 4.43 405 380 A 66 GLY H A 67 ASN HA 1.0 . 5.03 406 381 A 47 GLN HGy A 69 SER H 1.0 . 5.34 407 382 A 69 SER H A 68 LYS HDx 1.0 . 4.26 408 382 A 69 SER H A 68 LYS HDy 1.0 . 4.26 409 383 A 31 PHE H A 27 ARG HGx 1.0 . 5.37 410 383 A 31 PHE H A 27 ARG HGy 1.0 . 5.37 411 384 A 40 PHE H A 37 ILE HD1% 1.0 . 5.44 412 385 A 42 LEU HDx% A 49 ASP H 1.0 . 5.50 413 386 A 71 VAL HGx% A 49 ASP H 1.0 . 5.50 414 387 A 62 TRP HBy A 71 VAL H 1.0 . 5.02 415 388 A 72 CYS H A 44 LYS HA 1.0 . 3.98 416 389 A 62 TRP HE3 A 72 CYS H 1.0 . 5.04 417 390 A 68 LYS H A 68 LYS HDx 1.0 . 5.50 418 390 A 68 LYS H A 68 LYS HDy 1.0 . 5.50 419 391 A 64 ARG H A 63 LYS HA 1.0 . 2.78 420 392 A 62 TRP HA A 64 ARG H 1.0 . 5.42 421 393 A 64 ARG H A 64 ARG HDx 1.0 . 4.16 422 393 A 64 ARG HDy A 64 ARG H 1.0 . 4.16 423 394 A 62 TRP HE1 A 63 LYS H 1.0 . 4.68 424 395 A 64 ARG H A 63 LYS HGx 1.0 . 3.84 425 395 A 64 ARG H A 63 LYS HGy 1.0 . 3.84 426 396 A 53 ARG H A 53 ARG HDy 1.0 . 5.50 427 397 A 53 ARG H A 61 CYS HBy 1.0 . 5.50 428 398 A 53 ARG H A 53 ARG HDx 1.0 . 5.50 429 399 A 54 ASP H A 53 ARG HBx 1.0 . 4.64 430 400 A 54 ASP H A 53 ARG HGy 1.0 . 5.13 431 401 A 54 ASP H A 52 GLU HBx 1.0 . 5.19 432 401 A 52 GLU HBy A 54 ASP H 1.0 . 5.19 433 402 A 46 LYS H A 59 LEU HDy% 1.0 . 5.50 434 403 A 46 LYS H A 46 LYS HBy 1.0 . 3.08 435 404 A 46 LYS HGy A 46 LYS H 1.0 . 3.91 436 405 A 46 LYS HGx A 46 LYS H 1.0 . 3.52 437 406 A 46 LYS H A 46 LYS HDy 1.0 . 5.50 438 407 A 45 TRP H A 72 CYS HBx 1.0 . 5.11 439 408 A 45 TRP H A 46 LYS HBy 1.0 . 4.17 440 409 A 5 ILE HD1% A 11 CYS H 1.0 . 5.50 441 410 A 21 GLY H A 40 PHE HE% 1.0 . 3.81 442 411 A 43 VAL HB A 43 VAL HA 1.0 . 2.91 443 412 A 69 SER HA A 69 SER HBx 1.0 . 2.81 444 412 A 69 SER HBy A 69 SER HA 1.0 . 2.81 445 413 A 38 PRO HA A 39 GLY HAy 1.0 . 4.85 446 414 A 38 PRO HA A 39 GLY HAx 1.0 . 4.85 447 415 A 40 PHE HA A 40 PHE HD% 1.0 . 3.31 448 416 A 37 ILE HD1% A 40 PHE HBx 1.0 . 4.52 449 417 A 37 ILE HB A 40 PHE HBx 1.0 . 3.62 450 418 A 40 PHE H A 40 PHE HBx 1.0 . 3.34 451 419 A 40 PHE H A 40 PHE HBy 1.0 . 3.35 452 420 A 40 PHE HD% A 41 CYS HA 1.0 . 5.50 453 421 A 55 CYS HA A 42 LEU HBx 1.0 . 3.72 454 422 A 42 LEU HBy A 55 CYS HA 1.0 . 3.57 455 423 A 46 LYS HBx A 42 LEU HA 1.0 . 4.43 456 424 A 42 LEU HBy A 46 LYS HBx 1.0 . 4.60 457 425 A 43 VAL HA A 42 LEU HA 1.0 . 4.58 458 426 A 44 LYS H A 43 VAL HA 1.0 . 2.99 459 427 A 44 LYS HA A 43 VAL HA 1.0 . 4.51 460 428 A 43 VAL HGx% A 43 VAL HA 1.0 . 2.72 461 429 A 43 VAL HA A 59 LEU HDx% 1.0 . 4.43 462 430 A 43 VAL HB A 59 LEU HDx% 1.0 . 4.84 463 431 A 43 VAL HB A 44 LYS HBx 1.0 . 4.33 464 431 A 43 VAL HB A 44 LYS HBy 1.0 . 4.33 465 432 A 44 LYS HGy A 44 LYS HA 1.0 . 3.65 466 433 A 43 VAL HGy% A 44 LYS HA 1.0 . 4.30 467 434 A 44 LYS HA A 72 CYS HBy 1.0 . 3.81 468 435 A 44 LYS HGx A 44 LYS HBx 1.0 . 2.91 469 435 A 44 LYS HGx A 44 LYS HBy 1.0 . 2.91 470 436 A 44 LYS HA A 73 ALA HA 1.0 . 3.52 471 437 A 73 ALA HA A 44 LYS HBx 1.0 . 4.22 472 437 A 73 ALA HA A 44 LYS HBy 1.0 . 4.22 473 438 A 44 LYS H A 44 LYS HBx 1.0 . 2.89 474 438 A 44 LYS H A 44 LYS HBy 1.0 . 2.89 475 439 A 45 TRP H A 44 LYS HA 1.0 . 3.35 476 440 A 45 TRP HA A 45 TRP HE3 1.0 . 3.19 477 441 A 47 GLN H A 46 LYS HBy 1.0 . 4.24 478 442 A 46 LYS H A 46 LYS HBx 1.0 . 3.67 479 443 A 44 LYS HA A 45 TRP HA 1.0 . 4.64 480 444 A 71 VAL HGx% A 45 TRP HA 1.0 . 3.55 481 445 A 43 VAL HGy% A 46 LYS HBy 1.0 . 3.34 482 446 A 42 LEU HDx% A 46 LYS HBx 1.0 . 4.02 483 447 A 43 VAL HGy% A 46 LYS HBx 1.0 . 4.29 484 448 A 42 LEU HBx A 46 LYS HBx 1.0 . 4.31 485 449 A 37 ILE HG2% A 38 PRO HDx 1.0 . 3.20 486 450 A 42 LEU HG A 40 PHE HZ 1.0 . 4.41 487 451 A 43 VAL HGy% A 46 LYS HEx 1.0 . 4.08 488 452 A 43 VAL HGy% A 43 VAL HA 1.0 . 3.31 489 453 A 43 VAL HGy% A 42 LEU HA 1.0 . 3.90 490 454 A 43 VAL HGx% A 42 LEU HA 1.0 . 3.59 491 455 A 44 LYS H A 43 VAL HGx% 1.0 . 3.47 492 456 A 43 VAL H A 43 VAL HGx% 1.0 . 2.98 493 457 A 64 ARG HA A 64 ARG HGy 1.0 . 3.86 494 458 A 59 LEU H A 59 LEU HG 1.0 . 4.59 495 459 A 44 LYS HGy A 44 LYS HEx 1.0 . 3.48 496 459 A 44 LYS HGy A 44 LYS HEy 1.0 . 3.48 497 460 A 44 LYS HGx A 44 LYS HEx 1.0 . 3.39 498 460 A 44 LYS HGx A 44 LYS HEy 1.0 . 3.39 499 461 A 22 LEU HDy% A 7 LYS HDx 1.0 . 5.50 500 461 A 22 LEU HDy% A 7 LYS HDy 1.0 . 5.50 501 462 A 44 LYS H A 44 LYS HDx 1.0 . 4.46 502 463 A 43 VAL HGy% A 46 LYS HGx 1.0 . 3.08 503 464 A 42 LEU HBx A 46 LYS HGx 1.0 . 4.84 504 465 A 43 VAL HGy% A 46 LYS HGy 1.0 . 3.10 505 466 A 42 LEU HDy% A 46 LYS HDy 1.0 . 3.58 506 467 A 46 LYS HA A 46 LYS HDy 1.0 . 3.71 507 468 A 43 VAL HGy% A 46 LYS HDx 1.0 . 4.23 508 469 A 46 LYS HA A 46 LYS HDx 1.0 . 3.53 509 470 A 47 GLN H A 46 LYS HDx 1.0 . 4.17 510 471 A 43 VAL HGy% A 46 LYS HEy 1.0 . 4.08 511 472 A 46 LYS HA A 47 GLN HBx 1.0 . 4.53 512 473 A 71 VAL HGx% A 47 GLN HBy 1.0 . 4.97 513 474 A 47 GLN HA A 47 GLN HGx 1.0 . 3.84 514 475 A 47 GLN HA A 47 GLN HGy 1.0 . 3.74 515 476 A 47 GLN HGx A 49 ASP H 1.0 . 3.67 516 477 A 47 GLN HGy A 49 ASP H 1.0 . 4.90 517 478 A 47 GLN HGy A 47 GLN HE2y 1.0 . 3.67 518 479 A 61 CYS HBy A 48 CYS HBy 1.0 . 3.92 519 480 A 48 CYS HBx A 52 GLU HA 1.0 . 4.65 520 481 A 49 ASP HA A 50 GLY HAx 1.0 . 4.57 521 482 A 51 ARG HBx A 54 ASP H 1.0 . 4.45 522 483 A 42 LEU HDx% A 51 ARG HBx 1.0 . 3.87 523 484 A 53 ARG HA A 53 ARG HGy 1.0 . 3.60 524 485 A 51 ARG HBy A 51 ARG HDx 1.0 . 3.70 525 486 A 51 ARG HA A 51 ARG HGy 1.0 . 4.02 526 487 A 42 LEU HDx% A 51 ARG HGx 1.0 . 3.86 527 488 A 52 GLU HA A 52 GLU HGx 1.0 . 3.49 528 488 A 52 GLU HGy A 52 GLU HA 1.0 . 3.49 529 489 A 61 CYS HBy A 52 GLU HA 1.0 . 3.50 530 490 A 48 CYS HBy A 52 GLU HA 1.0 . 3.75 531 491 A 52 GLU HBx A 52 GLU HGx 1.0 . 2.62 532 491 A 52 GLU HBy A 52 GLU HGx 1.0 . 2.62 533 491 A 52 GLU HGy A 52 GLU HBx 1.0 . 2.62 534 491 A 52 GLU HBy A 52 GLU HGy 1.0 . 2.62 535 492 A 54 ASP H A 53 ARG HBy 1.0 . 4.64 536 493 A 53 ARG H A 53 ARG HBy 1.0 . 3.82 537 494 A 15 LYS H A 15 LYS HDx 1.0 . 4.58 538 494 A 15 LYS H A 15 LYS HDy 1.0 . 4.58 539 495 A 53 ARG H A 53 ARG HBx 1.0 . 3.82 540 496 A 53 ARG HA A 53 ARG HDy 1.0 . 5.50 541 497 A 53 ARG HA A 53 ARG HDx 1.0 . 5.50 542 498 A 51 ARG HBy A 54 ASP HBy 1.0 . 4.19 543 499 A 42 LEU HDx% A 54 ASP HBy 1.0 . 3.50 544 500 A 42 LEU HBy A 55 CYS HBx 1.0 . 4.48 545 501 A 55 CYS HBx A 59 LEU HBy 1.0 . 3.49 546 502 A 55 CYS HBx A 56 CYS H 1.0 . 3.91 547 503 A 55 CYS HBx A 59 LEU HG 1.0 . 5.05 548 504 A 55 CYS HBx A 59 LEU HBx 1.0 . 3.53 549 505 A 55 CYS H A 55 CYS HBy 1.0 . 3.71 550 506 A 42 LEU HBy A 55 CYS HBy 1.0 . 4.25 551 507 A 41 CYS HBx A 56 CYS HA 1.0 . 3.18 552 508 A 41 CYS HBy A 56 CYS HA 1.0 . 3.18 553 509 A 56 CYS HA A 57 ALA HA 1.0 . 4.36 554 510 A 42 LEU H A 56 CYS HA 1.0 . 4.20 555 511 A 57 ALA HB% A 56 CYS HA 1.0 . 4.34 556 512 A 59 LEU H A 57 ALA HA 1.0 . 3.69 557 513 A 58 GLY H A 57 ALA HA 1.0 . 2.79 558 514 A 57 ALA HB% A 58 GLY H 1.0 . 3.41 559 515 A 57 ALA HB% A 58 GLY HAx 1.0 . 4.43 560 516 A 57 ALA HB% A 56 CYS HBy 1.0 . 3.80 561 517 A 75 ILE HD1% A 58 GLY HAx 1.0 . 4.62 562 518 A 75 ILE HD1% A 58 GLY HAy 1.0 . 4.62 563 519 A 59 LEU HBx A 59 LEU HDy% 1.0 . 3.51 564 520 A 22 LEU HBy A 18 CYS HBx 1.0 . 4.14 565 521 A 55 CYS HBy A 59 LEU HBy 1.0 . 3.13 566 522 A 59 LEU H A 59 LEU HBx 1.0 . 4.02 567 523 A 60 GLU H A 59 LEU HBy 1.0 . 4.16 568 524 A 43 VAL HB A 59 LEU HDy% 1.0 . 4.84 569 525 A 43 VAL HA A 59 LEU HDy% 1.0 . 4.43 570 526 A 44 LYS H A 59 LEU HDx% 1.0 . 3.67 571 527 A 59 LEU H A 59 LEU HDx% 1.0 . 4.06 572 528 A 19 CYS H A 22 LEU HDx% 1.0 . 3.95 573 529 A 8 TRP H A 22 LEU HDx% 1.0 . 4.45 574 530 A 45 TRP H A 59 LEU HDx% 1.0 . 5.10 575 531 A 44 LYS H A 59 LEU HDy% 1.0 . 3.67 576 532 A 59 LEU H A 59 LEU HDy% 1.0 . 4.06 577 533 A 73 ALA H A 59 LEU HDy% 1.0 . 4.58 578 534 A 60 GLU H A 60 GLU HGx 1.0 . 4.24 579 535 A 60 GLU HA A 60 GLU HGx 1.0 . 4.11 580 536 A 52 GLU HA A 61 CYS HBx 1.0 . 4.24 581 537 A 61 CYS H A 61 CYS HBx 1.0 . 3.29 582 538 A 62 TRP H A 61 CYS HBx 1.0 . 4.71 583 539 A 61 CYS HBy A 52 GLU HGx 1.0 . 4.10 584 539 A 61 CYS HBy A 52 GLU HGy 1.0 . 4.10 585 540 A 61 CYS HBy A 52 GLU HBx 1.0 . 3.67 586 540 A 61 CYS HBy A 52 GLU HBy 1.0 . 3.67 587 541 A 62 TRP HBx A 62 TRP HE3 1.0 . 3.40 588 542 A 62 TRP HBy A 62 TRP HE3 1.0 . 3.59 589 543 A 62 TRP HBy A 62 TRP HD1 1.0 . 3.89 590 544 A 62 TRP HBy A 71 VAL HGy% 1.0 . 3.98 591 545 A 62 TRP HBy A 60 GLU HGx 1.0 . 4.39 592 546 A 4 CYS HBy A 3 GLU HA 1.0 . 4.46 593 547 A 63 LYS H A 63 LYS HBx 1.0 . 3.52 594 548 A 64 ARG H A 63 LYS HBx 1.0 . 4.72 595 549 A 63 LYS H A 63 LYS HBy 1.0 . 3.52 596 550 A 64 ARG H A 63 LYS HBy 1.0 . 4.72 597 551 A 63 LYS H A 63 LYS HGx 1.0 . 4.19 598 551 A 63 LYS H A 63 LYS HGy 1.0 . 4.19 599 552 A 63 LYS HA A 63 LYS HGx 1.0 . 3.44 600 552 A 63 LYS HA A 63 LYS HGy 1.0 . 3.44 601 553 A 63 LYS HEy A 63 LYS HGx 1.0 . 3.27 602 553 A 63 LYS HEx A 63 LYS HGx 1.0 . 3.27 603 553 A 63 LYS HGy A 63 LYS HEx 1.0 . 3.27 604 553 A 63 LYS HGy A 63 LYS HEy 1.0 . 3.27 605 554 A 70 SER HA A 63 LYS HA 1.0 . 5.50 606 555 A 63 LYS H A 63 LYS HEx 1.0 . 4.82 607 555 A 63 LYS H A 63 LYS HEy 1.0 . 4.82 608 556 A 26 LYS HA A 26 LYS HDx 1.0 . 4.65 609 556 A 26 LYS HA A 26 LYS HDy 1.0 . 4.65 610 557 A 64 ARG HA A 64 ARG HDx 1.0 . 4.00 611 557 A 64 ARG HDy A 64 ARG HA 1.0 . 4.00 612 558 A 63 LYS HA A 64 ARG HA 1.0 . 4.52 613 559 A 64 ARG H A 64 ARG HBx 1.0 . 3.83 614 560 A 62 TRP HE1 A 64 ARG HA 1.0 . 5.50 615 561 A 62 TRP HZ3 A 64 ARG HDx 1.0 . 3.58 616 561 A 64 ARG HDy A 62 TRP HZ3 1.0 . 3.58 617 562 A 66 GLY H A 65 SER HA 1.0 . 2.97 618 563 A 65 SER HA A 66 GLY HAy 1.0 . 4.50 619 564 A 68 LYS H A 67 ASN HBy 1.0 . 4.20 620 565 A 67 ASN H A 67 ASN HBy 1.0 . 3.74 621 566 A 68 LYS H A 67 ASN HBx 1.0 . 4.20 622 567 A 67 ASN H A 67 ASN HBx 1.0 . 3.74 623 568 A 68 LYS H A 68 LYS HBy 1.0 . 4.02 624 569 A 69 SER H A 68 LYS HBx 1.0 . 3.92 625 570 A 68 LYS HA A 69 SER HBx 1.0 . 4.71 626 570 A 69 SER HBy A 68 LYS HA 1.0 . 4.71 627 571 A 68 LYS H A 68 LYS HGy 1.0 . 4.58 628 572 A 68 LYS HA A 68 LYS HGy 1.0 . 3.88 629 573 A 68 LYS HEy A 68 LYS HGy 1.0 . 3.72 630 573 A 68 LYS HGy A 68 LYS HEx 1.0 . 3.72 631 574 A 68 LYS HEx A 68 LYS HGx 1.0 . 3.72 632 574 A 68 LYS HEy A 68 LYS HGx 1.0 . 3.72 633 575 A 68 LYS HA A 68 LYS HGx 1.0 . 3.88 634 576 A 68 LYS H A 68 LYS HGx 1.0 . 4.58 635 577 A 71 VAL HGx% A 69 SER HBx 1.0 . 3.95 636 577 A 69 SER HBy A 71 VAL HGx% 1.0 . 3.95 637 578 A 47 GLN HBy A 69 SER HBx 1.0 . 4.95 638 578 A 69 SER HBy A 47 GLN HBy 1.0 . 4.95 639 579 A 47 GLN HGx A 69 SER HBx 1.0 . 3.78 640 579 A 69 SER HBy A 47 GLN HGx 1.0 . 3.78 641 580 A 47 GLN HGy A 69 SER HBx 1.0 . 3.49 642 580 A 69 SER HBy A 47 GLN HGy 1.0 . 3.49 643 581 A 47 GLN HE2y A 69 SER HBx 1.0 . 4.04 644 581 A 69 SER HBy A 47 GLN HE2y 1.0 . 4.04 645 582 A 70 SER H A 70 SER HBy 1.0 . 3.56 646 583 A 71 VAL HB A 45 TRP HA 1.0 . 3.52 647 584 A 47 GLN HA A 71 VAL HA 1.0 . 3.31 648 585 A 45 TRP H A 71 VAL HB 1.0 . 5.26 649 586 A 71 VAL HGy% A 64 ARG HDx 1.0 . 3.44 650 586 A 64 ARG HDy A 71 VAL HGy% 1.0 . 3.44 651 587 A 71 VAL HGy% A 64 ARG HA 1.0 . 5.50 652 588 A 71 VAL HGy% A 45 TRP HA 1.0 . 3.99 653 589 A 71 VAL HGy% A 62 TRP HE3 1.0 . 2.91 654 590 A 71 VAL HGy% A 62 TRP HZ3 1.0 . 3.95 655 591 A 71 VAL HGy% A 71 VAL HA 1.0 . 3.62 656 592 A 71 VAL HGy% A 46 LYS H 1.0 . 5.50 657 593 A 71 VAL HGy% A 71 VAL H 1.0 . 3.05 658 594 A 71 VAL HGx% A 47 GLN HGx 1.0 . 4.14 659 595 A 47 GLN HGy A 71 VAL HGx% 1.0 . 3.52 660 596 A 71 VAL HGy% A 63 LYS HA 1.0 . 5.03 661 597 A 46 LYS HA A 71 VAL HGx% 1.0 . 4.04 662 598 A 47 GLN HA A 71 VAL HGx% 1.0 . 3.18 663 599 A 71 VAL HGx% A 70 SER HA 1.0 . 4.16 664 600 A 71 VAL HGx% A 45 TRP HE3 1.0 . 4.28 665 601 A 59 LEU HBx A 72 CYS HBx 1.0 . 3.68 666 602 A 72 CYS HBx A 59 LEU HDx% 1.0 . 4.17 667 603 A 72 CYS HBx A 59 LEU HDy% 1.0 . 4.17 668 604 A 35 VAL HGy% A 34 CYS HA 1.0 . 3.67 669 605 A 62 TRP HBx A 73 ALA HB% 1.0 . 3.27 670 606 A 62 TRP HBy A 73 ALA HB% 1.0 . 3.24 671 607 A 72 CYS HBx A 73 ALA HB% 1.0 . 4.71 672 608 A 73 ALA HB% A 60 GLU HGx 1.0 . 4.14 673 609 A 72 CYS HA A 73 ALA HB% 1.0 . 3.76 674 610 A 62 TRP HA A 73 ALA HB% 1.0 . 3.99 675 611 A 73 ALA HB% A 62 TRP HZ3 1.0 . 3.30 676 612 A 62 TRP HE3 A 73 ALA HA 1.0 . 4.53 677 613 A 62 TRP H A 73 ALA HB% 1.0 . 3.95 678 614 A 60 GLU H A 73 ALA HB% 1.0 . 4.31 679 615 A 62 TRP HE3 A 73 ALA HB% 1.0 . 3.09 680 616 A 44 LYS HGy A 73 ALA HA 1.0 . 5.11 681 617 A 59 LEU HA A 74 PRO HA 1.0 . 3.52 682 618 A 74 PRO HA A 75 ILE HG1x 1.0 . 4.41 683 619 A 74 PRO HA A 59 LEU HBx 1.0 . 5.16 684 620 A 74 PRO HA A 75 ILE HG1y 1.0 . 5.50 685 621 A 75 ILE H A 74 PRO HGy 1.0 . 4.55 686 622 A 74 PRO HDx A 73 ALA HA 1.0 . 3.07 687 623 A 73 ALA HB% A 74 PRO HDx 1.0 . 3.40 688 624 A 75 ILE HA A 76 THR HG2% 1.0 . 4.72 689 625 A 74 PRO HBx A 75 ILE HA 1.0 . 4.93 690 626 A 74 PRO HBy A 75 ILE HG1x 1.0 . 4.91 691 627 A 74 PRO HBy A 75 ILE HG1y 1.0 . 5.03 692 628 A 75 ILE HA A 75 ILE HD1% 1.0 . 4.29 693 629 A 75 ILE HG2% A 75 ILE HA 1.0 . 3.11 694 630 A 75 ILE HG2% A 76 THR HA 1.0 . 5.50 695 631 A 74 PRO HA A 75 ILE HG2% 1.0 . 4.40 696 632 A 76 THR HG2% A 76 THR HA 1.0 . 3.14 697 633 A 76 THR H A 76 THR HB 1.0 . 4.03 698 634 A 35 VAL HGx% A 25 TYR HBx 1.0 . 3.63 699 635 A 35 VAL HGx% A 36 PRO HDx 1.0 . 3.77 700 636 A 35 VAL HGx% A 8 TRP HZ3 1.0 . 3.48 701 637 A 35 VAL HGx% A 8 TRP HE3 1.0 . 4.15 702 638 A 35 VAL HGx% A 8 TRP HZ2 1.0 . 4.50 703 639 A 35 VAL H A 35 VAL HGx% 1.0 . 3.71 704 640 A 8 TRP H A 35 VAL HGx% 1.0 . 4.60 705 641 A 25 TYR H A 35 VAL HGx% 1.0 . 4.86 706 642 A 60 GLU HGy A 73 ALA HB% 1.0 . 4.37 707 643 A 3 GLU HA A 3 GLU HGx 1.0 . 3.34 708 643 A 3 GLU HGy A 3 GLU HA 1.0 . 3.34 709 644 A 4 CYS HBx A 19 CYS HA 1.0 . 3.25 710 645 A 4 CYS H A 4 CYS HBx 1.0 . 3.87 711 646 A 18 CYS HA A 5 ILE HB 1.0 . 3.35 712 647 A 6 ARG H A 5 ILE HA 1.0 . 2.87 713 648 A 5 ILE H A 5 ILE HG2% 1.0 . 3.95 714 649 A 5 ILE H A 19 CYS HA 1.0 . 4.08 715 650 A 21 GLY H A 20 GLU HBx 1.0 . 4.62 716 651 A 40 PHE HZ A 20 GLU HBx 1.0 . 5.50 717 652 A 40 PHE HZ A 20 GLU HBy 1.0 . 5.50 718 653 A 20 GLU HA A 20 GLU HGy 1.0 . 3.71 719 654 A 20 GLU HA A 20 GLU HGx 1.0 . 3.71 720 655 A 40 PHE HD% A 37 ILE HB 1.0 . 4.39 721 656 A 9 LEU H A 9 LEU HBx 1.0 . 3.80 722 657 A 37 ILE HA A 38 PRO HDx 1.0 . 3.35 723 658 A 37 ILE HA A 38 PRO HGy 1.0 . 4.52 724 659 A 37 ILE HA A 38 PRO HGx 1.0 . 4.37 725 660 A 22 LEU HA A 36 PRO HA 1.0 . 3.59 726 661 A 37 ILE H A 36 PRO HA 1.0 . 3.25 727 662 A 22 LEU HDy% A 36 PRO HA 1.0 . 3.07 728 663 A 34 CYS H A 33 VAL HA 1.0 . 3.26 729 664 A 11 CYS H A 33 VAL HA 1.0 . 3.47 730 665 A 37 ILE HG2% A 37 ILE HD1% 1.0 . 5.11 731 666 A 5 ILE HD1% A 17 ASP HBx 1.0 . 4.11 732 667 A 37 ILE HG2% A 40 PHE HD% 1.0 . 4.16 733 668 A 37 ILE HG2% A 37 ILE HA 1.0 . 2.98 734 669 A 42 LEU HDx% A 48 CYS HA 1.0 . 3.60 735 670 A 9 LEU HA A 9 LEU HDy% 1.0 . 3.90 736 671 A 43 VAL H A 42 LEU HDx% 1.0 . 4.56 737 672 A 42 LEU HDx% A 48 CYS HBy 1.0 . 4.34 738 673 A 42 LEU HDx% A 42 LEU HA 1.0 . 4.11 739 674 A 51 ARG HA A 42 LEU HDx% 1.0 . 4.52 740 675 A 73 ALA HA A 44 LYS HGx 1.0 . 4.52 741 676 A 45 TRP H A 44 LYS HGx 1.0 . 4.86 742 677 A 12 VAL HA A 12 VAL HGx% 1.0 . 3.24 743 678 A 26 LYS HEx A 26 LYS HGx 1.0 . 3.46 744 678 A 26 LYS HEy A 26 LYS HGx 1.0 . 3.46 745 678 A 26 LYS HGy A 26 LYS HEx 1.0 . 3.46 746 678 A 26 LYS HGy A 26 LYS HEy 1.0 . 3.46 747 679 A 37 ILE HG1x A 37 ILE HA 1.0 . 3.91 748 680 A 26 LYS H A 26 LYS HDx 1.0 . 4.67 749 680 A 26 LYS H A 26 LYS HDy 1.0 . 4.67 750 681 A 7 LYS HEy A 7 LYS HBy 1.0 . 3.83 751 681 A 7 LYS HBy A 7 LYS HEx 1.0 . 3.83 752 682 A 40 PHE HD% A 21 GLY HAx 1.0 . 3.85 753 683 A 10 SER H A 33 VAL HGy% 1.0 . 4.41 754 684 A 8 TRP HE3 A 33 VAL HGy% 1.0 . 4.29 755 685 A 8 TRP H A 33 VAL HGy% 1.0 . 5.50 756 686 A 33 VAL HB A 8 TRP HA 1.0 . 4.23 757 687 A 22 LEU HDx% A 34 CYS HBy 1.0 . 3.70 758 688 A 34 CYS H A 34 CYS HBy 1.0 . 4.12 759 689 A 6 ARG HBy A 6 ARG HDx 1.0 . 3.33 760 689 A 6 ARG HBy A 6 ARG HDy 1.0 . 3.33 761 690 A 6 ARG HA A 6 ARG HDx 1.0 . 3.70 762 690 A 6 ARG HA A 6 ARG HDy 1.0 . 3.70 763 691 A 6 ARG HA A 7 LYS HBy 1.0 . 4.92 764 692 A 6 ARG HA A 6 ARG HGy 1.0 . 3.54 765 693 A 37 ILE H A 36 PRO HBy 1.0 . 4.26 766 694 A 17 ASP H A 16 ASN HBy 1.0 . 4.37 767 695 A 10 SER H A 10 SER HBx 1.0 . 4.11 768 696 A 40 PHE HD% A 37 ILE HD1% 1.0 . 3.55 769 697 A 37 ILE H A 37 ILE HD1% 1.0 . 3.55 770 698 A 22 LEU HA A 37 ILE HG1x 1.0 . 4.66 771 699 A 37 ILE HD1% A 22 LEU HA 1.0 . 3.82 772 700 A 37 ILE HD1% A 23 GLU HA 1.0 . 4.21 773 701 A 37 ILE HD1% A 37 ILE HA 1.0 . 3.95 774 702 A 37 ILE HD1% A 21 GLY HAy 1.0 . 3.88 775 703 A 37 ILE HD1% A 38 PRO HDx 1.0 . 5.14 776 704 A 37 ILE HD1% A 40 PHE HBy 1.0 . 4.08 777 705 A 37 ILE HB A 37 ILE HD1% 1.0 . 3.14 778 706 A 40 PHE HA A 37 ILE HB 1.0 . 4.06 779 707 A 28 ARG HA A 28 ARG HGx 1.0 . 4.04 780 707 A 28 ARG HGy A 28 ARG HA 1.0 . 4.04 781 708 A 28 ARG H A 28 ARG HDx 1.0 . 4.94 782 708 A 28 ARG H A 28 ARG HDy 1.0 . 4.94 783 709 A 28 ARG HA A 28 ARG HDx 1.0 . 3.93 784 709 A 28 ARG HA A 28 ARG HDy 1.0 . 3.93 785 710 A 44 LYS HGy A 45 TRP HA 1.0 . 4.43 786 711 A 44 LYS H A 44 LYS HGy 1.0 . 3.97 787 712 A 12 VAL HA A 12 VAL HGy% 1.0 . 3.24 788 713 A 40 PHE HZ A 20 GLU HGy 1.0 . 3.82 789 714 A 17 ASP H A 16 ASN HBx 1.0 . 4.37 790 715 A 16 ASN H A 16 ASN HBx 1.0 . 4.21 791 716 A 16 ASN H A 16 ASN HBy 1.0 . 4.21 792 717 A 22 LEU HG A 22 LEU HA 1.0 . 4.07 793 718 A 37 ILE HG1x A 23 GLU HBx 1.0 . 4.66 794 719 A 37 ILE HG1x A 23 GLU HBy 1.0 . 4.66 795 720 A 35 VAL HGx% A 36 PRO HDy 1.0 . 3.45 796 721 A 35 VAL HGy% A 36 PRO HDy 1.0 . 3.88 797 722 A 36 PRO HDy A 7 LYS HDx 1.0 . 4.11 798 722 A 7 LYS HDy A 36 PRO HDy 1.0 . 4.11 799 723 A 36 PRO HDy A 35 VAL HA 1.0 . 3.23 800 724 A 22 LEU HBx A 22 LEU HDy% 1.0 . 3.56 801 725 A 22 LEU HBx A 23 GLU H 1.0 . 4.23 802 726 A 22 LEU HBx A 18 CYS HBy 1.0 . 3.66 803 727 A 22 LEU HBx A 22 LEU HDx% 1.0 . 3.48 804 728 A 37 ILE HG2% A 40 PHE HBx 1.0 . 3.78 805 729 A 37 ILE HG2% A 37 ILE HG1x 1.0 . 3.77 806 730 A 35 VAL HB A 36 PRO HDy 1.0 . 3.60 807 731 A 35 VAL HB A 36 PRO HDx 1.0 . 3.69 808 732 A 35 VAL HGx% A 35 VAL HA 1.0 . 3.22 809 733 A 35 VAL HGy% A 35 VAL HA 1.0 . 3.40 810 734 A 22 LEU HDy% A 35 VAL HA 1.0 . 4.19 811 735 A 35 VAL HGy% A 36 PRO HDx 1.0 . 4.71 812 736 A 53 ARG H A 53 ARG HGx 1.0 . 3.84 813 737 A 53 ARG HA A 53 ARG HGx 1.0 . 3.60 814 738 A 5 ILE HA A 5 ILE HG1y 1.0 . 4.15 815 739 A 35 VAL HGx% A 34 CYS HA 1.0 . 4.04 816 740 A 26 LYS H A 25 TYR HBx 1.0 . 4.27 817 741 A 25 TYR H A 25 TYR HBx 1.0 . 3.80 818 742 A 35 VAL HGy% A 25 TYR HBx 1.0 . 3.53 819 743 A 35 VAL HGx% A 25 TYR HBy 1.0 . 3.63 820 744 A 35 VAL HGy% A 25 TYR HBy 1.0 . 3.53 821 745 A 26 LYS H A 25 TYR HBy 1.0 . 4.27 822 746 A 25 TYR H A 25 TYR HBy 1.0 . 3.80 823 747 A 26 LYS HA A 26 LYS HGx 1.0 . 3.62 824 747 A 26 LYS HGy A 26 LYS HA 1.0 . 3.62 825 748 A 27 ARG HGy A 30 SER HBx 1.0 . 3.94 826 748 A 30 SER HBx A 27 ARG HGx 1.0 . 3.94 827 749 A 27 ARG HGy A 30 SER HBy 1.0 . 3.94 828 749 A 27 ARG HGx A 30 SER HBy 1.0 . 3.94 829 750 A 33 VAL HA A 33 VAL HGx% 1.0 . 3.85 830 751 A 8 TRP HA A 33 VAL HGx% 1.0 . 4.16 831 752 A 8 TRP HE3 A 33 VAL HGx% 1.0 . 4.29 832 753 A 34 CYS H A 33 VAL HGx% 1.0 . 4.03 833 754 A 10 SER H A 33 VAL HGx% 1.0 . 4.41 834 755 A 8 TRP H A 33 VAL HGx% 1.0 . 5.50 835 756 A 5 ILE HD1% A 11 CYS HA 1.0 . 3.32 836 757 A 9 LEU H A 9 LEU HDy% 1.0 . 4.61 837 758 A 6 ARG HBx A 6 ARG HDx 1.0 . 3.40 838 758 A 6 ARG HDy A 6 ARG HBx 1.0 . 3.40 839 759 A 9 LEU H A 9 LEU HDx% 1.0 . 4.61 840 760 A 42 LEU HDy% A 42 LEU HA 1.0 . 2.99 841 761 A 5 ILE HG2% A 5 ILE HA 1.0 . 3.20 842 762 A 18 CYS HA A 5 ILE HG2% 1.0 . 3.68 843 763 A 59 LEU HBx A 55 CYS HBy 1.0 . 3.30 844 764 A 55 CYS HBy A 59 LEU HG 1.0 . 4.04 845 765 A 34 CYS H A 34 CYS HBx 1.0 . 4.12 846 766 A 19 CYS HBy A 22 LEU HBy 1.0 . 4.48 847 767 A 19 CYS HA A 20 GLU HBx 1.0 . 5.20 848 768 A 22 LEU H A 22 LEU HBy 1.0 . 4.03 849 769 A 23 GLU H A 22 LEU HBy 1.0 . 4.17 850 770 A 19 CYS H A 22 LEU HBy 1.0 . 4.40 851 771 A 25 TYR HE% A 27 ARG HA 1.0 . 4.62 852 772 A 37 ILE HG2% A 40 PHE HBy 1.0 . 3.62 853 773 A 48 CYS HBy A 51 ARG HBx 1.0 . 4.92 854 774 A 51 ARG HBy A 51 ARG HDy 1.0 . 3.70 855 775 A 57 ALA HA A 58 GLY HAx 1.0 . 4.60 856 776 A 57 ALA HA A 58 GLY HAy 1.0 . 4.60 857 777 A 63 LYS H A 63 LYS HDx 1.0 . 5.50 858 777 A 63 LYS H A 63 LYS HDy 1.0 . 5.50 859 778 A 47 GLN HBx A 71 VAL HGx% 1.0 . 4.58 860 779 A 15 LYS H A 15 LYS HGy 1.0 . 5.50 861 780 A 15 LYS H A 15 LYS HGx 1.0 . 5.50 862 781 A 28 ARG H A 28 ARG HBx 1.0 . 3.91 863 782 A 28 ARG H A 28 ARG HBy 1.0 . 3.91 864 783 A 34 CYS HA A 24 CYS HA 1.0 . 3.73 865 784 A 5 ILE HD1% A 17 ASP HBy 1.0 . 4.11 866 785 A 45 TRP HE1 A 44 LYS HEx 1.0 . 3.53 867 785 A 45 TRP HE1 A 44 LYS HEy 1.0 . 3.53 868 786 A 37 ILE HG2% A 37 ILE H 1.0 . 3.90 869 787 A 37 ILE HG2% A 22 LEU HA 1.0 . 5.50 870 788 A 37 ILE HG2% A 40 PHE HA 1.0 . 3.79 871 789 A 37 ILE HG2% A 38 PRO HGx 1.0 . 3.52 872 790 A 37 ILE HG2% A 38 PRO HGy 1.0 . 4.20 873 791 A 37 ILE HG1y A 23 GLU HGy 1.0 . 4.05 874 792 A 37 ILE HB A 40 PHE HBy 1.0 . 3.75 875 793 A 41 CYS HBy A 56 CYS H 1.0 . 4.71 876 794 A 42 LEU HDy% A 47 GLN H 1.0 . 5.50 877 795 A 45 TRP H A 44 LYS HBx 1.0 . 3.99 878 795 A 45 TRP H A 44 LYS HBy 1.0 . 3.99 879 796 A 62 TRP HZ3 A 44 LYS HBx 1.0 . 5.03 880 796 A 44 LYS HBy A 62 TRP HZ3 1.0 . 5.03 881 797 A 46 LYS H A 46 LYS HDx 1.0 . 5.33 882 798 A 46 LYS HGy A 46 LYS HA 1.0 . 4.25 883 799 A 47 GLN H A 47 GLN HBy 1.0 . 3.48 884 800 A 51 ARG HA A 51 ARG HGx 1.0 . 4.02 885 801 A 51 ARG HA A 51 ARG HDx 1.0 . 3.96 886 802 A 42 LEU HDx% A 51 ARG HGy 1.0 . 3.86 887 803 A 42 LEU HDx% A 54 ASP HBx 1.0 . 3.50 888 804 A 56 CYS H A 55 CYS HBy 1.0 . 3.87 889 805 A 57 ALA HB% A 58 GLY HAy 1.0 . 4.43 890 806 A 75 ILE HG1x A 58 GLY HAy 1.0 . 4.72 891 807 A 59 LEU HBx A 59 LEU HDx% 1.0 . 3.51 892 808 A 61 CYS HBx A 52 GLU HBx 1.0 . 3.52 893 808 A 52 GLU HBy A 61 CYS HBx 1.0 . 3.52 894 809 A 64 ARG H A 63 LYS HEx 1.0 . 5.25 895 809 A 64 ARG H A 63 LYS HEy 1.0 . 5.25 896 810 A 64 ARG H A 63 LYS HDx 1.0 . 4.10 897 810 A 64 ARG H A 63 LYS HDy 1.0 . 4.10 898 811 A 62 TRP HE3 A 71 VAL HB 1.0 . 4.58 899 812 A 44 LYS HA A 72 CYS HBx 1.0 . 4.24 900 813 A 74 PRO HDx A 44 LYS HGx 1.0 . 4.06 901 814 A 44 LYS HGx A 74 PRO HDy 1.0 . 4.61 902 815 A 74 PRO HA A 75 ILE HA 1.0 . 4.54 903 816 A 28 ARG H A 27 ARG HA 1.0 . 3.32 904 817 A 37 ILE HG1y A 23 GLU HGx 1.0 . 4.05 905 818 A 22 LEU HA A 22 LEU HDx% 1.0 . 3.89 906 819 A 19 CYS H A 19 CYS HBx 1.0 . 3.47 907 820 A 20 GLU HA A 19 CYS HA 1.0 . 4.54 908 821 A 19 CYS HA A 22 LEU HDx% 1.0 . 4.31 909 822 A 15 LYS HBx A 15 LYS HEx 1.0 . 5.50 910 822 A 15 LYS HBy A 15 LYS HEx 1.0 . 5.50 911 822 A 15 LYS HEy A 15 LYS HBx 1.0 . 5.50 912 822 A 15 LYS HBy A 15 LYS HEy 1.0 . 5.50 913 823 A 12 VAL HA A 32 GLU HGy 1.0 . 5.31 914 824 A 12 VAL HA A 32 GLU HGx 1.0 . 5.31 915 825 A 22 LEU HBx A 18 CYS HBx 1.0 . 3.66 916 826 A 37 ILE HG2% A 38 PRO HDy 1.0 . 3.52 917 827 A 37 ILE HD1% A 21 GLY HAx 1.0 . 3.88 918 828 A 4 CYS HBy A 5 ILE H 1.0 . 3.79 919 829 A 26 LYS H A 26 LYS HEx 1.0 . 5.50 920 829 A 26 LYS H A 26 LYS HEy 1.0 . 5.50 921 830 A 69 SER H A 68 LYS HEx 1.0 . 5.50 922 830 A 69 SER H A 68 LYS HEy 1.0 . 5.50 923 831 A 59 LEU HA A 44 LYS HA 1.0 . 5.50 924 832 A 6 ARG HA A 7 LYS HBx 1.0 . 4.92 925 833 A 45 TRP H A 59 LEU HDy% 1.0 . 5.10 926 834 A 23 GLU H A 36 PRO HA 1.0 . 4.51 927 835 A 35 VAL H A 22 LEU HDx% 1.0 . 4.92 928 836 A 1 SER HA A 1 SER HBx 1.0 . 2.63 929 836 A 1 SER HA A 1 SER HBy 1.0 . 2.63 930 837 A 4 CYS HBy A 19 CYS HA 1.0 . 3.35 931 838 A 5 ILE HB A 5 ILE HD1% 1.0 . 3.32 932 839 A 5 ILE HD1% A 5 ILE HA 1.0 . 3.99 933 840 A 6 ARG HBy A 5 ILE HG2% 1.0 . 3.95 934 841 A 5 ILE H A 5 ILE HD1% 1.0 . 3.78 935 842 A 19 CYS H A 5 ILE HD1% 1.0 . 5.31 936 843 A 18 CYS HA A 5 ILE HD1% 1.0 . 3.69 937 844 A 6 ARG HBy A 5 ILE HA 1.0 . 4.85 938 845 A 9 LEU H A 5 ILE HG2% 1.0 . 4.01 939 846 A 10 SER H A 5 ILE HG2% 1.0 . 4.32 940 847 A 6 ARG HA A 6 ARG HGx 1.0 . 3.54 941 848 A 5 ILE HA A 6 ARG HDx 1.0 . 3.88 942 848 A 5 ILE HA A 6 ARG HDy 1.0 . 3.88 943 849 A 6 ARG HBy A 6 ARG H 1.0 . 3.15 944 850 A 7 LYS H A 6 ARG HBx 1.0 . 3.24 945 851 A 7 LYS H A 6 ARG HGx 1.0 . 4.76 946 852 A 6 ARG H A 6 ARG HDx 1.0 . 3.25 947 852 A 6 ARG H A 6 ARG HDy 1.0 . 3.25 948 853 A 9 LEU HG A 9 LEU HA 1.0 . 3.72 949 854 A 9 LEU HA A 9 LEU HDx% 1.0 . 3.90 950 855 A 31 PHE HD% A 10 SER HBx 1.0 . 4.80 951 856 A 22 LEU HDx% A 34 CYS HA 1.0 . 5.08 952 857 A 11 CYS H A 10 SER HBy 1.0 . 4.62 953 858 A 11 CYS H A 10 SER HBx 1.0 . 4.62 954 859 A 12 VAL H A 12 VAL HGx% 1.0 . 3.89 955 860 A 31 PHE HD% A 10 SER HBy 1.0 . 4.80 956 861 A 7 LYS H A 7 LYS HBy 1.0 . 3.56 957 862 A 7 LYS HA A 7 LYS HEx 1.0 . 4.96 958 862 A 7 LYS HEy A 7 LYS HA 1.0 . 4.96 959 863 A 7 LYS HEy A 7 LYS HBx 1.0 . 3.83 960 863 A 7 LYS HBx A 7 LYS HEx 1.0 . 3.83 961 864 A 7 LYS H A 7 LYS HBx 1.0 . 3.56 962 865 A 22 LEU HDx% A 7 LYS HBy 1.0 . 4.23 963 866 A 22 LEU HDx% A 7 LYS HBx 1.0 . 4.23 964 867 A 8 TRP HA A 7 LYS HA 1.0 . 4.43 965 868 A 8 TRP HA A 33 VAL HGy% 1.0 . 4.16 966 869 A 8 TRP HE3 A 8 TRP HA 1.0 . 3.67 967 870 A 45 TRP HD1 A 45 TRP HA 1.0 . 4.52 968 871 A 5 ILE HD1% A 14 ARG HDx 1.0 . 3.83 969 872 A 5 ILE HD1% A 14 ARG HDy 1.0 . 3.83 970 873 A 22 LEU HBy A 18 CYS HBy 1.0 . 4.14 971 874 A 21 GLY H A 20 GLU HA 1.0 . 2.79 972 875 A 21 GLY H A 20 GLU HBy 1.0 . 4.62 973 876 A 20 GLU HA A 40 PHE HZ 1.0 . 5.07 974 877 A 42 LEU HDy% A 20 GLU HA 1.0 . 5.50 975 878 A 19 CYS HA A 20 GLU HBy 1.0 . 5.20 976 879 A 27 ARG HA A 27 ARG HDx 1.0 . 3.93 977 879 A 27 ARG HA A 27 ARG HDy 1.0 . 3.93 978 880 A 27 ARG HA A 27 ARG HGx 1.0 . 3.51 979 880 A 27 ARG HGy A 27 ARG HA 1.0 . 3.51 980 881 A 28 ARG HA A 29 HIS HA 1.0 . 4.82 981 882 A 30 SER H A 30 SER HBy 1.0 . 3.67 982 883 A 30 SER H A 30 SER HBx 1.0 . 3.67 983 884 A 5 ILE HA A 5 ILE HG1x 1.0 . 4.15 984 885 A 5 ILE HD1% A 5 ILE HG2% 1.0 . 5.50 985 886 A 5 ILE HG2% A 9 LEU HG 1.0 . 5.50 986 887 A 8 TRP H A 7 LYS HA 1.0 . 3.33 987 888 A 11 CYS HA A 33 VAL HA 1.0 . 4.27 988 889 A 33 VAL HA A 33 VAL HGy% 1.0 . 3.85 989 890 A 10 SER H A 33 VAL HA 1.0 . 4.66 990 891 A 23 GLU H A 34 CYS HA 1.0 . 4.24 991 892 A 25 TYR H A 34 CYS HA 1.0 . 4.67 992 893 A 35 VAL H A 34 CYS HA 1.0 . 3.00 993 894 A 35 VAL HGy% A 22 LEU HBy 1.0 . 5.50 994 895 A 26 LYS H A 35 VAL HGy% 1.0 . 5.13 995 896 A 35 VAL H A 35 VAL HGy% 1.0 . 3.28 996 897 A 12 VAL H A 12 VAL HGy% 1.0 . 3.89 997 898 A 40 PHE H A 38 PRO HA 1.0 . 4.41 998 899 A 37 ILE HA A 37 ILE HG1y 1.0 . 3.78 999 900 A 37 ILE HG1x A 36 PRO HA 1.0 . 4.12 1000 901 A 37 ILE HD1% A 36 PRO HA 1.0 . 4.56 1001 902 A 22 LEU HBy A 36 PRO HA 1.0 . 4.70 1002 903 A 36 PRO HDx A 35 VAL HA 1.0 . 3.01 1003 904 A 62 TRP HD1 A 64 ARG HDx 1.0 . 4.94 1004 904 A 64 ARG HDy A 62 TRP HD1 1.0 . 4.94 1005 905 A 42 LEU HG A 41 CYS HA 1.0 . 3.63 1006 906 A 42 LEU HBx A 46 LYS HBy 1.0 . 5.50 1007 907 A 46 LYS HGy A 42 LEU HBx 1.0 . 5.50 1008 908 A 42 LEU HG A 42 LEU HA 1.0 . 3.66 1009 909 A 46 LYS HGy A 42 LEU HA 1.0 . 3.98 1010 910 A 42 LEU HG A 41 CYS HBx 1.0 . 4.24 1011 911 A 42 LEU HBy A 42 LEU HDx% 1.0 . 3.38 1012 912 A 42 LEU HDx% A 51 ARG HBy 1.0 . 3.66 1013 913 A 42 LEU HDy% A 40 PHE HZ 1.0 . 2.71 1014 914 A 42 LEU HDy% A 54 ASP HBx 1.0 . 5.50 1015 915 A 42 LEU HDy% A 54 ASP HBy 1.0 . 5.50 1016 916 A 42 LEU HDx% A 55 CYS HBy 1.0 . 5.50 1017 917 A 43 VAL H A 42 LEU HBy 1.0 . 4.52 1018 918 A 43 VAL HA A 44 LYS HBx 1.0 . 4.65 1019 918 A 43 VAL HA A 44 LYS HBy 1.0 . 4.65 1020 919 A 44 LYS HA A 44 LYS HDx 1.0 . 5.50 1021 920 A 44 LYS HA A 44 LYS HDy 1.0 . 5.50 1022 921 A 43 VAL HGx% A 44 LYS HBx 1.0 . 5.46 1023 921 A 43 VAL HGx% A 44 LYS HBy 1.0 . 5.46 1024 922 A 44 LYS H A 44 LYS HEx 1.0 . 4.03 1025 922 A 44 LYS H A 44 LYS HEy 1.0 . 4.03 1026 923 A 44 LYS HBy A 44 LYS HEx 1.0 . 5.50 1027 923 A 44 LYS HEy A 44 LYS HBx 1.0 . 5.50 1028 923 A 44 LYS HBy A 44 LYS HEy 1.0 . 5.50 1029 923 A 44 LYS HBx A 44 LYS HEx 1.0 . 5.50 1030 924 A 44 LYS H A 44 LYS HDy 1.0 . 4.46 1031 925 A 47 GLN H A 47 GLN HBx 1.0 . 3.18 1032 926 A 50 GLY H A 49 ASP HBy 1.0 . 4.73 1033 927 A 49 ASP HA A 50 GLY HAy 1.0 . 4.57 1034 928 A 51 ARG HBy A 54 ASP HBx 1.0 . 4.19 1035 929 A 51 ARG HA A 51 ARG HDy 1.0 . 3.96 1036 930 A 51 ARG H A 52 GLU HGx 1.0 . 4.91 1037 930 A 51 ARG H A 52 GLU HGy 1.0 . 4.91 1038 931 A 51 ARG HBx A 54 ASP HBy 1.0 . 4.22 1039 932 A 51 ARG HBx A 54 ASP HBx 1.0 . 4.22 1040 933 A 43 VAL HA A 56 CYS HBx 1.0 . 4.02 1041 934 A 59 LEU HBx A 56 CYS HBx 1.0 . 4.96 1042 935 A 22 LEU HDy% A 19 CYS HBy 1.0 . 4.23 1043 936 A 19 CYS HBx A 22 LEU HDx% 1.0 . 3.37 1044 937 A 75 ILE HG1x A 58 GLY HAx 1.0 . 4.72 1045 938 A 20 GLU H A 22 LEU HDx% 1.0 . 4.07 1046 939 A 22 LEU HDx% A 34 CYS HBx 1.0 . 3.70 1047 940 A 55 CYS HBy A 59 LEU HDx% 1.0 . 4.09 1048 941 A 22 LEU HDx% A 7 LYS HA 1.0 . 2.91 1049 942 A 22 LEU HDx% A 36 PRO HBy 1.0 . 5.24 1050 943 A 22 LEU HDy% A 22 LEU HA 1.0 . 3.34 1051 944 A 22 LEU HDy% A 23 GLU H 1.0 . 3.71 1052 945 A 37 ILE H A 22 LEU HDy% 1.0 . 3.77 1053 946 A 22 LEU HDy% A 36 PRO HDy 1.0 . 4.23 1054 947 A 22 LEU HDy% A 7 LYS HA 1.0 . 4.05 1055 948 A 22 LEU HDy% A 7 LYS HEx 1.0 . 3.84 1056 948 A 22 LEU HDy% A 7 LYS HEy 1.0 . 3.84 1057 949 A 22 LEU HDy% A 22 LEU HBy 1.0 . 3.45 1058 950 A 22 LEU HDy% A 36 PRO HBx 1.0 . 4.12 1059 951 A 22 LEU HDy% A 36 PRO HBy 1.0 . 3.55 1060 952 A 55 CYS HBy A 59 LEU HDy% 1.0 . 4.09 1061 953 A 60 GLU HA A 60 GLU HBx 1.0 . 2.95 1062 953 A 60 GLU HBy A 60 GLU HA 1.0 . 2.95 1063 954 A 61 CYS H A 60 GLU HBx 1.0 . 5.50 1064 954 A 60 GLU HBy A 61 CYS H 1.0 . 5.50 1065 955 A 65 SER HA A 66 GLY HAx 1.0 . 4.50 1066 956 A 67 ASN H A 66 GLY HAx 1.0 . 3.53 1067 957 A 47 GLN HGy A 71 VAL HA 1.0 . 4.03 1068 958 A 62 TRP HBx A 71 VAL HGy% 1.0 . 3.55 1069 959 A 71 VAL HGx% A 71 VAL HA 1.0 . 3.03 1070 960 A 71 VAL HGy% A 70 SER HA 1.0 . 3.67 1071 961 A 72 CYS HBx A 44 LYS HBx 1.0 . 4.91 1072 961 A 72 CYS HBx A 44 LYS HBy 1.0 . 4.91 1073 962 A 72 CYS HBx A 59 LEU HG 1.0 . 5.11 1074 963 A 73 ALA HA A 74 PRO HGy 1.0 . 4.54 1075 964 A 73 ALA HA A 74 PRO HGx 1.0 . 4.68 1076 965 A 73 ALA HA A 62 TRP HZ3 1.0 . 5.07 1077 966 A 74 PRO HBx A 75 ILE HG1x 1.0 . 3.77 1078 967 A 74 PRO HBx A 76 THR HG2% 1.0 . 4.70 1079 968 A 73 ALA HA A 74 PRO HDy 1.0 . 2.95 1080 969 A 73 ALA HB% A 74 PRO HDy 1.0 . 3.04 1081 970 A 75 ILE HG1y A 75 ILE HA 1.0 . 3.65 1082 971 A 75 ILE HG1x A 75 ILE HA 1.0 . 3.77 1083 972 A 75 ILE HB A 75 ILE HD1% 1.0 . 3.04 1084 973 A 75 ILE HG1x A 75 ILE HG2% 1.0 . 3.31 1085 974 A 59 LEU HA A 75 ILE HG2% 1.0 . 4.91 1086 975 A 76 THR H A 76 THR HG2% 1.0 . 3.57 1087 976 A 68 LYS H A 68 LYS HBx 1.0 . 4.02 1088 977 A 68 LYS HA A 68 LYS HEx 1.0 . 4.58 1089 977 A 68 LYS HA A 68 LYS HEy 1.0 . 4.58 1090 978 A 68 LYS HA A 68 LYS HDx 1.0 . 5.50 1091 978 A 68 LYS HA A 68 LYS HDy 1.0 . 5.50 1092 979 A 63 LYS HA A 63 LYS HEx 1.0 . 5.50 1093 979 A 63 LYS HA A 63 LYS HEy 1.0 . 5.50 1094 980 A 63 LYS HA A 63 LYS HDx 1.0 . 5.50 1095 980 A 63 LYS HA A 63 LYS HDy 1.0 . 5.50 1096 981 A 64 ARG HDy A 64 ARG HBx 1.0 . 3.65 1097 981 A 64 ARG HBx A 64 ARG HDx 1.0 . 3.65 1098 982 A 64 ARG HA A 64 ARG HGx 1.0 . 3.86 1099 983 A 64 ARG HDy A 64 ARG HBy 1.0 . 3.65 1100 983 A 64 ARG HBy A 64 ARG HDx 1.0 . 3.65 1101 984 A 64 ARG H A 64 ARG HBy 1.0 . 3.83 1102 985 A 53 ARG H A 53 ARG HGy 1.0 . 3.84 1103 986 A 43 VAL HGy% A 46 LYS HA 1.0 . 3.76 1104 987 A 46 LYS HA A 46 LYS HGx 1.0 . 3.80 1105 988 A 40 PHE HZ A 20 GLU HGx 1.0 . 3.82 1106 989 A 40 PHE HD% A 21 GLY HAy 1.0 . 3.85 1107 990 A 25 TYR HE% A 27 ARG HGx 1.0 . 4.56 1108 990 A 25 TYR HE% A 27 ARG HGy 1.0 . 4.56 1109 991 A 35 VAL HGy% A 25 TYR HE% 1.0 . 4.96 1110 992 A 63 LYS H A 62 TRP HD1 1.0 . 3.39 1111 993 A 73 ALA HB% A 62 TRP HD1 1.0 . 4.25 1112 994 A 42 LEU HDy% A 40 PHE HE% 1.0 . 3.65 1113 995 A 35 VAL HGx% A 25 TYR HD% 1.0 . 4.17 1114 996 A 25 TYR HD% A 27 ARG HGx 1.0 . 4.14 1115 996 A 27 ARG HGy A 25 TYR HD% 1.0 . 4.14 1116 997 A 26 LYS H A 25 TYR HD% 1.0 . 3.89 1117 998 A 8 TRP HA A 8 TRP HD1 1.0 . 4.58 1118 999 A 35 VAL HGy% A 25 TYR HD% 1.0 . 3.52 1119 1000 A 29 HIS HA A 29 HIS HD2 1.0 . 4.20 1120 1001 A 62 TRP HA A 62 TRP HD1 1.0 . 5.50 1121 1002 A 25 TYR HD% A 25 TYR HA 1.0 . 5.50 1122 1003 A 44 LYS HGy A 45 TRP HD1 1.0 . 2.85 1123 1004 A 45 TRP HD1 A 44 LYS HEx 1.0 . 3.00 1124 1004 A 45 TRP HD1 A 44 LYS HEy 1.0 . 3.00 1125 1005 A 2 ASN HBx A 2 ASN HD2x 1.0 . 3.21 1126 1005 A 2 ASN HBy A 2 ASN HD2x 1.0 . 3.21 1127 1005 A 2 ASN HD2y A 2 ASN HBy 1.0 . 3.21 1128 1005 A 2 ASN HBx A 2 ASN HD2y 1.0 . 3.21 1129 1006 A 3 GLU H A 2 ASN HBy 1.0 . 3.94 1130 1006 A 3 GLU H A 2 ASN HBx 1.0 . 3.94 1131 1007 A 3 GLU H A 3 GLU HBy 1.0 . 2.89 1132 1007 A 3 GLU H A 3 GLU HBx 1.0 . 2.89 1133 1008 A 4 CYS H A 3 GLU HBy 1.0 . 3.27 1134 1008 A 4 CYS H A 3 GLU HBx 1.0 . 3.27 1135 1009 A 5 ILE H A 5 ILE HG1x 1.0 . 3.09 1136 1009 A 5 ILE H A 5 ILE HG1y 1.0 . 3.09 1137 1010 A 5 ILE HA A 5 ILE HG1x 1.0 . 3.53 1138 1010 A 5 ILE HA A 5 ILE HG1y 1.0 . 3.53 1139 1011 A 5 ILE HA A 9 LEU HDy% 1.0 . 4.13 1140 1011 A 5 ILE HA A 9 LEU HDx% 1.0 . 4.13 1141 1012 A 5 ILE HG2% A 9 LEU HBy 1.0 . 2.99 1142 1012 A 5 ILE HG2% A 9 LEU HBx 1.0 . 2.99 1143 1013 A 5 ILE HG2% A 34 CYS HBx 1.0 . 4.05 1144 1013 A 5 ILE HG2% A 34 CYS HBy 1.0 . 4.05 1145 1014 A 6 ARG H A 5 ILE HG1x 1.0 . 4.92 1146 1014 A 6 ARG H A 5 ILE HG1y 1.0 . 4.92 1147 1015 A 5 ILE HD1% A 11 CYS HBy 1.0 . 5.34 1148 1015 A 5 ILE HD1% A 11 CYS HBx 1.0 . 5.34 1149 1016 A 5 ILE HD1% A 14 ARG HDy 1.0 . 3.19 1150 1016 A 5 ILE HD1% A 14 ARG HDx 1.0 . 3.19 1151 1017 A 5 ILE HD1% A 17 ASP HBx 1.0 . 3.32 1152 1017 A 5 ILE HD1% A 17 ASP HBy 1.0 . 3.32 1153 1018 A 6 ARG H A 6 ARG HGy 1.0 . 3.06 1154 1018 A 6 ARG H A 6 ARG HGx 1.0 . 3.06 1155 1019 A 6 ARG H A 9 LEU HBy 1.0 . 4.13 1156 1019 A 6 ARG H A 9 LEU HBx 1.0 . 4.13 1157 1020 A 6 ARG H A 9 LEU HDy% 1.0 . 3.28 1158 1020 A 6 ARG H A 9 LEU HDx% 1.0 . 3.28 1159 1021 A 6 ARG HA A 6 ARG HGy 1.0 . 3.07 1160 1021 A 6 ARG HA A 6 ARG HGx 1.0 . 3.07 1161 1022 A 6 ARG HA A 9 LEU HDy% 1.0 . 4.44 1162 1022 A 6 ARG HA A 9 LEU HDx% 1.0 . 4.44 1163 1023 A 6 ARG HBy A 9 LEU HDy% 1.0 . 3.35 1164 1023 A 6 ARG HBy A 9 LEU HDx% 1.0 . 3.35 1165 1024 A 6 ARG HBx A 9 LEU HDy% 1.0 . 3.65 1166 1024 A 6 ARG HBx A 9 LEU HDx% 1.0 . 3.65 1167 1025 A 7 LYS H A 6 ARG HGy 1.0 . 4.04 1168 1025 A 7 LYS H A 6 ARG HGx 1.0 . 4.04 1169 1026 A 6 ARG HGy A 9 LEU HDy% 1.0 . 3.65 1170 1026 A 6 ARG HGx A 9 LEU HDy% 1.0 . 3.65 1171 1026 A 9 LEU HDx% A 6 ARG HGy 1.0 . 3.65 1172 1026 A 9 LEU HDx% A 6 ARG HGx 1.0 . 3.65 1173 1027 A 6 ARG HDy A 9 LEU HDy% 1.0 . 3.03 1174 1027 A 6 ARG HDx A 9 LEU HDy% 1.0 . 3.03 1175 1027 A 9 LEU HDx% A 6 ARG HDx 1.0 . 3.03 1176 1027 A 6 ARG HDy A 9 LEU HDx% 1.0 . 3.03 1177 1028 A 7 LYS H A 7 LYS HGy 1.0 . 4.35 1178 1028 A 7 LYS H A 7 LYS HGx 1.0 . 4.35 1179 1029 A 7 LYS HA A 34 CYS HBx 1.0 . 5.09 1180 1029 A 7 LYS HA A 34 CYS HBy 1.0 . 5.09 1181 1030 A 7 LYS HBx A 7 LYS HEx 1.0 . 3.36 1182 1030 A 7 LYS HBy A 7 LYS HEx 1.0 . 3.36 1183 1030 A 7 LYS HEy A 7 LYS HBy 1.0 . 3.36 1184 1030 A 7 LYS HEy A 7 LYS HBx 1.0 . 3.36 1185 1031 A 22 LEU HDx% A 7 LYS HBy 1.0 . 3.36 1186 1031 A 22 LEU HDx% A 7 LYS HBx 1.0 . 3.36 1187 1032 A 8 TRP H A 7 LYS HGy 1.0 . 4.65 1188 1032 A 8 TRP H A 7 LYS HGx 1.0 . 4.65 1189 1033 A 9 LEU H A 7 LYS HGy 1.0 . 5.34 1190 1033 A 9 LEU H A 7 LYS HGx 1.0 . 5.34 1191 1034 A 7 LYS HDx A 36 PRO HGy 1.0 . 3.44 1192 1034 A 7 LYS HDy A 36 PRO HGy 1.0 . 3.44 1193 1034 A 36 PRO HGx A 7 LYS HDx 1.0 . 3.44 1194 1034 A 7 LYS HDy A 36 PRO HGx 1.0 . 3.44 1195 1035 A 8 TRP H A 33 VAL HGy% 1.0 . 3.98 1196 1035 A 8 TRP H A 33 VAL HGx% 1.0 . 3.98 1197 1036 A 8 TRP HA A 33 VAL HGy% 1.0 . 3.33 1198 1036 A 8 TRP HA A 33 VAL HGx% 1.0 . 3.33 1199 1037 A 8 TRP HD1 A 8 TRP HBy 1.0 . 3.38 1200 1037 A 8 TRP HD1 A 8 TRP HBx 1.0 . 3.38 1201 1038 A 8 TRP HE1 A 8 TRP HBy 1.0 . 4.66 1202 1038 A 8 TRP HBx A 8 TRP HE1 1.0 . 4.66 1203 1039 A 8 TRP HE3 A 33 VAL HGy% 1.0 . 3.41 1204 1039 A 8 TRP HE3 A 33 VAL HGx% 1.0 . 3.41 1205 1040 A 8 TRP HZ3 A 33 VAL HGy% 1.0 . 5.44 1206 1040 A 8 TRP HZ3 A 33 VAL HGx% 1.0 . 5.44 1207 1041 A 9 LEU H A 9 LEU HBy 1.0 . 3.10 1208 1041 A 9 LEU H A 9 LEU HBx 1.0 . 3.10 1209 1042 A 9 LEU H A 9 LEU HDy% 1.0 . 4.00 1210 1042 A 9 LEU H A 9 LEU HDx% 1.0 . 4.00 1211 1043 A 9 LEU H A 34 CYS HBx 1.0 . 4.12 1212 1043 A 9 LEU H A 34 CYS HBy 1.0 . 4.12 1213 1044 A 9 LEU HA A 9 LEU HDy% 1.0 . 3.11 1214 1044 A 9 LEU HA A 9 LEU HDx% 1.0 . 3.11 1215 1045 A 9 LEU HA A 33 VAL HGy% 1.0 . 4.79 1216 1045 A 9 LEU HA A 33 VAL HGx% 1.0 . 4.79 1217 1046 A 10 SER H A 9 LEU HBy 1.0 . 3.07 1218 1046 A 10 SER H A 9 LEU HBx 1.0 . 3.07 1219 1047 A 9 LEU HBx A 10 SER HBx 1.0 . 5.12 1220 1047 A 9 LEU HBy A 10 SER HBx 1.0 . 5.12 1221 1047 A 10 SER HBy A 9 LEU HBy 1.0 . 5.12 1222 1047 A 9 LEU HBx A 10 SER HBy 1.0 . 5.12 1223 1048 A 10 SER H A 9 LEU HDy% 1.0 . 3.95 1224 1048 A 10 SER H A 9 LEU HDx% 1.0 . 3.95 1225 1049 A 9 LEU HDy% A 10 SER HBx 1.0 . 4.10 1226 1049 A 9 LEU HDx% A 10 SER HBx 1.0 . 4.10 1227 1049 A 10 SER HBy A 9 LEU HDy% 1.0 . 4.10 1228 1049 A 9 LEU HDx% A 10 SER HBy 1.0 . 4.10 1229 1050 A 10 SER H A 10 SER HBx 1.0 . 3.56 1230 1050 A 10 SER H A 10 SER HBy 1.0 . 3.56 1231 1051 A 10 SER H A 33 VAL HGy% 1.0 . 3.77 1232 1051 A 10 SER H A 33 VAL HGx% 1.0 . 3.77 1233 1052 A 11 CYS H A 10 SER HBx 1.0 . 3.82 1234 1052 A 11 CYS H A 10 SER HBy 1.0 . 3.82 1235 1053 A 11 CYS HA A 10 SER HBx 1.0 . 4.62 1236 1053 A 11 CYS HA A 10 SER HBy 1.0 . 4.62 1237 1054 A 31 PHE HD% A 10 SER HBx 1.0 . 4.22 1238 1054 A 31 PHE HD% A 10 SER HBy 1.0 . 4.22 1239 1055 A 10 SER HBy A 33 VAL HGy% 1.0 . 4.06 1240 1055 A 10 SER HBx A 33 VAL HGy% 1.0 . 4.06 1241 1055 A 33 VAL HGx% A 10 SER HBx 1.0 . 4.06 1242 1055 A 33 VAL HGx% A 10 SER HBy 1.0 . 4.06 1243 1056 A 11 CYS H A 12 VAL HGy% 1.0 . 3.80 1244 1056 A 11 CYS H A 12 VAL HGx% 1.0 . 3.80 1245 1057 A 11 CYS H A 33 VAL HGy% 1.0 . 3.68 1246 1057 A 11 CYS H A 33 VAL HGx% 1.0 . 3.68 1247 1058 A 15 LYS HA A 11 CYS HBy 1.0 . 4.41 1248 1058 A 11 CYS HBx A 15 LYS HA 1.0 . 4.41 1249 1059 A 12 VAL H A 12 VAL HGy% 1.0 . 3.07 1250 1059 A 12 VAL H A 12 VAL HGx% 1.0 . 3.07 1251 1060 A 12 VAL HA A 12 VAL HGy% 1.0 . 2.83 1252 1060 A 12 VAL HA A 12 VAL HGx% 1.0 . 2.83 1253 1061 A 12 VAL HA A 32 GLU HGx 1.0 . 4.51 1254 1061 A 12 VAL HA A 32 GLU HGy 1.0 . 4.51 1255 1062 A 31 PHE HA A 12 VAL HGy% 1.0 . 4.02 1256 1062 A 12 VAL HGx% A 31 PHE HA 1.0 . 4.02 1257 1063 A 12 VAL HGx% A 31 PHE HBy 1.0 . 3.56 1258 1063 A 12 VAL HGy% A 31 PHE HBy 1.0 . 3.56 1259 1063 A 31 PHE HBx A 12 VAL HGy% 1.0 . 3.56 1260 1063 A 12 VAL HGx% A 31 PHE HBx 1.0 . 3.56 1261 1064 A 31 PHE HD% A 12 VAL HGy% 1.0 . 3.66 1262 1064 A 31 PHE HD% A 12 VAL HGx% 1.0 . 3.66 1263 1065 A 12 VAL HGx% A 32 GLU HBx 1.0 . 4.70 1264 1065 A 12 VAL HGy% A 32 GLU HBx 1.0 . 4.70 1265 1065 A 32 GLU HBy A 12 VAL HGy% 1.0 . 4.70 1266 1065 A 12 VAL HGx% A 32 GLU HBy 1.0 . 4.70 1267 1066 A 12 VAL HGx% A 32 GLU HGx 1.0 . 3.41 1268 1066 A 12 VAL HGy% A 32 GLU HGx 1.0 . 3.41 1269 1066 A 32 GLU HGy A 12 VAL HGy% 1.0 . 3.41 1270 1066 A 12 VAL HGx% A 32 GLU HGy 1.0 . 3.41 1271 1067 A 15 LYS HA A 24 CYS HBx 1.0 . 4.08 1272 1067 A 15 LYS HA A 24 CYS HBy 1.0 . 4.08 1273 1068 A 15 LYS HBy A 24 CYS HBx 1.0 . 3.67 1274 1068 A 15 LYS HBx A 24 CYS HBx 1.0 . 3.67 1275 1068 A 24 CYS HBy A 15 LYS HBx 1.0 . 3.67 1276 1068 A 15 LYS HBy A 24 CYS HBy 1.0 . 3.67 1277 1069 A 16 ASN H A 16 ASN HBy 1.0 . 3.43 1278 1069 A 16 ASN H A 16 ASN HBx 1.0 . 3.43 1279 1070 A 16 ASN H A 16 ASN HD2x 1.0 . 4.66 1280 1070 A 16 ASN H A 16 ASN HD2y 1.0 . 4.66 1281 1071 A 16 ASN HBx A 16 ASN HD2x 1.0 . 3.10 1282 1071 A 16 ASN HBy A 16 ASN HD2x 1.0 . 3.10 1283 1071 A 16 ASN HD2y A 16 ASN HBy 1.0 . 3.10 1284 1071 A 16 ASN HBx A 16 ASN HD2y 1.0 . 3.10 1285 1072 A 17 ASP H A 16 ASN HBy 1.0 . 3.72 1286 1072 A 17 ASP H A 16 ASN HBx 1.0 . 3.72 1287 1073 A 18 CYS H A 18 CYS HBx 1.0 . 3.28 1288 1073 A 18 CYS H A 18 CYS HBy 1.0 . 3.28 1289 1074 A 19 CYS H A 18 CYS HBx 1.0 . 3.48 1290 1074 A 19 CYS H A 18 CYS HBy 1.0 . 3.48 1291 1075 A 22 LEU H A 18 CYS HBx 1.0 . 4.72 1292 1075 A 22 LEU H A 18 CYS HBy 1.0 . 4.72 1293 1076 A 22 LEU HBx A 18 CYS HBx 1.0 . 3.11 1294 1076 A 22 LEU HBx A 18 CYS HBy 1.0 . 3.11 1295 1077 A 22 LEU HBy A 18 CYS HBx 1.0 . 3.47 1296 1077 A 22 LEU HBy A 18 CYS HBy 1.0 . 3.47 1297 1078 A 22 LEU HDx% A 18 CYS HBx 1.0 . 3.73 1298 1078 A 22 LEU HDx% A 18 CYS HBy 1.0 . 3.73 1299 1079 A 23 GLU H A 18 CYS HBx 1.0 . 4.48 1300 1079 A 23 GLU H A 18 CYS HBy 1.0 . 4.48 1301 1080 A 19 CYS HA A 20 GLU HBy 1.0 . 4.47 1302 1080 A 19 CYS HA A 20 GLU HBx 1.0 . 4.47 1303 1081 A 20 GLU H A 20 GLU HGx 1.0 . 4.46 1304 1081 A 20 GLU H A 20 GLU HGy 1.0 . 4.46 1305 1082 A 20 GLU HA A 20 GLU HGx 1.0 . 3.09 1306 1082 A 20 GLU HA A 20 GLU HGy 1.0 . 3.09 1307 1083 A 20 GLU HA A 21 GLY HAy 1.0 . 4.52 1308 1083 A 20 GLU HA A 21 GLY HAx 1.0 . 4.52 1309 1084 A 21 GLY H A 20 GLU HBy 1.0 . 3.99 1310 1084 A 21 GLY H A 20 GLU HBx 1.0 . 3.99 1311 1085 A 21 GLY H A 20 GLU HGx 1.0 . 3.58 1312 1085 A 21 GLY H A 20 GLU HGy 1.0 . 3.58 1313 1086 A 40 PHE HZ A 20 GLU HGx 1.0 . 3.31 1314 1086 A 40 PHE HZ A 20 GLU HGy 1.0 . 3.31 1315 1087 A 42 LEU HDy% A 20 GLU HGx 1.0 . 4.69 1316 1087 A 42 LEU HDy% A 20 GLU HGy 1.0 . 4.69 1317 1088 A 37 ILE HD1% A 21 GLY HAy 1.0 . 3.01 1318 1088 A 37 ILE HD1% A 21 GLY HAx 1.0 . 3.01 1319 1089 A 40 PHE HZ A 21 GLY HAy 1.0 . 3.97 1320 1089 A 40 PHE HZ A 21 GLY HAx 1.0 . 3.97 1321 1090 A 22 LEU H A 23 GLU HBy 1.0 . 5.34 1322 1090 A 22 LEU H A 23 GLU HBx 1.0 . 5.34 1323 1091 A 22 LEU HBx A 34 CYS HBx 1.0 . 3.65 1324 1091 A 22 LEU HBx A 34 CYS HBy 1.0 . 3.65 1325 1092 A 22 LEU HBy A 34 CYS HBx 1.0 . 3.54 1326 1092 A 22 LEU HBy A 34 CYS HBy 1.0 . 3.54 1327 1093 A 22 LEU HDx% A 34 CYS HBx 1.0 . 2.99 1328 1093 A 22 LEU HDx% A 34 CYS HBy 1.0 . 2.99 1329 1094 A 22 LEU HDy% A 36 PRO HGy 1.0 . 4.33 1330 1094 A 22 LEU HDy% A 36 PRO HGx 1.0 . 4.33 1331 1095 A 23 GLU H A 23 GLU HBy 1.0 . 3.64 1332 1095 A 23 GLU H A 23 GLU HBx 1.0 . 3.64 1333 1096 A 23 GLU H A 23 GLU HGx 1.0 . 3.99 1334 1096 A 23 GLU H A 23 GLU HGy 1.0 . 3.99 1335 1097 A 24 CYS H A 23 GLU HBy 1.0 . 3.18 1336 1097 A 24 CYS H A 23 GLU HBx 1.0 . 3.18 1337 1098 A 35 VAL HGy% A 23 GLU HBy 1.0 . 4.35 1338 1098 A 35 VAL HGy% A 23 GLU HBx 1.0 . 4.35 1339 1099 A 37 ILE H A 23 GLU HBy 1.0 . 5.00 1340 1099 A 37 ILE H A 23 GLU HBx 1.0 . 5.00 1341 1100 A 37 ILE HG1y A 23 GLU HBy 1.0 . 3.24 1342 1100 A 37 ILE HG1y A 23 GLU HBx 1.0 . 3.24 1343 1101 A 37 ILE HG1x A 23 GLU HBy 1.0 . 3.79 1344 1101 A 37 ILE HG1x A 23 GLU HBx 1.0 . 3.79 1345 1102 A 37 ILE HD1% A 23 GLU HBy 1.0 . 3.17 1346 1102 A 37 ILE HD1% A 23 GLU HBx 1.0 . 3.17 1347 1103 A 24 CYS H A 23 GLU HGx 1.0 . 4.38 1348 1103 A 24 CYS H A 23 GLU HGy 1.0 . 4.38 1349 1104 A 35 VAL HGy% A 23 GLU HGx 1.0 . 4.25 1350 1104 A 35 VAL HGy% A 23 GLU HGy 1.0 . 4.25 1351 1105 A 37 ILE HG1y A 23 GLU HGx 1.0 . 3.23 1352 1105 A 37 ILE HG1y A 23 GLU HGy 1.0 . 3.23 1353 1106 A 37 ILE HG1x A 23 GLU HGx 1.0 . 4.19 1354 1106 A 37 ILE HG1x A 23 GLU HGy 1.0 . 4.19 1355 1107 A 37 ILE HD1% A 23 GLU HGx 1.0 . 3.43 1356 1107 A 37 ILE HD1% A 23 GLU HGy 1.0 . 3.43 1357 1108 A 24 CYS H A 24 CYS HBx 1.0 . 2.89 1358 1108 A 24 CYS H A 24 CYS HBy 1.0 . 2.89 1359 1109 A 25 TYR H A 25 TYR HBx 1.0 . 3.31 1360 1109 A 25 TYR H A 25 TYR HBy 1.0 . 3.31 1361 1110 A 25 TYR HA A 26 LYS HBy 1.0 . 4.64 1362 1110 A 25 TYR HA A 26 LYS HBx 1.0 . 4.64 1363 1111 A 26 LYS H A 25 TYR HBx 1.0 . 3.69 1364 1111 A 26 LYS H A 25 TYR HBy 1.0 . 3.69 1365 1112 A 35 VAL HGx% A 25 TYR HBx 1.0 . 3.17 1366 1112 A 35 VAL HGx% A 25 TYR HBy 1.0 . 3.17 1367 1113 A 35 VAL HGy% A 25 TYR HBx 1.0 . 2.88 1368 1113 A 35 VAL HGy% A 25 TYR HBy 1.0 . 2.88 1369 1114 A 26 LYS H A 26 LYS HBy 1.0 . 3.27 1370 1114 A 26 LYS H A 26 LYS HBx 1.0 . 3.27 1371 1115 A 27 ARG HGy A 30 SER HBy 1.0 . 3.36 1372 1115 A 27 ARG HGx A 30 SER HBy 1.0 . 3.36 1373 1115 A 30 SER HBx A 27 ARG HGx 1.0 . 3.36 1374 1115 A 27 ARG HGy A 30 SER HBx 1.0 . 3.36 1375 1116 A 27 ARG HDy A 30 SER HBy 1.0 . 3.69 1376 1116 A 27 ARG HDx A 30 SER HBy 1.0 . 3.69 1377 1116 A 30 SER HBx A 27 ARG HDx 1.0 . 3.69 1378 1116 A 27 ARG HDy A 30 SER HBx 1.0 . 3.69 1379 1117 A 28 ARG H A 28 ARG HBx 1.0 . 3.25 1380 1117 A 28 ARG H A 28 ARG HBy 1.0 . 3.25 1381 1118 A 28 ARG HBy A 28 ARG HDx 1.0 . 3.28 1382 1118 A 28 ARG HBx A 28 ARG HDx 1.0 . 3.28 1383 1118 A 28 ARG HDy A 28 ARG HBx 1.0 . 3.28 1384 1118 A 28 ARG HDy A 28 ARG HBy 1.0 . 3.28 1385 1119 A 29 HIS H A 28 ARG HBx 1.0 . 3.71 1386 1119 A 29 HIS H A 28 ARG HBy 1.0 . 3.71 1387 1120 A 31 PHE H A 30 SER HBy 1.0 . 3.67 1388 1120 A 31 PHE H A 30 SER HBx 1.0 . 3.67 1389 1121 A 31 PHE HBy A 33 VAL HGy% 1.0 . 3.85 1390 1121 A 31 PHE HBx A 33 VAL HGy% 1.0 . 3.85 1391 1121 A 33 VAL HGx% A 31 PHE HBy 1.0 . 3.85 1392 1121 A 33 VAL HGx% A 31 PHE HBx 1.0 . 3.85 1393 1122 A 31 PHE HD% A 33 VAL HGy% 1.0 . 3.05 1394 1122 A 31 PHE HD% A 33 VAL HGx% 1.0 . 3.05 1395 1123 A 31 PHE HE% A 33 VAL HGy% 1.0 . 4.13 1396 1123 A 31 PHE HE% A 33 VAL HGx% 1.0 . 4.13 1397 1124 A 33 VAL HA A 33 VAL HGy% 1.0 . 3.04 1398 1124 A 33 VAL HA A 33 VAL HGx% 1.0 . 3.04 1399 1125 A 33 VAL HGx% A 34 CYS HBx 1.0 . 3.87 1400 1125 A 33 VAL HGy% A 34 CYS HBx 1.0 . 3.87 1401 1125 A 34 CYS HBy A 33 VAL HGy% 1.0 . 3.87 1402 1125 A 34 CYS HBy A 33 VAL HGx% 1.0 . 3.87 1403 1126 A 35 VAL HGx% A 33 VAL HGy% 1.0 . 3.42 1404 1126 A 35 VAL HGx% A 33 VAL HGx% 1.0 . 3.42 1405 1127 A 34 CYS H A 34 CYS HBx 1.0 . 3.47 1406 1127 A 34 CYS H A 34 CYS HBy 1.0 . 3.47 1407 1128 A 35 VAL H A 34 CYS HBx 1.0 . 4.21 1408 1128 A 35 VAL H A 34 CYS HBy 1.0 . 4.21 1409 1129 A 35 VAL HGx% A 36 PRO HGy 1.0 . 4.78 1410 1129 A 35 VAL HGx% A 36 PRO HGx 1.0 . 4.78 1411 1130 A 38 PRO HA A 39 GLY HAx 1.0 . 4.10 1412 1130 A 38 PRO HA A 39 GLY HAy 1.0 . 4.10 1413 1131 A 39 GLY H A 38 PRO HBx 1.0 . 3.46 1414 1131 A 39 GLY H A 38 PRO HBy 1.0 . 3.46 1415 1132 A 40 PHE H A 38 PRO HBx 1.0 . 5.05 1416 1132 A 40 PHE H A 38 PRO HBy 1.0 . 5.05 1417 1133 A 40 PHE HA A 39 GLY HAx 1.0 . 5.17 1418 1133 A 40 PHE HA A 39 GLY HAy 1.0 . 5.17 1419 1134 A 42 LEU HA A 59 LEU HDy% 1.0 . 4.48 1420 1134 A 42 LEU HA A 59 LEU HDx% 1.0 . 4.48 1421 1135 A 42 LEU HDx% A 51 ARG HGy 1.0 . 3.31 1422 1135 A 42 LEU HDx% A 51 ARG HGx 1.0 . 3.31 1423 1136 A 42 LEU HDx% A 51 ARG HDy 1.0 . 3.84 1424 1136 A 42 LEU HDx% A 51 ARG HDx 1.0 . 3.84 1425 1137 A 42 LEU HDy% A 46 LYS HEx 1.0 . 3.55 1426 1137 A 42 LEU HDy% A 46 LYS HEy 1.0 . 3.55 1427 1138 A 42 LEU HDy% A 51 ARG HDy 1.0 . 5.34 1428 1138 A 42 LEU HDy% A 51 ARG HDx 1.0 . 5.34 1429 1139 A 43 VAL H A 46 LYS HEx 1.0 . 4.17 1430 1139 A 43 VAL H A 46 LYS HEy 1.0 . 4.17 1431 1140 A 43 VAL HA A 59 LEU HDy% 1.0 . 3.12 1432 1140 A 43 VAL HA A 59 LEU HDx% 1.0 . 3.12 1433 1141 A 43 VAL HB A 59 LEU HDy% 1.0 . 3.86 1434 1141 A 43 VAL HB A 59 LEU HDx% 1.0 . 3.86 1435 1142 A 43 VAL HGx% A 46 LYS HEx 1.0 . 4.71 1436 1142 A 43 VAL HGx% A 46 LYS HEy 1.0 . 4.71 1437 1143 A 43 VAL HGy% A 46 LYS HEx 1.0 . 3.36 1438 1143 A 43 VAL HGy% A 46 LYS HEy 1.0 . 3.36 1439 1144 A 44 LYS H A 44 LYS HDx 1.0 . 3.59 1440 1144 A 44 LYS H A 44 LYS HDy 1.0 . 3.59 1441 1145 A 44 LYS H A 59 LEU HDy% 1.0 . 3.01 1442 1145 A 44 LYS H A 59 LEU HDx% 1.0 . 3.01 1443 1146 A 44 LYS HA A 59 LEU HDy% 1.0 . 3.40 1444 1146 A 44 LYS HA A 59 LEU HDx% 1.0 . 3.40 1445 1147 A 44 LYS HBy A 59 LEU HDy% 1.0 . 3.34 1446 1147 A 44 LYS HBx A 59 LEU HDy% 1.0 . 3.34 1447 1147 A 59 LEU HDx% A 44 LYS HBx 1.0 . 3.34 1448 1147 A 44 LYS HBy A 59 LEU HDx% 1.0 . 3.34 1449 1148 A 44 LYS HGy A 59 LEU HDy% 1.0 . 4.70 1450 1148 A 44 LYS HGy A 59 LEU HDx% 1.0 . 4.70 1451 1149 A 45 TRP HD1 A 44 LYS HDx 1.0 . 4.11 1452 1149 A 45 TRP HD1 A 44 LYS HDy 1.0 . 4.11 1453 1150 A 45 TRP HE1 A 44 LYS HDx 1.0 . 4.07 1454 1150 A 45 TRP HE1 A 44 LYS HDy 1.0 . 4.07 1455 1151 A 44 LYS HDx A 59 LEU HDy% 1.0 . 4.85 1456 1151 A 44 LYS HDy A 59 LEU HDy% 1.0 . 4.85 1457 1151 A 59 LEU HDx% A 44 LYS HDx 1.0 . 4.85 1458 1151 A 59 LEU HDx% A 44 LYS HDy 1.0 . 4.85 1459 1152 A 73 ALA HA A 44 LYS HDx 1.0 . 5.07 1460 1152 A 73 ALA HA A 44 LYS HDy 1.0 . 5.07 1461 1153 A 74 PRO HGx A 44 LYS HDx 1.0 . 3.78 1462 1153 A 74 PRO HGx A 44 LYS HDy 1.0 . 3.78 1463 1154 A 44 LYS HEy A 59 LEU HDy% 1.0 . 5.44 1464 1154 A 44 LYS HEx A 59 LEU HDy% 1.0 . 5.44 1465 1154 A 59 LEU HDx% A 44 LYS HEx 1.0 . 5.44 1466 1154 A 44 LYS HEy A 59 LEU HDx% 1.0 . 5.44 1467 1155 A 46 LYS H A 59 LEU HDy% 1.0 . 4.48 1468 1155 A 46 LYS H A 59 LEU HDx% 1.0 . 4.48 1469 1156 A 46 LYS HA A 46 LYS HEx 1.0 . 4.76 1470 1156 A 46 LYS HA A 46 LYS HEy 1.0 . 4.76 1471 1157 A 46 LYS HGx A 46 LYS HEx 1.0 . 3.51 1472 1157 A 46 LYS HGx A 46 LYS HEy 1.0 . 3.51 1473 1158 A 46 LYS HGy A 46 LYS HEx 1.0 . 3.50 1474 1158 A 46 LYS HGy A 46 LYS HEy 1.0 . 3.50 1475 1159 A 47 GLN HGx A 47 GLN HE2y 1.0 . 3.51 1476 1159 A 47 GLN HE2x A 47 GLN HGx 1.0 . 3.51 1477 1160 A 47 GLN HGy A 47 GLN HE2y 1.0 . 3.21 1478 1160 A 47 GLN HE2x A 47 GLN HGy 1.0 . 3.21 1479 1161 A 69 SER H A 47 GLN HE2y 1.0 . 4.34 1480 1161 A 47 GLN HE2x A 69 SER H 1.0 . 4.34 1481 1162 A 69 SER HBy A 47 GLN HE2y 1.0 . 3.41 1482 1162 A 47 GLN HE2y A 69 SER HBx 1.0 . 3.41 1483 1162 A 47 GLN HE2x A 69 SER HBy 1.0 . 3.41 1484 1162 A 47 GLN HE2x A 69 SER HBx 1.0 . 3.41 1485 1163 A 48 CYS H A 70 SER HBy 1.0 . 4.38 1486 1163 A 48 CYS H A 70 SER HBx 1.0 . 4.38 1487 1164 A 49 ASP H A 49 ASP HBy 1.0 . 2.96 1488 1164 A 49 ASP H A 49 ASP HBx 1.0 . 2.96 1489 1165 A 50 GLY H A 49 ASP HBy 1.0 . 3.97 1490 1165 A 50 GLY H A 49 ASP HBx 1.0 . 3.97 1491 1166 A 49 ASP HBx A 50 GLY HAx 1.0 . 4.49 1492 1166 A 49 ASP HBy A 50 GLY HAx 1.0 . 4.49 1493 1166 A 50 GLY HAy A 49 ASP HBy 1.0 . 4.49 1494 1166 A 49 ASP HBx A 50 GLY HAy 1.0 . 4.49 1495 1167 A 51 ARG H A 51 ARG HGy 1.0 . 3.55 1496 1167 A 51 ARG H A 51 ARG HGx 1.0 . 3.55 1497 1168 A 51 ARG H A 51 ARG HDy 1.0 . 4.34 1498 1168 A 51 ARG H A 51 ARG HDx 1.0 . 4.34 1499 1169 A 51 ARG H A 54 ASP HBx 1.0 . 5.11 1500 1169 A 51 ARG H A 54 ASP HBy 1.0 . 5.11 1501 1170 A 51 ARG HA A 51 ARG HDy 1.0 . 3.47 1502 1170 A 51 ARG HA A 51 ARG HDx 1.0 . 3.47 1503 1171 A 51 ARG HBx A 54 ASP HBx 1.0 . 3.67 1504 1171 A 51 ARG HBx A 54 ASP HBy 1.0 . 3.67 1505 1172 A 51 ARG HBy A 51 ARG HDy 1.0 . 3.18 1506 1172 A 51 ARG HBy A 51 ARG HDx 1.0 . 3.18 1507 1173 A 51 ARG HBy A 54 ASP HBx 1.0 . 3.62 1508 1173 A 51 ARG HBy A 54 ASP HBy 1.0 . 3.62 1509 1174 A 52 GLU H A 51 ARG HGy 1.0 . 4.75 1510 1174 A 52 GLU H A 51 ARG HGx 1.0 . 4.75 1511 1175 A 51 ARG HGx A 54 ASP HBx 1.0 . 4.45 1512 1175 A 54 ASP HBy A 51 ARG HGy 1.0 . 4.45 1513 1175 A 51 ARG HGx A 54 ASP HBy 1.0 . 4.45 1514 1175 A 51 ARG HGy A 54 ASP HBx 1.0 . 4.45 1515 1176 A 52 GLU H A 51 ARG HDy 1.0 . 5.14 1516 1176 A 52 GLU H A 51 ARG HDx 1.0 . 5.14 1517 1177 A 52 GLU HGx A 53 ARG HGy 1.0 . 3.92 1518 1177 A 52 GLU HGy A 53 ARG HGy 1.0 . 3.92 1519 1177 A 53 ARG HGx A 52 GLU HGx 1.0 . 3.92 1520 1177 A 52 GLU HGy A 53 ARG HGx 1.0 . 3.92 1521 1178 A 52 GLU HGx A 53 ARG HDy 1.0 . 4.37 1522 1178 A 52 GLU HGy A 53 ARG HDy 1.0 . 4.37 1523 1178 A 53 ARG HDx A 52 GLU HGx 1.0 . 4.37 1524 1178 A 52 GLU HGy A 53 ARG HDx 1.0 . 4.37 1525 1179 A 53 ARG H A 53 ARG HBx 1.0 . 3.24 1526 1179 A 53 ARG H A 53 ARG HBy 1.0 . 3.24 1527 1180 A 53 ARG H A 53 ARG HGy 1.0 . 3.35 1528 1180 A 53 ARG H A 53 ARG HGx 1.0 . 3.35 1529 1181 A 53 ARG HA A 53 ARG HGy 1.0 . 3.00 1530 1181 A 53 ARG HA A 53 ARG HGx 1.0 . 3.00 1531 1182 A 53 ARG HA A 53 ARG HDy 1.0 . 4.77 1532 1182 A 53 ARG HA A 53 ARG HDx 1.0 . 4.77 1533 1183 A 54 ASP H A 53 ARG HBx 1.0 . 3.96 1534 1183 A 54 ASP H A 53 ARG HBy 1.0 . 3.96 1535 1184 A 54 ASP H A 53 ARG HGy 1.0 . 4.46 1536 1184 A 54 ASP H A 53 ARG HGx 1.0 . 4.46 1537 1185 A 55 CYS H A 54 ASP HBx 1.0 . 3.99 1538 1185 A 55 CYS H A 54 ASP HBy 1.0 . 3.99 1539 1186 A 55 CYS H A 59 LEU HDy% 1.0 . 5.17 1540 1186 A 55 CYS H A 59 LEU HDx% 1.0 . 5.17 1541 1187 A 55 CYS HA A 59 LEU HDy% 1.0 . 3.43 1542 1187 A 55 CYS HA A 59 LEU HDx% 1.0 . 3.43 1543 1188 A 55 CYS HBx A 59 LEU HDy% 1.0 . 3.66 1544 1188 A 55 CYS HBx A 59 LEU HDx% 1.0 . 3.66 1545 1189 A 55 CYS HBy A 59 LEU HDy% 1.0 . 2.85 1546 1189 A 55 CYS HBy A 59 LEU HDx% 1.0 . 2.85 1547 1190 A 56 CYS H A 59 LEU HDy% 1.0 . 3.17 1548 1190 A 56 CYS H A 59 LEU HDx% 1.0 . 3.17 1549 1191 A 56 CYS HA A 59 LEU HDy% 1.0 . 4.33 1550 1191 A 56 CYS HA A 59 LEU HDx% 1.0 . 4.33 1551 1192 A 56 CYS HBx A 59 LEU HDy% 1.0 . 2.96 1552 1192 A 56 CYS HBx A 59 LEU HDx% 1.0 . 2.96 1553 1193 A 56 CYS HBy A 59 LEU HDy% 1.0 . 3.68 1554 1193 A 56 CYS HBy A 59 LEU HDx% 1.0 . 3.68 1555 1194 A 57 ALA HB% A 58 GLY HAy 1.0 . 3.88 1556 1194 A 57 ALA HB% A 58 GLY HAx 1.0 . 3.88 1557 1195 A 59 LEU H A 58 GLY HAy 1.0 . 3.12 1558 1195 A 59 LEU H A 58 GLY HAx 1.0 . 3.12 1559 1196 A 58 GLY HAx A 59 LEU HDy% 1.0 . 5.07 1560 1196 A 58 GLY HAy A 59 LEU HDy% 1.0 . 5.07 1561 1196 A 59 LEU HDx% A 58 GLY HAy 1.0 . 5.07 1562 1196 A 59 LEU HDx% A 58 GLY HAx 1.0 . 5.07 1563 1197 A 75 ILE HG1x A 58 GLY HAy 1.0 . 4.09 1564 1197 A 75 ILE HG1x A 58 GLY HAx 1.0 . 4.09 1565 1198 A 75 ILE HD1% A 58 GLY HAy 1.0 . 4.06 1566 1198 A 75 ILE HD1% A 58 GLY HAx 1.0 . 4.06 1567 1199 A 59 LEU H A 59 LEU HDy% 1.0 . 3.53 1568 1199 A 59 LEU H A 59 LEU HDx% 1.0 . 3.53 1569 1200 A 59 LEU HA A 59 LEU HDy% 1.0 . 3.13 1570 1200 A 59 LEU HA A 59 LEU HDx% 1.0 . 3.13 1571 1201 A 59 LEU HBx A 59 LEU HDy% 1.0 . 3.00 1572 1201 A 59 LEU HBx A 59 LEU HDx% 1.0 . 3.00 1573 1202 A 60 GLU H A 59 LEU HDy% 1.0 . 3.23 1574 1202 A 60 GLU H A 59 LEU HDx% 1.0 . 3.23 1575 1203 A 72 CYS HA A 59 LEU HDy% 1.0 . 5.43 1576 1203 A 72 CYS HA A 59 LEU HDx% 1.0 . 5.43 1577 1204 A 72 CYS HBy A 59 LEU HDy% 1.0 . 5.02 1578 1204 A 72 CYS HBy A 59 LEU HDx% 1.0 . 5.02 1579 1205 A 72 CYS HBx A 59 LEU HDy% 1.0 . 3.24 1580 1205 A 72 CYS HBx A 59 LEU HDx% 1.0 . 3.24 1581 1206 A 73 ALA H A 59 LEU HDy% 1.0 . 3.90 1582 1206 A 73 ALA H A 59 LEU HDx% 1.0 . 3.90 1583 1207 A 73 ALA HA A 59 LEU HDy% 1.0 . 3.82 1584 1207 A 73 ALA HA A 59 LEU HDx% 1.0 . 3.82 1585 1208 A 73 ALA HB% A 59 LEU HDy% 1.0 . 4.17 1586 1208 A 73 ALA HB% A 59 LEU HDx% 1.0 . 4.17 1587 1209 A 74 PRO HA A 59 LEU HDy% 1.0 . 2.82 1588 1209 A 74 PRO HA A 59 LEU HDx% 1.0 . 2.82 1589 1210 A 74 PRO HBx A 59 LEU HDy% 1.0 . 3.91 1590 1210 A 74 PRO HBx A 59 LEU HDx% 1.0 . 3.91 1591 1211 A 74 PRO HBy A 59 LEU HDy% 1.0 . 3.37 1592 1211 A 74 PRO HBy A 59 LEU HDx% 1.0 . 3.37 1593 1212 A 74 PRO HGy A 59 LEU HDy% 1.0 . 4.56 1594 1212 A 74 PRO HGy A 59 LEU HDx% 1.0 . 4.56 1595 1213 A 74 PRO HGx A 59 LEU HDy% 1.0 . 3.88 1596 1213 A 74 PRO HGx A 59 LEU HDx% 1.0 . 3.88 1597 1214 A 74 PRO HDy A 59 LEU HDy% 1.0 . 3.88 1598 1214 A 74 PRO HDy A 59 LEU HDx% 1.0 . 3.88 1599 1215 A 74 PRO HDx A 59 LEU HDy% 1.0 . 3.63 1600 1215 A 74 PRO HDx A 59 LEU HDx% 1.0 . 3.63 1601 1216 A 75 ILE H A 59 LEU HDy% 1.0 . 4.40 1602 1216 A 75 ILE H A 59 LEU HDx% 1.0 . 4.40 1603 1217 A 62 TRP HE1 A 64 ARG HGy 1.0 . 4.03 1604 1217 A 62 TRP HE1 A 64 ARG HGx 1.0 . 4.03 1605 1218 A 63 LYS H A 64 ARG HBy 1.0 . 5.18 1606 1218 A 63 LYS H A 64 ARG HBx 1.0 . 5.18 1607 1219 A 63 LYS HA A 70 SER HBy 1.0 . 3.56 1608 1219 A 63 LYS HA A 70 SER HBx 1.0 . 3.56 1609 1220 A 63 LYS HBx A 63 LYS HEx 1.0 . 4.27 1610 1220 A 63 LYS HBy A 63 LYS HEx 1.0 . 4.27 1611 1220 A 63 LYS HEy A 63 LYS HBy 1.0 . 4.27 1612 1220 A 63 LYS HEy A 63 LYS HBx 1.0 . 4.27 1613 1221 A 64 ARG H A 63 LYS HBy 1.0 . 4.02 1614 1221 A 64 ARG H A 63 LYS HBx 1.0 . 4.02 1615 1222 A 63 LYS HBx A 70 SER HBy 1.0 . 4.82 1616 1222 A 63 LYS HBy A 70 SER HBy 1.0 . 4.82 1617 1222 A 70 SER HBx A 63 LYS HBy 1.0 . 4.82 1618 1222 A 70 SER HBx A 63 LYS HBx 1.0 . 4.82 1619 1223 A 63 LYS HGy A 70 SER HBy 1.0 . 4.02 1620 1223 A 63 LYS HGx A 70 SER HBy 1.0 . 4.02 1621 1223 A 70 SER HBx A 63 LYS HGx 1.0 . 4.02 1622 1223 A 63 LYS HGy A 70 SER HBx 1.0 . 4.02 1623 1224 A 64 ARG H A 64 ARG HGy 1.0 . 3.89 1624 1224 A 64 ARG H A 64 ARG HGx 1.0 . 3.89 1625 1225 A 64 ARG H A 70 SER HBy 1.0 . 3.91 1626 1225 A 64 ARG H A 70 SER HBx 1.0 . 3.91 1627 1226 A 64 ARG HA A 64 ARG HGy 1.0 . 3.33 1628 1226 A 64 ARG HA A 64 ARG HGx 1.0 . 3.33 1629 1227 A 64 ARG HBx A 64 ARG HDx 1.0 . 3.19 1630 1227 A 64 ARG HBy A 64 ARG HDx 1.0 . 3.19 1631 1227 A 64 ARG HDy A 64 ARG HBy 1.0 . 3.19 1632 1227 A 64 ARG HDy A 64 ARG HBx 1.0 . 3.19 1633 1228 A 65 SER H A 64 ARG HBy 1.0 . 3.39 1634 1228 A 65 SER H A 64 ARG HBx 1.0 . 3.39 1635 1229 A 66 GLY H A 64 ARG HBy 1.0 . 5.34 1636 1229 A 66 GLY H A 64 ARG HBx 1.0 . 5.34 1637 1230 A 67 ASN H A 64 ARG HBy 1.0 . 4.34 1638 1230 A 67 ASN H A 64 ARG HBx 1.0 . 4.34 1639 1231 A 64 ARG HBy A 67 ASN HBy 1.0 . 4.17 1640 1231 A 64 ARG HBx A 67 ASN HBy 1.0 . 4.17 1641 1231 A 67 ASN HBx A 64 ARG HBy 1.0 . 4.17 1642 1231 A 64 ARG HBx A 67 ASN HBx 1.0 . 4.17 1643 1232 A 64 ARG HBy A 67 ASN HD2x 1.0 . 5.18 1644 1232 A 67 ASN HD2y A 64 ARG HBy 1.0 . 5.18 1645 1232 A 64 ARG HBx A 67 ASN HD2y 1.0 . 5.18 1646 1232 A 64 ARG HBx A 67 ASN HD2x 1.0 . 5.18 1647 1233 A 68 LYS H A 64 ARG HBy 1.0 . 5.34 1648 1233 A 68 LYS H A 64 ARG HBx 1.0 . 5.34 1649 1234 A 65 SER H A 64 ARG HGy 1.0 . 3.61 1650 1234 A 65 SER H A 64 ARG HGx 1.0 . 3.61 1651 1235 A 67 ASN H A 64 ARG HGy 1.0 . 5.34 1652 1235 A 67 ASN H A 64 ARG HGx 1.0 . 5.34 1653 1236 A 65 SER H A 65 SER HBy 1.0 . 3.23 1654 1236 A 65 SER H A 65 SER HBx 1.0 . 3.23 1655 1237 A 66 GLY H A 65 SER HBy 1.0 . 3.12 1656 1237 A 66 GLY H A 65 SER HBx 1.0 . 3.12 1657 1238 A 66 GLY H A 66 GLY HAx 1.0 . 2.58 1658 1238 A 66 GLY H A 66 GLY HAy 1.0 . 2.58 1659 1239 A 66 GLY H A 67 ASN HBy 1.0 . 4.94 1660 1239 A 66 GLY H A 67 ASN HBx 1.0 . 4.94 1661 1240 A 67 ASN H A 66 GLY HAx 1.0 . 2.90 1662 1240 A 67 ASN H A 66 GLY HAy 1.0 . 2.90 1663 1241 A 67 ASN HA A 66 GLY HAx 1.0 . 4.51 1664 1241 A 67 ASN HA A 66 GLY HAy 1.0 . 4.51 1665 1242 A 67 ASN H A 67 ASN HBy 1.0 . 3.24 1666 1242 A 67 ASN H A 67 ASN HBx 1.0 . 3.24 1667 1243 A 67 ASN HA A 67 ASN HD2x 1.0 . 4.51 1668 1243 A 67 ASN HA A 67 ASN HD2y 1.0 . 4.51 1669 1244 A 67 ASN HBx A 67 ASN HD2x 1.0 . 3.05 1670 1244 A 67 ASN HBy A 67 ASN HD2x 1.0 . 3.05 1671 1244 A 67 ASN HD2y A 67 ASN HBy 1.0 . 3.05 1672 1244 A 67 ASN HBx A 67 ASN HD2y 1.0 . 3.05 1673 1245 A 68 LYS H A 67 ASN HBy 1.0 . 3.62 1674 1245 A 68 LYS H A 67 ASN HBx 1.0 . 3.62 1675 1246 A 68 LYS HA A 68 LYS HGx 1.0 . 3.16 1676 1246 A 68 LYS HA A 68 LYS HGy 1.0 . 3.16 1677 1247 A 68 LYS HBx A 68 LYS HEx 1.0 . 4.44 1678 1247 A 68 LYS HBy A 68 LYS HEx 1.0 . 4.44 1679 1247 A 68 LYS HEy A 68 LYS HBy 1.0 . 4.44 1680 1247 A 68 LYS HEy A 68 LYS HBx 1.0 . 4.44 1681 1248 A 69 SER H A 68 LYS HBy 1.0 . 3.20 1682 1248 A 69 SER H A 68 LYS HBx 1.0 . 3.20 1683 1249 A 68 LYS HBy A 69 SER HBx 1.0 . 3.99 1684 1249 A 68 LYS HBx A 69 SER HBx 1.0 . 3.99 1685 1249 A 69 SER HBy A 68 LYS HBy 1.0 . 3.99 1686 1249 A 69 SER HBy A 68 LYS HBx 1.0 . 3.99 1687 1250 A 68 LYS HEx A 68 LYS HGx 1.0 . 3.17 1688 1250 A 68 LYS HEy A 68 LYS HGx 1.0 . 3.17 1689 1250 A 68 LYS HGy A 68 LYS HEx 1.0 . 3.17 1690 1250 A 68 LYS HEy A 68 LYS HGy 1.0 . 3.17 1691 1251 A 69 SER H A 68 LYS HGx 1.0 . 4.69 1692 1251 A 69 SER H A 68 LYS HGy 1.0 . 4.69 1693 1252 A 71 VAL H A 70 SER HBy 1.0 . 3.50 1694 1252 A 71 VAL H A 70 SER HBx 1.0 . 3.50 stop_ save_ save_DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.restraint_origin undefined _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 4 CYS SG A 19 CYS SG 1.0 . 1.96 2 2 A 4 CYS SG A 19 CYS CB 1.0 . 2.90 3 3 A 19 CYS SG A 4 CYS CB 1.0 . 2.90 4 4 A 11 CYS SG A 24 CYS SG 1.0 . 1.96 5 5 A 11 CYS SG A 24 CYS CB 1.0 . 2.90 6 6 A 24 CYS SG A 11 CYS CB 1.0 . 2.90 7 7 A 18 CYS SG A 34 CYS SG 1.0 . 1.96 8 8 A 18 CYS SG A 34 CYS CB 1.0 . 2.90 9 9 A 34 CYS SG A 18 CYS CB 1.0 . 2.90 10 10 A 41 CYS SG A 56 CYS SG 1.0 . 1.96 11 11 A 41 CYS SG A 56 CYS CB 1.0 . 2.90 12 12 A 56 CYS SG A 41 CYS CB 1.0 . 2.90 13 13 A 48 CYS SG A 61 CYS SG 1.0 . 1.96 14 14 A 48 CYS SG A 61 CYS CB 1.0 . 2.90 15 15 A 61 CYS SG A 48 CYS CB 1.0 . 2.90 16 16 A 55 CYS SG A 72 CYS SG 1.0 . 1.96 17 17 A 55 CYS SG A 72 CYS CB 1.0 . 2.90 18 18 A 72 CYS SG A 55 CYS CB 1.0 . 2.90 19 19 A 4 CYS SG A 19 CYS SG 1.0 . 2.10 20 20 A 4 CYS SG A 19 CYS CB 1.0 . 3.50 21 21 A 19 CYS SG A 4 CYS CB 1.0 . 3.50 22 22 A 11 CYS SG A 24 CYS SG 1.0 . 2.10 23 23 A 11 CYS SG A 24 CYS CB 1.0 . 3.50 24 24 A 24 CYS SG A 11 CYS CB 1.0 . 3.50 25 25 A 18 CYS SG A 34 CYS SG 1.0 . 2.10 26 26 A 18 CYS SG A 34 CYS CB 1.0 . 3.50 27 27 A 34 CYS SG A 18 CYS CB 1.0 . 3.50 28 28 A 41 CYS SG A 56 CYS SG 1.0 . 2.10 29 29 A 41 CYS SG A 56 CYS CB 1.0 . 3.50 30 30 A 56 CYS SG A 41 CYS CB 1.0 . 3.50 31 31 A 48 CYS SG A 61 CYS SG 1.0 . 2.10 32 32 A 48 CYS SG A 61 CYS CB 1.0 . 3.50 33 33 A 61 CYS SG A 48 CYS CB 1.0 . 3.50 34 34 A 55 CYS SG A 72 CYS SG 1.0 . 2.10 35 35 A 55 CYS SG A 72 CYS CB 1.0 . 3.50 36 36 A 72 CYS SG A 55 CYS CB 1.0 . 3.50 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_2 _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 3 GLU C A 4 CYS N A 4 CYS CA A 4 CYS C 1.0 -132.0 -48.0 PHI 2 2 A 4 CYS N A 4 CYS CA A 4 CYS C A 5 ILE N 1.0 78.0 174.0 PSI 3 3 A 4 CYS C A 5 ILE N A 5 ILE CA A 5 ILE C 1.0 -166.0 -46.0 PHI 4 4 A 5 ILE N A 5 ILE CA A 5 ILE C A 6 ARG N 1.0 104.0 168.0 PSI 5 5 A 5 ILE C A 6 ARG N A 6 ARG CA A 6 ARG C 1.0 -186.0 -46.0 PHI 6 6 A 6 ARG N A 6 ARG CA A 6 ARG C A 7 LYS N 1.0 112.0 204.0 PSI 7 7 A 7 LYS C A 8 TRP N A 8 TRP CA A 8 TRP C 1.0 46.0 74.0 PHI 8 8 A 8 TRP N A 8 TRP CA A 8 TRP C A 9 LEU N 1.0 16.0 52.0 PSI 9 9 A 8 TRP C A 9 LEU N A 9 LEU CA A 9 LEU C 1.0 -128.0 -60.0 PHI 10 10 A 9 LEU N A 9 LEU CA A 9 LEU C A 10 SER N 1.0 -77.0 35.0 PSI 11 11 A 10 SER C A 11 CYS N A 11 CYS CA A 11 CYS C 1.0 -99.0 -35.0 PHI 12 12 A 11 CYS N A 11 CYS CA A 11 CYS C A 12 VAL N 1.0 -69.0 -9.0 PSI 13 13 A 11 CYS C A 12 VAL N A 12 VAL CA A 12 VAL C 1.0 -118.0 -30.0 PHI 14 14 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 ASP N 1.0 -67.0 -3.0 PSI 15 15 A 14 ARG C A 15 LYS N A 15 LYS CA A 15 LYS C 1.0 -83.0 -51.0 PHI 16 16 A 15 LYS N A 15 LYS CA A 15 LYS C A 16 ASN N 1.0 -55.0 -11.0 PSI 17 17 A 15 LYS C A 16 ASN N A 16 ASN CA A 16 ASN C 1.0 -124.0 -48.0 PHI 18 18 A 16 ASN N A 16 ASN CA A 16 ASN C A 17 ASP N 1.0 -52.0 24.0 PSI 19 19 A 16 ASN C A 17 ASP N A 17 ASP CA A 17 ASP C 1.0 -130.0 -42.0 PHI 20 20 A 17 ASP N A 17 ASP CA A 17 ASP C A 18 CYS N 1.0 -79.0 33.0 PSI 21 21 A 17 ASP C A 18 CYS N A 18 CYS CA A 18 CYS C 1.0 -104.0 -44.0 PHI 22 22 A 18 CYS N A 18 CYS CA A 18 CYS C A 19 CYS N 1.0 -70.0 10.0 PSI 23 23 A 19 CYS C A 20 GLU N A 20 GLU CA A 20 GLU C 1.0 -110.0 -30.0 PHI 24 24 A 20 GLU N A 20 GLU CA A 20 GLU C A 21 GLY N 1.0 113.0 153.0 PSI 25 25 A 20 GLU C A 21 GLY N A 21 GLY CA A 21 GLY C 1.0 63.0 111.0 PHI 26 26 A 21 GLY N A 21 GLY CA A 21 GLY C A 22 LEU N 1.0 -26.0 34.0 PSI 27 27 A 21 GLY C A 22 LEU N A 22 LEU CA A 22 LEU C 1.0 -164.0 -64.0 PHI 28 28 A 22 LEU N A 22 LEU CA A 22 LEU C A 23 GLU N 1.0 89.0 205.0 PSI 29 29 A 22 LEU C A 23 GLU N A 23 GLU CA A 23 GLU C 1.0 -167.0 -83.0 PHI 30 30 A 23 GLU N A 23 GLU CA A 23 GLU C A 24 CYS N 1.0 101.0 169.0 PSI 31 31 A 23 GLU C A 24 CYS N A 24 CYS CA A 24 CYS C 1.0 -146.0 -38.0 PHI 32 32 A 24 CYS N A 24 CYS CA A 24 CYS C A 25 TYR N 1.0 92.0 156.0 PSI 33 33 A 24 CYS C A 25 TYR N A 25 TYR CA A 25 TYR C 1.0 -155.0 -95.0 PHI 34 34 A 25 TYR N A 25 TYR CA A 25 TYR C A 26 LYS N 1.0 100.0 172.0 PSI 35 35 A 25 TYR C A 26 LYS N A 26 LYS CA A 26 LYS C 1.0 -146.0 -74.0 PHI 36 36 A 26 LYS N A 26 LYS CA A 26 LYS C A 27 ARG N 1.0 99.0 147.0 PSI 37 37 A 26 LYS C A 27 ARG N A 27 ARG CA A 27 ARG C 1.0 -170.0 -54.0 PHI 38 38 A 27 ARG N A 27 ARG CA A 27 ARG C A 28 ARG N 1.0 113.0 181.0 PSI 39 39 A 28 ARG C A 29 HIS N A 29 HIS CA A 29 HIS C 1.0 -127.0 -59.0 PHI 40 40 A 29 HIS N A 29 HIS CA A 29 HIS C A 30 SER N 1.0 -49.0 27.0 PSI 41 41 A 30 SER C A 31 PHE N A 31 PHE CA A 31 PHE C 1.0 -178.0 -26.0 PHI 42 42 A 31 PHE N A 31 PHE CA A 31 PHE C A 32 GLU N 1.0 116.0 172.0 PSI 43 43 A 31 PHE C A 32 GLU N A 32 GLU CA A 32 GLU C 1.0 -115.0 -59.0 PHI 44 44 A 32 GLU N A 32 GLU CA A 32 GLU C A 33 VAL N 1.0 106.0 154.0 PSI 45 45 A 32 GLU C A 33 VAL N A 33 VAL CA A 33 VAL C 1.0 -160.0 -112.0 PHI 46 46 A 33 VAL N A 33 VAL CA A 33 VAL C A 34 CYS N 1.0 144.0 176.0 PSI 47 47 A 33 VAL C A 34 CYS N A 34 CYS CA A 34 CYS C 1.0 -113.0 -69.0 PHI 48 48 A 34 CYS N A 34 CYS CA A 34 CYS C A 35 VAL N 1.0 104.0 156.0 PSI 49 49 A 34 CYS C A 35 VAL N A 35 VAL CA A 35 VAL C 1.0 -138.0 -58.0 PHI 50 50 A 35 VAL N A 35 VAL CA A 35 VAL C A 36 PRO N 1.0 112.0 160.0 PSI 51 51 A 36 PRO N A 36 PRO CA A 36 PRO C A 37 ILE N 1.0 119.0 171.0 PSI 52 52 A 36 PRO C A 37 ILE N A 37 ILE CA A 37 ILE C 1.0 -139.0 -39.0 PHI 53 53 A 37 ILE N A 37 ILE CA A 37 ILE C A 38 PRO N 1.0 95.0 159.0 PSI 54 54 A 38 PRO N A 38 PRO CA A 38 PRO C A 39 GLY N 1.0 116.0 156.0 PSI 55 55 A 38 PRO C A 39 GLY N A 39 GLY CA A 39 GLY C 1.0 66.0 118.0 PHI 56 56 A 39 GLY N A 39 GLY CA A 39 GLY C A 40 PHE N 1.0 -36.0 12.0 PSI 57 57 A 39 GLY C A 40 PHE N A 40 PHE CA A 40 PHE C 1.0 -102.0 -54.0 PHI 58 58 A 40 PHE N A 40 PHE CA A 40 PHE C A 41 CYS N 1.0 120.0 172.0 PSI 59 59 A 40 PHE C A 41 CYS N A 41 CYS CA A 41 CYS C 1.0 -163.0 -79.0 PHI 60 60 A 41 CYS N A 41 CYS CA A 41 CYS C A 42 LEU N 1.0 106.0 190.0 PSI 61 61 A 41 CYS C A 42 LEU N A 42 LEU CA A 42 LEU C 1.0 -200.0 -56.0 PHI 62 62 A 42 LEU N A 42 LEU CA A 42 LEU C A 43 VAL N 1.0 129.0 189.0 PSI 63 63 A 42 LEU C A 43 VAL N A 43 VAL CA A 43 VAL C 1.0 -173.0 -33.0 PHI 64 64 A 43 VAL N A 43 VAL CA A 43 VAL C A 44 LYS N 1.0 132.0 204.0 PSI 65 65 A 44 LYS C A 45 TRP N A 45 TRP CA A 45 TRP C 1.0 -124.0 -76.0 PHI 66 66 A 45 TRP N A 45 TRP CA A 45 TRP C A 46 LYS N 1.0 -36.0 48.0 PSI 67 67 A 47 GLN C A 48 CYS N A 48 CYS CA A 48 CYS C 1.0 -129.0 -69.0 PHI 68 68 A 48 CYS N A 48 CYS CA A 48 CYS C A 49 ASP N 1.0 -45.0 31.0 PSI 69 69 A 48 CYS C A 49 ASP N A 49 ASP CA A 49 ASP C 1.0 -72.0 -44.0 PHI 70 70 A 49 ASP N A 49 ASP CA A 49 ASP C A 50 GLY N 1.0 119.0 147.0 PSI 71 71 A 49 ASP C A 50 GLY N A 50 GLY CA A 50 GLY C 1.0 62.0 114.0 PHI 72 72 A 50 GLY N A 50 GLY CA A 50 GLY C A 51 ARG N 1.0 -31.0 17.0 PSI 73 73 A 50 GLY C A 51 ARG N A 51 ARG CA A 51 ARG C 1.0 -111.0 -55.0 PHI 74 74 A 51 ARG C A 52 GLU N A 52 GLU CA A 52 GLU C 1.0 -77.0 -45.0 PHI 75 75 A 52 GLU N A 52 GLU CA A 52 GLU C A 53 ARG N 1.0 -52.0 -8.0 PSI 76 76 A 52 GLU C A 53 ARG N A 53 ARG CA A 53 ARG C 1.0 -126.0 -66.0 PHI 77 77 A 53 ARG N A 53 ARG CA A 53 ARG C A 54 ASP N 1.0 -42.0 26.0 PSI 78 78 A 55 CYS C A 56 CYS N A 56 CYS CA A 56 CYS C 1.0 -123.0 -67.0 PHI 79 79 A 56 CYS C A 57 ALA N A 57 ALA CA A 57 ALA C 1.0 -105.0 -33.0 PHI 80 80 A 57 ALA N A 57 ALA CA A 57 ALA C A 58 GLY N 1.0 110.0 154.0 PSI 81 81 A 57 ALA C A 58 GLY N A 58 GLY CA A 58 GLY C 1.0 64.0 120.0 PHI 82 82 A 58 GLY N A 58 GLY CA A 58 GLY C A 59 LEU N 1.0 -37.0 11.0 PSI 83 83 A 58 GLY C A 59 LEU N A 59 LEU CA A 59 LEU C 1.0 -145.0 -81.0 PHI 84 84 A 59 LEU N A 59 LEU CA A 59 LEU C A 60 GLU N 1.0 94.0 214.0 PSI 85 85 A 59 LEU C A 60 GLU N A 60 GLU CA A 60 GLU C 1.0 -166.0 -86.0 PHI 86 86 A 60 GLU N A 60 GLU CA A 60 GLU C A 61 CYS N 1.0 104.0 168.0 PSI 87 87 A 60 GLU C A 61 CYS N A 61 CYS CA A 61 CYS C 1.0 -138.0 -46.0 PHI 88 88 A 61 CYS N A 61 CYS CA A 61 CYS C A 62 TRP N 1.0 92.0 148.0 PSI 89 89 A 61 CYS C A 62 TRP N A 62 TRP CA A 62 TRP C 1.0 -148.0 -76.0 PHI 90 90 A 62 TRP N A 62 TRP CA A 62 TRP C A 63 LYS N 1.0 101.0 149.0 PSI 91 91 A 62 TRP C A 63 LYS N A 63 LYS CA A 63 LYS C 1.0 -150.0 -58.0 PHI 92 92 A 63 LYS N A 63 LYS CA A 63 LYS C A 64 ARG N 1.0 96.0 160.0 PSI 93 93 A 63 LYS C A 64 ARG N A 64 ARG CA A 64 ARG C 1.0 -185.0 -49.0 PHI 94 94 A 64 ARG N A 64 ARG CA A 64 ARG C A 65 SER N 1.0 115.0 179.0 PSI 95 95 A 64 ARG C A 65 SER N A 65 SER CA A 65 SER C 1.0 -132.0 -24.0 PHI 96 96 A 65 SER N A 65 SER CA A 65 SER C A 66 GLY N 1.0 109.0 173.0 PSI 97 97 A 65 SER C A 66 GLY N A 66 GLY CA A 66 GLY C 1.0 56.0 112.0 PHI 98 98 A 66 GLY N A 66 GLY CA A 66 GLY C A 67 ASN N 1.0 -36.0 44.0 PSI 99 99 A 66 GLY C A 67 ASN N A 67 ASN CA A 67 ASN C 1.0 -113.0 -69.0 PHI 100 100 A 67 ASN N A 67 ASN CA A 67 ASN C A 68 LYS N 1.0 -50.0 22.0 PSI 101 101 A 68 LYS C A 69 SER N A 69 SER CA A 69 SER C 1.0 -162.0 -34.0 PHI 102 102 A 69 SER N A 69 SER CA A 69 SER C A 70 SER N 1.0 86.0 178.0 PSI 103 103 A 69 SER C A 70 SER N A 70 SER CA A 70 SER C 1.0 -116.0 -68.0 PHI 104 104 A 70 SER N A 70 SER CA A 70 SER C A 71 VAL N 1.0 92.0 172.0 PSI 105 105 A 70 SER C A 71 VAL N A 71 VAL CA A 71 VAL C 1.0 -151.0 -119.0 PHI 106 106 A 71 VAL N A 71 VAL CA A 71 VAL C A 72 CYS N 1.0 134.0 178.0 PSI 107 107 A 71 VAL C A 72 CYS N A 72 CYS CA A 72 CYS C 1.0 -146.0 -62.0 PHI 108 108 A 72 CYS N A 72 CYS CA A 72 CYS C A 73 ALA N 1.0 69.0 165.0 PSI 109 109 A 72 CYS C A 73 ALA N A 73 ALA CA A 73 ALA C 1.0 -146.0 -62.0 PHI 110 110 A 73 ALA N A 73 ALA CA A 73 ALA C A 74 PRO N 1.0 98.0 162.0 PSI 111 111 A 74 PRO N A 74 PRO CA A 74 PRO C A 75 ILE N 1.0 124.0 176.0 PSI 112 112 A 74 PRO C A 75 ILE N A 75 ILE CA A 75 ILE C 1.0 -137.0 -49.0 PHI 113 113 A 75 ILE N A 75 ILE CA A 75 ILE C A 76 THR N 1.0 104.0 152.0 PSI stop_ save_