data_nef_c25460_2myw 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 BMRB 25459 PDB 2MYW 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 37 CYS SG 1 78 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 -11 ALA start . . 2 A -10 PRO middle . false 3 A -9 GLN middle . . 4 A -8 ASP middle . . 5 A -7 ASN middle . . 6 A -6 THR middle . . 7 A -5 SER middle . . 8 A -4 MET middle . . 9 A -3 GLY middle . false 10 A -2 SER middle . . 11 A -1 SER middle . . 12 A 0 HIS middle . . 13 A 1 HIS middle . . 14 A 2 HIS middle . . 15 A 3 HIS middle . . 16 A 4 HIS middle . . 17 A 5 HIS middle . . 18 A 6 SER middle . . 19 A 7 SER middle . . 20 A 8 GLY middle . false 21 A 9 ARG middle . . 22 A 10 GLU middle . . 23 A 11 ASN middle . . 24 A 12 LEU middle . . 25 A 13 TYR middle . . 26 A 14 PHE middle . . 27 A 15 GLN middle . . 28 A 16 GLY middle . false 29 A 17 HIS middle . . 30 A 18 MET middle . . 31 A 19 ALA middle . . 32 A 20 ALA middle . . 33 A 21 PRO middle . false 34 A 22 ALA middle . . 35 A 23 ARG middle . . 36 A 24 PHE middle . . 37 A 25 CYS middle -HG . 38 A 26 VAL middle . . 39 A 27 TYR middle . . 40 A 28 TYR middle . . 41 A 29 ASP middle . . 42 A 30 GLY middle . false 43 A 31 HIS middle . . 44 A 32 LEU middle . . 45 A 33 PRO middle . false 46 A 34 ALA middle . . 47 A 35 THR middle . . 48 A 36 ARG middle . . 49 A 37 VAL middle . . 50 A 38 LEU middle . . 51 A 39 LEU middle . . 52 A 40 MET middle . . 53 A 41 TYR middle . . 54 A 42 VAL middle . . 55 A 43 ARG middle . . 56 A 44 ILE middle . . 57 A 45 GLY middle . false 58 A 46 THR middle . . 59 A 47 THR middle . . 60 A 48 ALA middle . . 61 A 49 THR middle . . 62 A 50 ILE middle . . 63 A 51 THR middle . . 64 A 52 ALA middle . . 65 A 53 ARG middle . . 66 A 54 GLY middle . false 67 A 55 HIS middle . . 68 A 56 GLU middle . . 69 A 57 PHE middle . . 70 A 58 GLU middle . . 71 A 59 VAL middle . . 72 A 60 GLU middle . . 73 A 61 ALA middle . . 74 A 62 LYS middle . . 75 A 63 ASP middle . . 76 A 64 GLN middle . . 77 A 65 ASN middle . . 78 A 66 CYS middle -HG . 79 A 67 LYS middle . . 80 A 68 VAL middle . . 81 A 69 ILE middle . . 82 A 70 LEU middle . . 83 A 71 THR middle . . 84 A 72 ASN middle . . 85 A 73 GLY middle . false 86 A 74 LYS middle . . 87 A 75 GLN middle . . 88 A 76 ALA middle . . 89 A 77 PRO middle . false 90 A 78 ASP middle . . 91 A 79 TRP middle . . 92 A 80 LEU middle . . 93 A 81 ALA middle . . 94 A 82 ALA middle . . 95 A 83 GLU middle . . 96 A 84 PRO middle . false 97 A 85 TYR 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 8 GLY H H 1 8.462 . A 8 GLY HAy H 1 4.023 . A 8 GLY HAx H 1 3.982 . A 8 GLY C C 13 174.65 . A 8 GLY CA C 13 45.47 . A 8 GLY N N 15 110.72 . A 9 ARG H H 1 8.206 . A 9 ARG HA H 1 4.318 . A 9 ARG HBx H 1 1.595 . A 9 ARG HBy H 1 1.721 . A 9 ARG HDx H 1 3.156 . A 9 ARG HGx H 1 1.869 . A 9 ARG C C 13 176.79 . A 9 ARG CA C 13 56.34 . A 9 ARG CB C 13 30.53 . A 9 ARG N N 15 120.43 . A 10 GLU H H 1 8.562 . A 10 GLU HA H 1 4.210 . A 10 GLU HBx H 1 1.937 . A 10 GLU HBy H 1 2.028 . A 10 GLU HGx H 1 2.267 . A 10 GLU C C 13 176.60 . A 10 GLU CA C 13 57.27 . A 10 GLU CB C 13 29.78 . A 10 GLU N N 15 121.22 . A 11 ASN H H 1 8.337 . A 11 ASN HA H 1 4.670 . A 11 ASN HBx H 1 2.710 . A 11 ASN HBy H 1 2.765 . A 11 ASN HD2y H 1 7.511 . A 11 ASN HD2x H 1 6.854 . A 11 ASN C C 13 175.42 . A 11 ASN CA C 13 53.45 . A 11 ASN CB C 13 38.71 . A 11 ASN N N 15 118.90 . A 11 ASN ND2 N 15 112.50 . A 12 LEU H H 1 7.988 . A 12 LEU HA H 1 4.192 . A 12 LEU HBx H 1 1.325 . A 12 LEU HDx% H 1 0.818 . A 12 LEU HDy% H 1 0.752 . A 12 LEU HG H 1 1.431 . A 12 LEU C C 13 177.29 . A 12 LEU CA C 13 55.63 . A 12 LEU CB C 13 42.26 . A 12 LEU N N 15 121.83 . A 13 TYR H H 1 7.966 . A 13 TYR HA H 1 4.498 . A 13 TYR HBx H 1 2.843 . A 13 TYR HBy H 1 2.929 . A 13 TYR HDy H 1 6.973 . A 13 TYR HEy H 1 6.747 . A 13 TYR C C 13 175.95 . A 13 TYR CA C 13 57.93 . A 13 TYR CB C 13 38.59 . A 13 TYR N N 15 119.55 . A 14 PHE H H 1 8.006 . A 14 PHE HA H 1 4.524 . A 14 PHE HBx H 1 2.968 . A 14 PHE HBy H 1 3.047 . A 14 PHE HDy H 1 7.194 . A 14 PHE C C 13 175.82 . A 14 PHE CA C 13 57.95 . A 14 PHE CB C 13 39.51 . A 14 PHE N N 15 121.13 . A 15 GLN H H 1 8.217 . A 15 GLN HA H 1 4.185 . A 15 GLN HBx H 1 1.884 . A 15 GLN HBy H 1 2.061 . A 15 GLN HE2y H 1 7.423 . A 15 GLN HE2x H 1 6.821 . A 15 GLN HGx H 1 2.240 . A 15 GLN C C 13 176.42 . A 15 GLN CA C 13 56.18 . A 15 GLN CB C 13 29.11 . A 15 GLN N N 15 121.84 . A 15 GLN NE2 N 15 111.95 . A 16 GLY H H 1 7.907 . A 16 GLY HAx H 1 3.856 . A 16 GLY C C 13 174.14 . A 16 GLY CA C 13 45.31 . A 16 GLY N N 15 108.43 . A 17 HIS H H 1 8.250 . A 17 HIS HA H 1 3.877 . A 17 HIS HBx H 1 3.094 . A 17 HIS HBy H 1 3.239 . A 17 HIS C C 13 174.61 . A 17 HIS CA C 13 55.43 . A 17 HIS CB C 13 29.28 . A 17 HIS N N 15 117.99 . A 18 MET H H 1 8.320 . A 18 MET HA H 1 4.395 . A 18 MET HBy H 1 1.931 . A 18 MET HBx H 1 1.818 . A 18 MET HE% H 1 2.460 . A 18 MET HGx H 1 2.036 . A 18 MET HGy H 1 2.227 . A 18 MET C C 13 175.75 . A 18 MET CA C 13 55.66 . A 18 MET CB C 13 32.74 . A 18 MET N N 15 121.43 . A 19 ALA H H 1 8.262 . A 19 ALA HA H 1 4.272 . A 19 ALA HB% H 1 1.320 . A 19 ALA C C 13 176.95 . A 19 ALA CA C 13 52.26 . A 19 ALA CB C 13 19.13 . A 19 ALA N N 15 125.55 . A 20 ALA H H 1 8.083 . A 20 ALA HA H 1 4.536 . A 20 ALA HB% H 1 1.296 . A 20 ALA C C 13 175.39 . A 20 ALA CA C 13 50.10 . A 20 ALA CB C 13 18.42 . A 20 ALA N N 15 124.43 . A 21 PRO HA H 1 4.450 . A 21 PRO HBy H 1 2.346 . A 21 PRO HBx H 1 1.911 . A 21 PRO HDy H 1 3.720 . A 21 PRO HDx H 1 3.636 . A 21 PRO HGx H 1 2.000 . A 21 PRO HGy H 1 2.069 . A 21 PRO C C 13 175.77 . A 21 PRO CA C 13 55.52 . A 21 PRO CB C 13 32.96 . A 22 ALA H H 1 8.235 . A 22 ALA HA H 1 4.333 . A 22 ALA HB% H 1 1.381 . A 22 ALA C C 13 176.92 . A 22 ALA CA C 13 52.35 . A 22 ALA CB C 13 19.19 . A 22 ALA N N 15 124.42 . A 23 ARG H H 1 9.271 . A 23 ARG HA H 1 4.343 . A 23 ARG HBx H 1 1.609 . A 23 ARG HBy H 1 1.698 . A 23 ARG HGx H 1 1.416 . A 23 ARG C C 13 176.22 . A 23 ARG CA C 13 57.00 . A 23 ARG CB C 13 33.49 . A 23 ARG N N 15 120.14 . A 24 PHE H H 1 9.270 . A 24 PHE HA H 1 5.382 . A 24 PHE HBx H 1 3.060 . A 24 PHE HBy H 1 3.182 . A 24 PHE HDx H 1 7.198 . A 24 PHE HEx H 1 7.290 . A 24 PHE HEy H 1 7.290 . A 24 PHE C C 13 175.91 . A 24 PHE CA C 13 56.85 . A 24 PHE CB C 13 43.56 . A 24 PHE N N 15 119.13 . A 25 CYS H H 1 9.254 . A 25 CYS HA H 1 5.319 . A 25 CYS HBx H 1 2.243 . A 25 CYS HBy H 1 2.509 . A 25 CYS C C 13 172.99 . A 25 CYS CA C 13 54.20 . A 25 CYS CB C 13 39.74 . A 25 CYS N N 15 116.30 . A 26 VAL H H 1 9.512 . A 26 VAL HA H 1 4.382 . A 26 VAL HB H 1 1.700 . A 26 VAL HGx% H 1 0.266 . A 26 VAL HGy% H 1 0.148 . A 26 VAL C C 13 174.52 . A 26 VAL CA C 13 60.74 . A 26 VAL CB C 13 32.38 . A 26 VAL N N 15 126.29 . A 27 TYR H H 1 8.240 . A 27 TYR HA H 1 5.144 . A 27 TYR HBy H 1 2.661 . A 27 TYR HBx H 1 2.630 . A 27 TYR HDx H 1 6.836 . A 27 TYR HEx H 1 6.402 . A 27 TYR C C 13 175.40 . A 27 TYR CA C 13 57.10 . A 27 TYR CB C 13 40.86 . A 27 TYR N N 15 123.62 . A 28 TYR H H 1 9.448 . A 28 TYR HA H 1 5.273 . A 28 TYR HBy H 1 2.695 . A 28 TYR HBx H 1 2.532 . A 28 TYR HDx H 1 6.545 . A 28 TYR HEx H 1 6.422 . A 28 TYR C C 13 174.59 . A 28 TYR CA C 13 56.90 . A 28 TYR CB C 13 44.09 . A 28 TYR N N 15 119.74 . A 29 ASP H H 1 8.995 . A 29 ASP HA H 1 5.255 . A 29 ASP HBx H 1 2.541 . A 29 ASP HBy H 1 3.028 . A 29 ASP C C 13 177.67 . A 29 ASP CA C 13 52.80 . A 29 ASP CB C 13 41.35 . A 29 ASP N N 15 118.65 . A 30 GLY H H 1 9.046 . A 30 GLY HAy H 1 4.799 . A 30 GLY HAx H 1 3.746 . A 30 GLY C C 13 173.32 . A 30 GLY CA C 13 44.11 . A 30 GLY N N 15 114.74 . A 31 HIS H H 1 8.306 . A 31 HIS HA H 1 4.493 . A 31 HIS HBx H 1 2.937 . A 31 HIS HBy H 1 3.324 . A 31 HIS HD1 H 1 7.318 . A 31 HIS HE1 H 1 8.548 . A 31 HIS C C 13 175.23 . A 31 HIS CA C 13 55.98 . A 31 HIS CB C 13 30.63 . A 31 HIS N N 15 113.88 . A 32 LEU H H 1 8.477 . A 32 LEU HA H 1 4.824 . A 32 LEU HBx H 1 1.730 . A 32 LEU HBy H 1 1.761 . A 32 LEU HDx% H 1 0.959 . A 32 LEU HDy% H 1 0.913 . A 32 LEU HG H 1 1.594 . A 32 LEU C C 13 176.03 . A 32 LEU CA C 13 52.08 . A 32 LEU CB C 13 41.54 . A 32 LEU N N 15 124.06 . A 33 PRO HA H 1 3.753 . A 33 PRO HBx H 1 1.788 . A 33 PRO HBy H 1 1.908 . A 33 PRO HDx H 1 3.809 . A 33 PRO HDy H 1 4.062 . A 33 PRO HGx H 1 2.137 . A 33 PRO HGy H 1 2.224 . A 33 PRO C C 13 177.88 . A 33 PRO CA C 13 65.50 . A 33 PRO CB C 13 31.77 . A 34 ALA H H 1 8.193 . A 34 ALA HA H 1 4.193 . A 34 ALA HB% H 1 1.446 . A 34 ALA C C 13 179.12 . A 34 ALA CA C 13 54.61 . A 34 ALA CB C 13 19.43 . A 34 ALA N N 15 115.22 . A 35 THR H H 1 7.187 . A 35 THR HA H 1 4.597 . A 35 THR HB H 1 4.405 . A 35 THR HG2% H 1 1.090 . A 35 THR C C 13 175.61 . A 35 THR CA C 13 60.40 . A 35 THR CB C 13 70.55 . A 35 THR N N 15 102.12 . A 36 ARG H H 1 7.918 . A 36 ARG HA H 1 4.763 . A 36 ARG HBy H 1 1.506 . A 36 ARG HBx H 1 1.405 . A 36 ARG HDx H 1 3.752 . A 36 ARG HE H 1 6.677 . A 36 ARG HGx H 1 1.722 . A 36 ARG HGy H 1 1.819 . A 36 ARG C C 13 175.22 . A 36 ARG CA C 13 56.09 . A 36 ARG CB C 13 29.88 . A 36 ARG N N 15 122.52 . A 37 VAL H H 1 8.603 . A 37 VAL HA H 1 4.341 . A 37 VAL HB H 1 2.108 . A 37 VAL HGx% H 1 1.005 . A 37 VAL HGy% H 1 1.069 . A 37 VAL C C 13 175.69 . A 37 VAL CA C 13 61.33 . A 37 VAL CB C 13 35.05 . A 37 VAL N N 15 122.11 . A 38 LEU H H 1 8.708 . A 38 LEU HA H 1 3.769 . A 38 LEU HBy H 1 1.633 . A 38 LEU HBx H 1 1.520 . A 38 LEU HDx% H 1 0.469 . A 38 LEU HDy% H 1 0.598 . A 38 LEU HG H 1 0.909 . A 38 LEU C C 13 176.51 . A 38 LEU CA C 13 57.37 . A 38 LEU CB C 13 41.82 . A 38 LEU N N 15 130.47 . A 39 LEU H H 1 9.254 . A 39 LEU HA H 1 4.627 . A 39 LEU HBx H 1 1.427 . A 39 LEU HBy H 1 1.563 . A 39 LEU HDx% H 1 0.858 . A 39 LEU HDy% H 1 1.025 . A 39 LEU HG H 1 1.874 . A 39 LEU C C 13 176.80 . A 39 LEU CA C 13 55.73 . A 39 LEU CB C 13 42.33 . A 39 LEU N N 15 126.44 . A 40 MET H H 1 7.054 . A 40 MET HA H 1 4.471 . A 40 MET HBy H 1 2.104 . A 40 MET HBx H 1 1.726 . A 40 MET HE% H 1 2.171 . A 40 MET HGx H 1 2.510 . A 40 MET C C 13 173.75 . A 40 MET CA C 13 56.04 . A 40 MET CB C 13 36.88 . A 40 MET N N 15 114.55 . A 41 TYR H H 1 8.563 . A 41 TYR HA H 1 4.813 . A 41 TYR HBx H 1 2.216 . A 41 TYR HBy H 1 2.803 . A 41 TYR HDy H 1 6.509 . A 41 TYR HEy H 1 6.080 . A 41 TYR C C 13 175.68 . A 41 TYR CA C 13 57.94 . A 41 TYR CB C 13 39.46 . A 41 TYR N N 15 123.27 . A 42 VAL H H 1 9.442 . A 42 VAL HA H 1 4.409 . A 42 VAL HB H 1 2.210 . A 42 VAL HGx% H 1 0.816 . A 42 VAL HGy% H 1 0.651 . A 42 VAL C C 13 175.60 . A 42 VAL CA C 13 61.48 . A 42 VAL CB C 13 35.31 . A 42 VAL N N 15 123.93 . A 43 ARG H H 1 8.940 . A 43 ARG HA H 1 3.924 . A 43 ARG HBx H 1 1.688 . A 43 ARG HDx H 1 2.910 . A 43 ARG HE H 1 7.199 . A 43 ARG HGx H 1 1.494 . A 43 ARG C C 13 177.01 . A 43 ARG CA C 13 56.76 . A 43 ARG CB C 13 29.98 . A 43 ARG N N 15 129.29 . A 44 ILE H H 1 8.345 . A 44 ILE HA H 1 3.686 . A 44 ILE HB H 1 1.295 . A 44 ILE HD1% H 1 0.467 . A 44 ILE HG1y H 1 1.310 . A 44 ILE HG1x H 1 0.788 . A 44 ILE HG2% H 1 0.618 . A 44 ILE C C 13 177.02 . A 44 ILE CA C 13 64.93 . A 44 ILE CB C 13 37.24 . A 44 ILE N N 15 128.26 . A 45 GLY H H 1 9.423 . A 45 GLY HAy H 1 4.408 . A 45 GLY HAx H 1 3.851 . A 45 GLY C C 13 174.86 . A 45 GLY CA C 13 44.24 . A 45 GLY N N 15 115.53 . A 46 THR H H 1 7.925 . A 46 THR HA H 1 4.974 . A 46 THR HB H 1 4.405 . A 46 THR HG2% H 1 1.085 . A 46 THR C C 13 172.31 . A 46 THR CA C 13 60.28 . A 46 THR CB C 13 72.16 . A 46 THR N N 15 111.41 . A 47 THR H H 1 7.784 . A 47 THR HA H 1 5.383 . A 47 THR HB H 1 4.023 . A 47 THR HG2% H 1 1.056 . A 47 THR C C 13 174.56 . A 47 THR CA C 13 59.24 . A 47 THR CB C 13 71.84 . A 47 THR N N 15 109.43 . A 48 ALA H H 1 8.681 . A 48 ALA HA H 1 4.658 . A 48 ALA HB% H 1 1.291 . A 48 ALA C C 13 175.62 . A 48 ALA CA C 13 51.60 . A 48 ALA CB C 13 24.41 . A 48 ALA N N 15 122.63 . A 49 THR H H 1 8.347 . A 49 THR HA H 1 4.914 . A 49 THR HB H 1 3.908 . A 49 THR HG2% H 1 1.001 . A 49 THR C C 13 174.40 . A 49 THR CA C 13 62.32 . A 49 THR CB C 13 69.26 . A 49 THR N N 15 116.02 . A 50 ILE H H 1 9.199 . A 50 ILE HA H 1 4.436 . A 50 ILE HB H 1 1.753 . A 50 ILE HD1% H 1 0.364 . A 50 ILE HG1y H 1 1.339 . A 50 ILE HG1x H 1 1.013 . A 50 ILE HG2% H 1 0.713 . A 50 ILE C C 13 175.08 . A 50 ILE CA C 13 59.51 . A 50 ILE CB C 13 40.67 . A 50 ILE N N 15 126.05 . A 51 THR H H 1 8.500 . A 51 THR HA H 1 5.312 . A 51 THR HB H 1 3.967 . A 51 THR HG2% H 1 1.052 . A 51 THR C C 13 174.25 . A 51 THR CA C 13 61.03 . A 51 THR CB C 13 69.85 . A 51 THR N N 15 120.63 . A 52 ALA H H 1 9.202 . A 52 ALA HA H 1 4.711 . A 52 ALA HB% H 1 1.653 . A 52 ALA C C 13 176.53 . A 52 ALA CA C 13 51.98 . A 52 ALA CB C 13 22.72 . A 52 ALA N N 15 127.71 . A 53 ARG H H 1 9.303 . A 53 ARG HA H 1 3.856 . A 53 ARG HBx H 1 1.716 . A 53 ARG HBy H 1 2.040 . A 53 ARG HDy H 1 2.546 . A 53 ARG HDx H 1 1.798 . A 53 ARG HE H 1 6.982 . A 53 ARG HGx H 1 0.809 . A 53 ARG HGy H 1 1.132 . A 53 ARG C C 13 177.07 . A 53 ARG CA C 13 57.03 . A 53 ARG CB C 13 27.04 . A 53 ARG N N 15 118.78 . A 54 GLY H H 1 8.714 . A 54 GLY HAy H 1 3.974 . A 54 GLY HAx H 1 3.543 . A 54 GLY C C 13 174.11 . A 54 GLY CA C 13 45.36 . A 54 GLY N N 15 104.07 . A 55 HIS H H 1 8.227 . A 55 HIS HA H 1 4.776 . A 55 HIS HBx H 1 2.875 . A 55 HIS HBy H 1 3.100 . A 55 HIS HD1 H 1 7.119 . A 55 HIS HE1 H 1 8.519 . A 55 HIS C C 13 172.31 . A 55 HIS CA C 13 54.03 . A 55 HIS CB C 13 32.10 . A 55 HIS N N 15 119.17 . A 56 GLU H H 1 8.024 . A 56 GLU HA H 1 5.087 . A 56 GLU HBy H 1 1.744 . A 56 GLU HBx H 1 1.650 . A 56 GLU HGy H 1 2.107 . A 56 GLU HGx H 1 2.047 . A 56 GLU C C 13 176.15 . A 56 GLU CA C 13 55.09 . A 56 GLU CB C 13 31.78 . A 56 GLU N N 15 119.64 . A 57 PHE H H 1 9.219 . A 57 PHE HA H 1 4.774 . A 57 PHE HBy H 1 2.718 . A 57 PHE HBx H 1 2.627 . A 57 PHE HDy H 1 7.126 . A 57 PHE HEx H 1 7.464 . A 57 PHE HEy H 1 7.464 . A 57 PHE HZ H 1 7.298 . A 57 PHE C C 13 173.93 . A 57 PHE CA C 13 56.47 . A 57 PHE CB C 13 41.45 . A 57 PHE N N 15 121.66 . A 58 GLU H H 1 8.597 . A 58 GLU HA H 1 5.224 . A 58 GLU HBy H 1 2.199 . A 58 GLU HBx H 1 1.741 . A 58 GLU HGx H 1 2.021 . A 58 GLU C C 13 175.82 . A 58 GLU CA C 13 55.46 . A 58 GLU CB C 13 29.95 . A 58 GLU N N 15 125.63 . A 59 VAL H H 1 8.809 . A 59 VAL HA H 1 5.415 . A 59 VAL HB H 1 2.005 . A 59 VAL HGx% H 1 0.534 . A 59 VAL HGy% H 1 0.268 . A 59 VAL C C 13 174.79 . A 59 VAL CA C 13 58.55 . A 59 VAL CB C 13 34.15 . A 59 VAL N N 15 120.69 . A 60 GLU H H 1 8.024 . A 60 GLU HA H 1 4.617 . A 60 GLU HBy H 1 1.823 . A 60 GLU HBx H 1 1.616 . A 60 GLU HGx H 1 1.979 . A 60 GLU C C 13 176.05 . A 60 GLU CA C 13 54.18 . A 60 GLU CB C 13 32.05 . A 60 GLU N N 15 118.57 . A 61 ALA H H 1 8.230 . A 61 ALA HA H 1 4.699 . A 61 ALA HB% H 1 1.372 . A 61 ALA C C 13 176.26 . A 61 ALA CA C 13 50.52 . A 61 ALA CB C 13 17.71 . A 61 ALA N N 15 132.63 . A 62 LYS H H 1 9.070 . A 62 LYS HA H 1 3.998 . A 62 LYS HBx H 1 1.617 . A 62 LYS HBy H 1 1.741 . A 62 LYS HDx H 1 1.600 . A 62 LYS HEy H 1 2.935 . A 62 LYS HEx H 1 2.907 . A 62 LYS HGx H 1 1.282 . A 62 LYS HGy H 1 1.405 . A 62 LYS C C 13 177.03 . A 62 LYS CA C 13 59.59 . A 62 LYS CB C 13 34.54 . A 62 LYS N N 15 126.08 . A 63 ASP H H 1 7.507 . A 63 ASP HA H 1 4.386 . A 63 ASP HBx H 1 2.956 . A 63 ASP HBy H 1 3.009 . A 63 ASP C C 13 175.81 . A 63 ASP CA C 13 53.15 . A 63 ASP CB C 13 41.25 . A 63 ASP N N 15 110.55 . A 64 GLN H H 1 8.410 . A 64 GLN HA H 1 4.100 . A 64 GLN HBy H 1 2.162 . A 64 GLN HBx H 1 2.093 . A 64 GLN HE2y H 1 7.553 . A 64 GLN HE2x H 1 6.957 . A 64 GLN HGy H 1 2.337 . A 64 GLN HGx H 1 2.312 . A 64 GLN C C 13 175.95 . A 64 GLN CA C 13 57.69 . A 64 GLN CB C 13 27.84 . A 64 GLN N N 15 112.74 . A 64 GLN NE2 N 15 112.49 . A 65 ASN H H 1 8.747 . A 65 ASN HA H 1 4.579 . A 65 ASN HBy H 1 3.001 . A 65 ASN HBx H 1 2.638 . A 65 ASN HD2y H 1 7.613 . A 65 ASN HD2x H 1 7.060 . A 65 ASN C C 13 177.25 . A 65 ASN CA C 13 55.12 . A 65 ASN CB C 13 37.91 . A 65 ASN N N 15 117.79 . A 65 ASN ND2 N 15 115.26 . A 66 CYS H H 1 8.527 . A 66 CYS HA H 1 4.425 . A 66 CYS HBy H 1 2.782 . A 66 CYS HBx H 1 2.264 . A 66 CYS C C 13 174.97 . A 66 CYS CA C 13 55.13 . A 66 CYS CB C 13 36.16 . A 66 CYS N N 15 112.64 . A 67 LYS H H 1 8.014 . A 67 LYS HA H 1 4.177 . A 67 LYS HBy H 1 1.706 . A 67 LYS HBx H 1 1.661 . A 67 LYS HDx H 1 1.516 . A 67 LYS HEx H 1 3.000 . A 67 LYS HGx H 1 1.283 . A 67 LYS HGy H 1 1.377 . A 67 LYS C C 13 178.48 . A 67 LYS CA C 13 56.86 . A 67 LYS CB C 13 32.12 . A 67 LYS N N 15 116.24 . A 68 VAL H H 1 8.967 . A 68 VAL HA H 1 3.675 . A 68 VAL HB H 1 2.049 . A 68 VAL HGx% H 1 0.935 . A 68 VAL HGy% H 1 0.667 . A 68 VAL C C 13 174.46 . A 68 VAL CA C 13 64.75 . A 68 VAL CB C 13 30.16 . A 68 VAL N N 15 126.98 . A 69 ILE H H 1 8.689 . A 69 ILE HA H 1 4.179 . A 69 ILE HB H 1 2.042 . A 69 ILE HD1% H 1 0.884 . A 69 ILE HG1y H 1 1.355 . A 69 ILE HG1x H 1 0.930 . A 69 ILE HG2% H 1 0.852 . A 69 ILE C C 13 175.06 . A 69 ILE CA C 13 60.56 . A 69 ILE CB C 13 41.49 . A 69 ILE N N 15 132.54 . A 70 LEU H H 1 8.829 . A 70 LEU HA H 1 5.298 . A 70 LEU HBx H 1 1.756 . A 70 LEU HBy H 1 2.043 . A 70 LEU HDx% H 1 0.790 . A 70 LEU HDy% H 1 0.856 . A 70 LEU HG H 1 1.629 . A 70 LEU C C 13 180.80 . A 70 LEU CA C 13 53.19 . A 70 LEU CB C 13 41.15 . A 70 LEU N N 15 125.29 . A 71 THR H H 1 8.546 . A 71 THR HA H 1 4.094 . A 71 THR HB H 1 4.297 . A 71 THR HG2% H 1 1.120 . A 71 THR C C 13 176.24 . A 71 THR CA C 13 63.95 . A 71 THR CB C 13 68.28 . A 71 THR N N 15 115.51 . A 72 ASN H H 1 8.162 . A 72 ASN HA H 1 4.564 . A 72 ASN HBy H 1 3.189 . A 72 ASN HBx H 1 2.920 . A 72 ASN HD2y H 1 7.297 . A 72 ASN HD2x H 1 6.657 . A 72 ASN C C 13 177.34 . A 72 ASN CA C 13 52.71 . A 72 ASN CB C 13 37.22 . A 72 ASN N N 15 117.01 . A 72 ASN ND2 N 15 107.01 . A 73 GLY H H 1 7.985 . A 73 GLY HAy H 1 4.096 . A 73 GLY HAx H 1 3.865 . A 73 GLY C C 13 175.02 . A 73 GLY CA C 13 45.70 . A 73 GLY N N 15 106.66 . A 74 LYS H H 1 7.820 . A 74 LYS HA H 1 4.298 . A 74 LYS HBx H 1 1.837 . A 74 LYS HDx H 1 1.662 . A 74 LYS HEx H 1 2.980 . A 74 LYS HEy H 1 2.997 . A 74 LYS HGx H 1 1.303 . A 74 LYS C C 13 175.72 . A 74 LYS CA C 13 55.73 . A 74 LYS CB C 13 32.49 . A 74 LYS N N 15 120.73 . A 75 GLN H H 1 8.273 . A 75 GLN HA H 1 4.156 . A 75 GLN HBx H 1 1.938 . A 75 GLN HBy H 1 1.977 . A 75 GLN HE2y H 1 7.636 . A 75 GLN HE2x H 1 6.852 . A 75 GLN HGx H 1 2.417 . A 75 GLN C C 13 176.49 . A 75 GLN CA C 13 55.58 . A 75 GLN CB C 13 29.02 . A 75 GLN N N 15 119.59 . A 75 GLN NE2 N 15 113.12 . A 76 ALA H H 1 8.698 . A 76 ALA HA H 1 4.166 . A 76 ALA HB% H 1 1.110 . A 76 ALA C C 13 174.92 . A 76 ALA CA C 13 50.08 . A 76 ALA CB C 13 17.88 . A 76 ALA N N 15 129.34 . A 77 PRO HA H 1 4.237 . A 77 PRO HBy H 1 1.789 . A 77 PRO HBx H 1 0.054 . A 77 PRO HDy H 1 3.476 . A 77 PRO HDx H 1 2.562 . A 77 PRO HGx H 1 0.745 . A 77 PRO HGy H 1 1.491 . A 77 PRO C C 13 178.17 . A 77 PRO CA C 13 62.17 . A 77 PRO CB C 13 31.47 . A 78 ASP H H 1 8.607 . A 78 ASP HA H 1 4.217 . A 78 ASP HBx H 1 2.745 . A 78 ASP HBy H 1 2.798 . A 78 ASP C C 13 176.61 . A 78 ASP CA C 13 56.50 . A 78 ASP CB C 13 40.53 . A 78 ASP N N 15 121.04 . A 79 TRP H H 1 6.768 . A 79 TRP HA H 1 4.492 . A 79 TRP HBy H 1 3.708 . A 79 TRP HBx H 1 3.124 . A 79 TRP HD1 H 1 7.375 . A 79 TRP HE1 H 1 10.35 . A 79 TRP HE3 H 1 7.287 . A 79 TRP HH2 H 1 6.948 . A 79 TRP HZ2 H 1 6.622 . A 79 TRP HZ3 H 1 7.450 . A 79 TRP C C 13 175.28 . A 79 TRP CA C 13 54.63 . A 79 TRP CB C 13 29.14 . A 79 TRP N N 15 114.44 . A 79 TRP NE1 N 15 131.34 . A 80 LEU H H 1 6.577 . A 80 LEU HA H 1 4.761 . A 80 LEU HBy H 1 1.272 . A 80 LEU HBx H 1 0.240 . A 80 LEU HDx% H 1 0.588 . A 80 LEU HDy% H 1 0.300 . A 80 LEU HG H 1 1.167 . A 80 LEU C C 13 174.27 . A 80 LEU CA C 13 54.85 . A 80 LEU CB C 13 41.89 . A 80 LEU N N 15 123.45 . A 81 ALA H H 1 9.037 . A 81 ALA HA H 1 4.667 . A 81 ALA HB% H 1 0.943 . A 81 ALA C C 13 175.21 . A 81 ALA CA C 13 50.31 . A 81 ALA CB C 13 23.27 . A 81 ALA N N 15 130.91 . A 82 ALA H H 1 8.159 . A 82 ALA HA H 1 5.677 . A 82 ALA HB% H 1 0.655 . A 82 ALA C C 13 177.28 . A 82 ALA CA C 13 51.01 . A 82 ALA CB C 13 22.24 . A 82 ALA N N 15 119.12 . A 83 GLU H H 1 8.614 . A 83 GLU HA H 1 4.938 . A 83 GLU HBy H 1 2.211 . A 83 GLU HBx H 1 2.015 . A 83 GLU HGx H 1 2.369 . A 83 GLU C C 13 172.56 . A 83 GLU CA C 13 53.01 . A 83 GLU CB C 13 32.47 . A 83 GLU N N 15 116.91 . A 84 PRO HA H 1 5.513 . A 84 PRO HBy H 1 2.427 . A 84 PRO HBx H 1 1.922 . A 84 PRO HDx H 1 3.535 . A 84 PRO HDy H 1 3.786 . A 84 PRO HGx H 1 2.115 . A 84 PRO C C 13 177.34 . A 84 PRO CA C 13 62.93 . A 84 PRO CB C 13 32.42 . A 85 TYR H H 1 8.881 . A 85 TYR HA H 1 4.447 . A 85 TYR HBx H 1 2.750 . A 85 TYR HBy H 1 3.033 . A 85 TYR HDy H 1 7.250 . A 85 TYR HEy H 1 6.772 . A 85 TYR C C 13 179.53 . A 85 TYR CA C 13 61.39 . A 85 TYR CB C 13 43.01 . A 85 TYR N N 15 127.44 . stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 7 SER HBx A 7 SER HA 1.0 1.8 3.6 2 2 A 7 SER HA A 7 SER HBy 1.0 1.8 3.6 3 3 A 7 SER HBx A 7 SER HBy 1.0 1.8 2.2 4 4 A 9 ARG HDy A 9 ARG HGx 1.0 1.8 4.4 5 5 A 9 ARG HBx A 9 ARG HA 1.0 1.8 3.6 6 6 A 9 ARG HDy A 9 ARG HBy 1.0 1.8 3.6 7 7 A 9 ARG HA A 9 ARG HGy 1.0 1.8 3.6 8 8 A 9 ARG HBy A 9 ARG HGy 1.0 1.8 3.6 9 9 A 9 ARG HDy A 9 ARG HBx 1.0 1.8 4.4 10 10 A 9 ARG HBx A 9 ARG HGy 1.0 1.8 2.8 11 11 A 9 ARG HDy A 9 ARG HA 1.0 1.8 4.4 12 12 A 9 ARG HDy A 9 ARG HGy 1.0 1.8 4.4 13 13 A 9 ARG HA A 9 ARG HBy 1.0 1.8 4.4 14 14 A 10 GLU HBy A 10 GLU HGy 1.0 1.8 3.6 15 15 A 10 GLU HBx A 10 GLU HA 1.0 1.8 3.6 16 16 A 10 GLU HBy A 10 GLU HA 1.0 1.8 3.6 17 17 A 10 GLU HBx A 10 GLU HGy 1.0 1.8 3.6 18 18 A 10 GLU HA A 10 GLU HGy 1.0 1.8 3.6 19 19 A 12 LEU HA A 13 TYR HD% 1.0 1.8 6.9 20 20 A 12 LEU HG A 12 LEU HDx% 1.0 1.8 4.6 21 21 A 12 LEU HA A 12 LEU HBy 1.0 1.8 3.6 22 22 A 12 LEU HG A 12 LEU HDy% 1.0 1.8 4.6 23 23 A 12 LEU HDx% A 12 LEU HBy 1.0 1.8 3.8 24 24 A 12 LEU HA A 12 LEU HDy% 1.0 1.8 4.6 25 25 A 12 LEU HA A 12 LEU HDx% 1.0 1.8 4.6 26 26 A 12 LEU HBy A 12 LEU HDy% 1.0 1.8 4.6 27 27 A 12 LEU HG A 12 LEU HBy 1.0 1.8 2.8 28 28 A 12 LEU HA A 12 LEU HG 1.0 1.8 2.8 29 29 A 13 TYR HBx A 13 TYR HA 1.0 1.8 4.4 30 30 A 13 TYR HD% A 13 TYR HBy 1.0 1.8 5.7 31 31 A 13 TYR HD% A 13 TYR HBx 1.0 1.8 5.7 32 32 A 13 TYR HA A 13 TYR HBy 1.0 1.8 4.4 33 33 A 13 TYR HD% A 13 TYR HA 1.0 1.8 6.5 34 34 A 13 TYR HBx A 13 TYR HE% 1.0 1.8 6.9 35 35 A 14 PHE HBy A 14 PHE HA 1.0 1.8 4.4 36 36 A 14 PHE HBx A 14 PHE HD% 1.0 1.8 5.7 37 37 A 14 PHE HA A 14 PHE HD% 1.0 1.8 6.5 38 38 A 14 PHE HBy A 14 PHE HD% 1.0 1.8 5.7 39 39 A 14 PHE HA A 14 PHE HBx 1.0 1.8 4.4 40 40 A 15 GLN HBx A 15 GLN HA 1.0 1.8 3.6 41 41 A 15 GLN HA A 15 GLN HBy 1.0 1.8 3.6 42 42 A 15 GLN HA A 15 GLN HGy 1.0 1.8 3.6 43 43 A 18 MET HA A 18 MET HBx 1.0 1.8 3.6 44 44 A 20 ALA HA A 18 MET HBx 1.0 1.8 4.4 45 45 A 18 MET HA A 18 MET HBy 1.0 1.8 3.6 46 46 A 18 MET HBy A 18 MET HGx 1.0 1.8 3.6 47 47 A 18 MET HA A 18 MET HGx 1.0 1.8 3.6 48 48 A 18 MET HA A 18 MET HGy 1.0 1.8 3.6 49 49 A 20 ALA HB% A 18 MET HBx 1.0 1.8 5.4 50 50 A 19 ALA HB% A 19 ALA HA 1.0 1.8 3.8 51 51 A 20 ALA HA A 21 PRO HDy 1.0 1.8 3.6 52 52 A 20 ALA HA A 20 ALA HB% 1.0 1.8 4.6 53 53 A 21 PRO HGy A 21 PRO HBx 1.0 1.8 4.4 54 54 A 21 PRO HBy A 21 PRO HGx 1.0 1.8 3.6 55 55 A 21 PRO HBy A 21 PRO HA 1.0 1.8 4.4 56 56 A 21 PRO HBx A 21 PRO HBy 1.0 1.8 4.4 57 57 A 21 PRO HGy A 21 PRO HA 1.0 1.8 4.4 58 58 A 21 PRO HBx A 21 PRO HA 1.0 1.8 4.4 59 59 A 21 PRO HBx A 21 PRO HGx 1.0 1.8 3.6 60 60 A 21 PRO HGx A 21 PRO HDx 1.0 1.8 4.8 61 61 A 22 ALA HB% A 84 PRO HA 1.0 1.8 5.4 62 62 A 22 ALA HB% A 84 PRO HBx 1.0 1.8 5.4 63 63 A 22 ALA HB% A 84 PRO HBy 1.0 1.8 5.4 64 64 A 22 ALA HA A 44 ILE HD1% 1.0 1.8 5.8 65 65 A 22 ALA HB% A 44 ILE HD1% 1.0 1.8 5.6 66 66 A 23 ARG HA A 23 ARG HBx 1.0 1.8 4.4 67 67 A 23 ARG HA A 23 ARG HGy 1.0 1.8 3.6 68 68 A 24 PHE HD% A 23 ARG HGy 1.0 1.8 6.5 69 69 A 24 PHE HE% A 23 ARG HBy 1.0 1.8 8.1 70 69 A 24 PHE HD% A 23 ARG HBy 1.0 1.8 8.1 71 69 A 23 ARG HBx A 24 PHE HE% 1.0 1.8 8.1 72 69 A 23 ARG HBx A 24 PHE HD% 1.0 1.8 8.1 73 70 A 23 ARG HA A 23 ARG HBy 1.0 1.8 4.4 74 71 A 24 PHE HA A 24 PHE HBy 1.0 1.8 4.4 75 72 A 24 PHE HD% A 44 ILE HG1x 1.0 1.8 7.7 76 72 A 24 PHE HE% A 44 ILE HG1x 1.0 1.8 7.7 77 72 A 24 PHE HE% A 44 ILE HG1y 1.0 1.8 7.7 78 72 A 24 PHE HD% A 44 ILE HG1y 1.0 1.8 7.7 79 73 A 24 PHE HD% A 85 TYR HA 1.0 1.8 6.9 80 74 A 41 TYR HD% A 24 PHE HBy 1.0 1.8 6.5 81 75 A 44 ILE HD1% A 24 PHE HD% 1.0 1.8 7.9 82 76 A 24 PHE HD% A 43 ARG HBy 1.0 1.8 7.7 83 76 A 24 PHE HE% A 43 ARG HBy 1.0 1.8 7.7 84 76 A 24 PHE HE% A 43 ARG HBx 1.0 1.8 7.7 85 76 A 24 PHE HD% A 43 ARG HBx 1.0 1.8 7.7 86 77 A 24 PHE HBx A 85 TYR HBy 1.0 1.8 4.4 87 78 A 24 PHE HA A 43 ARG HA 1.0 1.8 4.4 88 79 A 24 PHE HBy A 26 VAL HGy% 1.0 1.8 7.9 89 79 A 26 VAL HGx% A 24 PHE HBy 1.0 1.8 7.9 90 79 A 24 PHE HBx A 26 VAL HGx% 1.0 1.8 7.9 91 79 A 24 PHE HBx A 26 VAL HGy% 1.0 1.8 7.9 92 80 A 24 PHE HD% A 24 PHE HA 1.0 1.8 6.5 93 81 A 24 PHE HD% A 41 TYR HBy 1.0 1.8 6.5 94 82 A 24 PHE HD% A 41 TYR HD% 1.0 1.8 8.7 95 83 A 24 PHE HE% A 43 ARG HDy 1.0 1.8 6.5 96 84 A 41 TYR HBy A 24 PHE HBy 1.0 1.8 4.8 97 85 A 24 PHE HA A 24 PHE HBx 1.0 1.8 4.4 98 86 A 24 PHE HBx A 41 TYR HD% 1.0 1.8 6.5 99 87 A 24 PHE HD% A 41 TYR HE% 1.0 1.8 9.1 100 88 A 24 PHE HBx A 24 PHE HBy 1.0 1.8 2.8 101 89 A 24 PHE HD% A 24 PHE HBx 1.0 1.8 5.7 102 90 A 24 PHE HD% A 44 ILE HG1y 1.0 1.8 6.9 103 91 A 44 ILE HD1% A 24 PHE HA 1.0 1.8 5.4 104 92 A 24 PHE HBx A 85 TYR HD% 1.0 1.8 6.5 105 93 A 24 PHE HD% A 26 VAL HGy% 1.0 1.8 9.0 106 93 A 24 PHE HE% A 26 VAL HGy% 1.0 1.8 9.0 107 93 A 24 PHE HE% A 26 VAL HGx% 1.0 1.8 9.0 108 93 A 24 PHE HD% A 26 VAL HGx% 1.0 1.8 9.0 109 94 A 24 PHE HA A 44 ILE HG2% 1.0 1.8 5.8 110 95 A 24 PHE HD% A 43 ARG HGy 1.0 1.8 7.7 111 95 A 24 PHE HE% A 43 ARG HGy 1.0 1.8 7.7 112 95 A 24 PHE HE% A 43 ARG HGx 1.0 1.8 7.7 113 95 A 24 PHE HD% A 43 ARG HGx 1.0 1.8 7.7 114 96 A 24 PHE HD% A 43 ARG HA 1.0 1.8 6.5 115 97 A 24 PHE HD% A 85 TYR HE% 1.0 1.8 8.7 116 98 A 25 CYS HA A 25 CYS HBy 1.0 1.8 4.4 117 99 A 25 CYS HA A 25 CYS HBx 1.0 1.8 4.4 118 100 A 84 PRO HA A 25 CYS HA 1.0 1.8 3.6 119 101 A 27 TYR HE% A 25 CYS HBx 1.0 1.8 5.7 120 102 A 61 ALA HB% A 25 CYS HBx 1.0 1.8 5.4 121 103 A 25 CYS HBy A 42 VAL HGy% 1.0 1.8 6.7 122 103 A 25 CYS HBx A 42 VAL HGy% 1.0 1.8 6.7 123 103 A 42 VAL HGx% A 25 CYS HBx 1.0 1.8 6.7 124 103 A 25 CYS HBy A 42 VAL HGx% 1.0 1.8 6.7 125 104 A 25 CYS HBy A 27 TYR HE% 1.0 1.8 6.5 126 105 A 84 PRO HA A 25 CYS HBx 1.0 1.8 5.7 127 105 A 84 PRO HA A 25 CYS HBy 1.0 1.8 5.7 128 106 A 61 ALA HB% A 25 CYS HBy 1.0 1.8 5.4 129 107 A 25 CYS HBy A 27 TYR HD% 1.0 1.8 6.9 130 108 A 25 CYS HA A 27 TYR HE% 1.0 1.8 6.9 131 109 A 27 TYR HD% A 25 CYS HBx 1.0 1.8 6.5 132 110 A 85 TYR HA A 25 CYS HA 1.0 1.8 4.8 133 111 A 25 CYS HBy A 25 CYS HBx 1.0 1.8 3.6 134 112 A 26 VAL HGx% A 85 TYR HBy 1.0 1.8 5.8 135 113 A 26 VAL HB A 83 GLU HGy 1.0 1.8 4.8 136 114 A 26 VAL HB A 28 TYR HE% 1.0 1.8 5.7 137 115 A 26 VAL HGx% A 38 LEU HA 1.0 1.8 5.4 138 116 A 41 TYR HD% A 26 VAL HGy% 1.0 1.8 7.5 139 117 A 26 VAL HA A 27 TYR HD% 1.0 1.8 6.5 140 118 A 26 VAL HGx% A 38 LEU HG 1.0 1.8 5.4 141 119 A 26 VAL HGx% A 41 TYR HE% 1.0 1.8 7.6 142 120 A 26 VAL HGx% A 41 TYR HD% 1.0 1.8 7.5 143 121 A 26 VAL HA A 26 VAL HGy% 1.0 1.8 5.4 144 122 A 26 VAL HGx% A 85 TYR HBx 1.0 1.8 5.8 145 123 A 26 VAL HGx% A 85 TYR HD% 1.0 1.8 7.9 146 124 A 26 VAL HGx% A 26 VAL HB 1.0 1.8 4.6 147 125 A 85 TYR HD% A 26 VAL HGy% 1.0 1.8 7.5 148 126 A 38 LEU HDy% A 26 VAL HGy% 1.0 1.8 5.6 149 127 A 26 VAL HB A 26 VAL HGy% 1.0 1.8 4.6 150 128 A 28 TYR HD% A 26 VAL HGy% 1.0 1.8 8.2 151 128 A 28 TYR HE% A 26 VAL HGy% 1.0 1.8 8.2 152 128 A 26 VAL HGx% A 28 TYR HE% 1.0 1.8 8.2 153 128 A 26 VAL HGx% A 28 TYR HD% 1.0 1.8 8.2 154 129 A 26 VAL HGx% A 26 VAL HA 1.0 1.8 5.4 155 130 A 85 TYR HA A 26 VAL HGy% 1.0 1.8 5.4 156 131 A 26 VAL HB A 41 TYR HD% 1.0 1.8 6.9 157 132 A 41 TYR HE% A 26 VAL HGy% 1.0 1.8 7.6 158 133 A 26 VAL HB A 41 TYR HE% 1.0 1.8 6.9 159 134 A 85 TYR HBx A 26 VAL HGy% 1.0 1.8 5.4 160 135 A 26 VAL HA A 41 TYR HA 1.0 1.8 4.4 161 136 A 26 VAL HGx% A 38 LEU HDx% 1.0 1.8 6.4 162 137 A 41 TYR HA A 26 VAL HGy% 1.0 1.8 5.4 163 138 A 26 VAL HGx% A 38 LEU HDy% 1.0 1.8 5.6 164 139 A 26 VAL HGy% A 85 TYR HBy 1.0 1.8 5.4 165 140 A 26 VAL HGx% A 26 VAL HGy% 1.0 1.8 5.6 166 141 A 26 VAL HGx% A 41 TYR HA 1.0 1.8 5.4 167 142 A 42 VAL HA A 27 TYR HE% 1.0 1.8 6.5 168 143 A 82 ALA HA A 27 TYR HBx 1.0 1.8 5.7 169 143 A 27 TYR HBy A 82 ALA HA 1.0 1.8 5.7 170 144 A 82 ALA HA A 27 TYR HD% 1.0 1.8 6.9 171 145 A 50 ILE HG2% A 27 TYR HBx 1.0 1.8 6.3 172 145 A 27 TYR HBy A 50 ILE HG2% 1.0 1.8 6.3 173 146 A 59 VAL HB A 27 TYR HE% 1.0 1.8 6.5 174 147 A 27 TYR HD% A 50 ILE HG1y 1.0 1.8 6.9 175 148 A 50 ILE HD1% A 27 TYR HE% 1.0 1.8 8.0 176 149 A 50 ILE HD1% A 27 TYR HD% 1.0 1.8 7.5 177 150 A 27 TYR HA A 27 TYR HE% 1.0 1.8 6.9 178 151 A 27 TYR HBy A 27 TYR HD% 1.0 1.8 5.7 179 152 A 80 LEU HG A 27 TYR HD% 1.0 1.8 6.5 180 153 A 27 TYR HA A 27 TYR HD% 1.0 1.8 6.5 181 154 A 82 ALA HA A 27 TYR HA 1.0 1.8 3.6 182 155 A 68 VAL HA A 27 TYR HE% 1.0 1.8 5.7 183 156 A 27 TYR HBy A 27 TYR HE% 1.0 1.8 6.5 184 157 A 68 VAL HA A 27 TYR HD% 1.0 1.8 6.9 185 158 A 27 TYR HE% A 80 LEU HDx% 1.0 1.8 7.6 186 159 A 50 ILE HG2% A 27 TYR HE% 1.0 1.8 8.0 187 160 A 27 TYR HE% A 59 VAL HGx% 1.0 1.8 6.8 188 161 A 50 ILE HG2% A 27 TYR HD% 1.0 1.8 7.5 189 162 A 27 TYR HBx A 39 LEU HBy 1.0 1.8 4.8 190 163 A 27 TYR HA A 81 ALA HB% 1.0 1.8 5.8 191 164 A 42 VAL HB A 27 TYR HE% 1.0 1.8 5.7 192 165 A 27 TYR HA A 82 ALA HB% 1.0 1.8 5.4 193 166 A 50 ILE HD1% A 27 TYR HBx 1.0 1.8 5.5 194 166 A 27 TYR HBy A 50 ILE HD1% 1.0 1.8 5.5 195 167 A 27 TYR HD% A 80 LEU HDx% 1.0 1.8 6.7 196 168 A 39 LEU HBx A 27 TYR HBx 1.0 1.8 4.4 197 169 A 27 TYR HD% A 59 VAL HGx% 1.0 1.8 7.5 198 170 A 27 TYR HBy A 42 VAL HGy% 1.0 1.8 7.5 199 170 A 27 TYR HBx A 42 VAL HGy% 1.0 1.8 7.5 200 170 A 42 VAL HGx% A 27 TYR HBx 1.0 1.8 7.5 201 170 A 42 VAL HGx% A 27 TYR HBy 1.0 1.8 7.5 202 171 A 27 TYR HBx A 80 LEU HDy% 1.0 1.8 5.4 203 172 A 80 LEU HDx% A 27 TYR HBx 1.0 1.8 5.4 204 173 A 28 TYR HD% A 27 TYR HA 1.0 1.8 6.5 205 174 A 27 TYR HD% A 68 VAL HGy% 1.0 1.8 8.2 206 174 A 27 TYR HE% A 68 VAL HGy% 1.0 1.8 8.2 207 174 A 68 VAL HGx% A 27 TYR HE% 1.0 1.8 8.2 208 174 A 27 TYR HD% A 68 VAL HGx% 1.0 1.8 8.2 209 175 A 42 VAL HB A 27 TYR HD% 1.0 1.8 6.5 210 176 A 27 TYR HA A 27 TYR HBx 1.0 1.8 5.3 211 176 A 27 TYR HBy A 27 TYR HA 1.0 1.8 5.3 212 177 A 27 TYR HD% A 42 VAL HGy% 1.0 1.8 8.2 213 177 A 42 VAL HGx% A 27 TYR HE% 1.0 1.8 8.2 214 177 A 42 VAL HGx% A 27 TYR HD% 1.0 1.8 8.2 215 177 A 27 TYR HE% A 42 VAL HGy% 1.0 1.8 8.2 216 178 A 39 LEU HDx% A 27 TYR HBx 1.0 1.8 5.4 217 179 A 28 TYR HD% A 28 TYR HA 1.0 1.8 6.5 218 180 A 28 TYR HE% A 38 LEU HBy 1.0 1.8 5.7 219 181 A 38 LEU HA A 28 TYR HA 1.0 1.8 4.4 220 182 A 28 TYR HD% A 83 GLU HBx 1.0 1.8 6.9 221 183 A 38 LEU HG A 28 TYR HD% 1.0 1.8 6.5 222 184 A 38 LEU HA A 28 TYR HBy 1.0 1.8 4.8 223 185 A 81 ALA HB% A 28 TYR HBx 1.0 1.8 5.4 224 186 A 38 LEU HDy% A 28 TYR HD% 1.0 1.8 7.5 225 187 A 81 ALA HB% A 28 TYR HBy 1.0 1.8 5.4 226 188 A 28 TYR HA A 28 TYR HBy 1.0 1.8 4.4 227 189 A 83 GLU HGy A 28 TYR HE% 1.0 1.8 6.5 228 190 A 28 TYR HA A 39 LEU HDy% 1.0 1.8 5.4 229 191 A 28 TYR HE% A 38 LEU HBx 1.0 1.8 6.5 230 192 A 28 TYR HD% A 36 ARG HGy 1.0 1.8 6.5 231 193 A 28 TYR HE% A 82 ALA HA 1.0 1.8 6.5 232 194 A 83 GLU HGy A 28 TYR HD% 1.0 1.8 6.9 233 195 A 28 TYR HE% A 28 TYR HBy 1.0 1.8 6.5 234 196 A 28 TYR HA A 39 LEU HG 1.0 1.8 4.4 235 197 A 28 TYR HE% A 28 TYR HBx 1.0 1.8 6.5 236 198 A 38 LEU HDy% A 28 TYR HE% 1.0 1.8 6.8 237 199 A 38 LEU HA A 28 TYR HBx 1.0 1.8 4.8 238 200 A 38 LEU HA A 28 TYR HE% 1.0 1.8 6.5 239 201 A 28 TYR HD% A 28 TYR HBy 1.0 1.8 5.7 240 202 A 28 TYR HD% A 28 TYR HBx 1.0 1.8 5.7 241 203 A 28 TYR HD% A 82 ALA HA 1.0 1.8 6.5 242 204 A 28 TYR HE% A 39 LEU HDy% 1.0 1.8 9.0 243 204 A 28 TYR HD% A 39 LEU HDy% 1.0 1.8 9.0 244 204 A 28 TYR HE% A 39 LEU HDx% 1.0 1.8 9.0 245 204 A 28 TYR HD% A 39 LEU HDx% 1.0 1.8 9.0 246 205 A 28 TYR HD% A 38 LEU HDx% 1.0 1.8 7.9 247 206 A 28 TYR HA A 39 LEU HBx 1.0 1.8 4.8 248 207 A 28 TYR HE% A 28 TYR HA 1.0 1.8 6.9 249 208 A 28 TYR HBx A 39 LEU HG 1.0 1.8 4.8 250 209 A 28 TYR HD% A 38 LEU HBx 1.0 1.8 6.5 251 210 A 38 LEU HA A 28 TYR HD% 1.0 1.8 5.7 252 211 A 28 TYR HBy A 28 TYR HBx 1.0 1.8 3.6 253 212 A 28 TYR HD% A 37 VAL HA 1.0 1.8 6.9 254 213 A 28 TYR HD% A 38 LEU HBy 1.0 1.8 6.5 255 214 A 28 TYR HA A 28 TYR HBx 1.0 1.8 4.4 256 215 A 28 TYR HD% A 81 ALA HB% 1.0 1.8 7.5 257 216 A 39 LEU HDx% A 29 ASP HBx 1.0 1.8 5.4 258 217 A 29 ASP HBx A 37 VAL HGx% 1.0 1.8 5.4 259 218 A 29 ASP HA A 29 ASP HBy 1.0 1.8 4.4 260 219 A 29 ASP HA A 37 VAL HB 1.0 1.8 4.8 261 220 A 79 TRP HZ3 A 29 ASP HBy 1.0 1.8 5.3 262 220 A 29 ASP HBx A 79 TRP HZ3 1.0 1.8 5.3 263 221 A 37 VAL HGx% A 29 ASP HBy 1.0 1.8 5.4 264 222 A 29 ASP HBx A 37 VAL HGy% 1.0 1.8 5.4 265 223 A 39 LEU HDx% A 29 ASP HBy 1.0 1.8 4.6 266 224 A 29 ASP HA A 79 TRP HE3 1.0 1.8 3.6 267 225 A 29 ASP HA A 80 LEU HDx% 1.0 1.8 5.4 268 226 A 29 ASP HA A 29 ASP HBx 1.0 1.8 4.4 269 227 A 39 LEU HDx% A 29 ASP HA 1.0 1.8 5.4 270 228 A 29 ASP HA A 79 TRP HZ3 1.0 1.8 4.4 271 229 A 29 ASP HBy A 37 VAL HGy% 1.0 1.8 5.4 272 230 A 79 TRP HE3 A 29 ASP HBy 1.0 1.8 5.3 273 230 A 29 ASP HBx A 79 TRP HE3 1.0 1.8 5.3 274 231 A 29 ASP HBx A 29 ASP HBy 1.0 1.8 3.6 275 232 A 37 VAL HB A 29 ASP HBx 1.0 1.8 4.4 276 233 A 30 GLY HAx A 30 GLY HAy 1.0 1.8 4.4 277 234 A 31 HIS HBy A 31 HIS HBx 1.0 1.8 3.6 278 235 A 31 HIS HBy A 31 HIS HD2 1.0 1.8 4.4 279 236 A 31 HIS HBx A 31 HIS HD2 1.0 1.8 4.4 280 237 A 31 HIS HD2 A 31 HIS HA 1.0 1.8 4.4 281 238 A 31 HIS HBy A 31 HIS HA 1.0 1.8 4.4 282 239 A 31 HIS HBx A 31 HIS HA 1.0 1.8 3.6 283 240 A 31 HIS HE1 A 32 LEU HDx% 1.0 1.8 5.4 284 241 A 31 HIS HD2 A 32 LEU HDx% 1.0 1.8 5.8 285 242 A 32 LEU HBx A 32 LEU HDx% 1.0 1.8 4.6 286 243 A 32 LEU HBy A 33 PRO HDy 1.0 1.8 6.2 287 243 A 32 LEU HBx A 33 PRO HDy 1.0 1.8 6.2 288 243 A 33 PRO HDx A 32 LEU HBy 1.0 1.8 6.2 289 243 A 32 LEU HBx A 33 PRO HDx 1.0 1.8 6.2 290 244 A 32 LEU HDy% A 33 PRO HDy 1.0 1.8 5.4 291 245 A 32 LEU HG A 33 PRO HDy 1.0 1.8 4.8 292 246 A 32 LEU HG A 32 LEU HDy% 1.0 1.8 4.6 293 247 A 33 PRO HDx A 32 LEU HDy% 1.0 1.8 5.4 294 248 A 32 LEU HA A 32 LEU HDx% 1.0 1.8 5.4 295 249 A 32 LEU HBx A 32 LEU HA 1.0 1.8 3.6 296 250 A 32 LEU HBx A 32 LEU HDy% 1.0 1.8 4.6 297 251 A 32 LEU HA A 32 LEU HBy 1.0 1.8 3.6 298 252 A 32 LEU HDx% A 33 PRO HDy 1.0 1.8 5.4 299 253 A 32 LEU HBy A 32 LEU HDy% 1.0 1.8 4.6 300 254 A 34 ALA HB% A 32 LEU HDy% 1.0 1.8 6.8 301 255 A 32 LEU HDx% A 32 LEU HBy 1.0 1.8 4.6 302 256 A 33 PRO HDx A 32 LEU HDx% 1.0 1.8 5.4 303 257 A 32 LEU HG A 32 LEU HDx% 1.0 1.8 4.6 304 258 A 32 LEU HA A 33 PRO HDy 1.0 1.8 3.6 305 259 A 32 LEU HA A 32 LEU HDy% 1.0 1.8 4.6 306 260 A 32 LEU HA A 33 PRO HGy 1.0 1.8 4.4 307 261 A 32 LEU HG A 32 LEU HA 1.0 1.8 4.4 308 262 A 33 PRO HDx A 32 LEU HA 1.0 1.8 3.6 309 263 A 33 PRO HBy A 33 PRO HA 1.0 1.8 4.4 310 264 A 33 PRO HA A 33 PRO HBx 1.0 1.8 4.4 311 265 A 33 PRO HA A 33 PRO HGx 1.0 1.8 4.4 312 266 A 33 PRO HGy A 33 PRO HDy 1.0 1.8 3.6 313 267 A 33 PRO HGx A 33 PRO HDy 1.0 1.8 4.4 314 268 A 33 PRO HBy A 33 PRO HDy 1.0 1.8 4.4 315 269 A 33 PRO HDx A 33 PRO HDy 1.0 1.8 3.6 316 270 A 33 PRO HDx A 33 PRO HBx 1.0 1.8 4.8 317 271 A 33 PRO HDx A 33 PRO HGy 1.0 1.8 4.4 318 272 A 33 PRO HDx A 33 PRO HBy 1.0 1.8 4.4 319 273 A 33 PRO HDx A 33 PRO HGx 1.0 1.8 4.8 320 274 A 33 PRO HGy A 33 PRO HBy 1.0 1.8 3.6 321 275 A 33 PRO HGy A 33 PRO HA 1.0 1.8 4.4 322 276 A 33 PRO HGy A 33 PRO HBx 1.0 1.8 3.6 323 277 A 33 PRO HBx A 33 PRO HDy 1.0 1.8 4.4 324 278 A 33 PRO HBx A 33 PRO HGx 1.0 1.8 3.6 325 279 A 34 ALA HB% A 35 THR HG2% 1.0 1.8 5.6 326 280 A 35 THR HG2% A 35 THR HB 1.0 1.8 3.4 327 281 A 35 THR HB A 35 THR HA 1.0 1.8 3.6 328 282 A 35 THR HG2% A 35 THR HA 1.0 1.8 3.8 329 283 A 36 ARG HGy A 36 ARG HDy 1.0 1.8 4.4 330 284 A 36 ARG HDy A 36 ARG HGx 1.0 1.8 4.4 331 285 A 36 ARG HGx A 36 ARG HBy 1.0 1.8 4.4 332 286 A 36 ARG HBx A 36 ARG HA 1.0 1.8 4.4 333 287 A 36 ARG HBy A 36 ARG HA 1.0 1.8 4.4 334 288 A 37 VAL HA A 37 VAL HB 1.0 1.8 3.6 335 289 A 37 VAL HA A 37 VAL HGy% 1.0 1.8 4.6 336 290 A 37 VAL HB A 37 VAL HGx% 1.0 1.8 4.6 337 291 A 37 VAL HB A 37 VAL HGy% 1.0 1.8 4.6 338 292 A 37 VAL HA A 37 VAL HGx% 1.0 1.8 4.6 339 293 A 38 LEU HDy% A 41 TYR HE% 1.0 1.8 6.8 340 294 A 38 LEU HDx% A 38 LEU HBx 1.0 1.8 4.6 341 295 A 38 LEU HDy% A 38 LEU HBx 1.0 1.8 4.6 342 296 A 38 LEU HA A 38 LEU HG 1.0 1.8 4.4 343 297 A 38 LEU HA A 38 LEU HDy% 1.0 1.8 4.6 344 298 A 38 LEU HA A 38 LEU HBy 1.0 1.8 3.6 345 299 A 38 LEU HA A 38 LEU HDx% 1.0 1.8 5.4 346 300 A 38 LEU HA A 38 LEU HBx 1.0 1.8 4.4 347 301 A 38 LEU HDy% A 41 TYR HD% 1.0 1.8 7.5 348 302 A 38 LEU HDx% A 40 MET HA 1.0 1.8 5.4 349 303 A 38 LEU HDy% A 39 LEU HBy 1.0 1.8 5.4 350 304 A 38 LEU HDx% A 41 TYR HE% 1.0 1.8 6.8 351 305 A 38 LEU HG A 38 LEU HDy% 1.0 1.8 4.6 352 306 A 38 LEU HDy% A 38 LEU HBy 1.0 1.8 4.6 353 307 A 38 LEU HG A 38 LEU HBy 1.0 1.8 4.4 354 308 A 38 LEU HDx% A 38 LEU HBy 1.0 1.8 4.6 355 309 A 38 LEU HDx% A 41 TYR HD% 1.0 1.8 7.5 356 310 A 38 LEU HG A 38 LEU HDx% 1.0 1.8 4.6 357 311 A 79 TRP HZ3 A 39 LEU HDy% 1.0 1.8 6.6 358 311 A 39 LEU HDx% A 79 TRP HZ3 1.0 1.8 6.6 359 312 A 39 LEU HA A 39 LEU HDy% 1.0 1.8 4.6 360 313 A 39 LEU HDx% A 39 LEU HDy% 1.0 1.8 5.6 361 314 A 79 TRP HH2 A 39 LEU HDy% 1.0 1.8 6.6 362 314 A 39 LEU HDx% A 79 TRP HH2 1.0 1.8 6.6 363 315 A 50 ILE HD1% A 39 LEU HDy% 1.0 1.8 6.8 364 315 A 50 ILE HD1% A 39 LEU HDx% 1.0 1.8 6.8 365 316 A 39 LEU HDx% A 80 LEU HDy% 1.0 1.8 8.0 366 316 A 39 LEU HDy% A 80 LEU HDy% 1.0 1.8 8.0 367 316 A 80 LEU HDx% A 39 LEU HDy% 1.0 1.8 8.0 368 316 A 39 LEU HDx% A 80 LEU HDx% 1.0 1.8 8.0 369 317 A 39 LEU HBy A 39 LEU HDy% 1.0 1.8 4.6 370 318 A 39 LEU HDx% A 39 LEU HBy 1.0 1.8 4.6 371 319 A 39 LEU HA A 39 LEU HBy 1.0 1.8 4.4 372 320 A 39 LEU HBx A 39 LEU HDy% 1.0 1.8 5.4 373 321 A 39 LEU HDx% A 39 LEU HBx 1.0 1.8 4.6 374 322 A 39 LEU HDx% A 39 LEU HA 1.0 1.8 5.8 375 323 A 39 LEU HG A 39 LEU HDx% 1.0 1.8 4.6 376 324 A 39 LEU HG A 39 LEU HDy% 1.0 1.8 4.6 377 325 A 39 LEU HG A 39 LEU HBx 1.0 1.8 4.4 378 326 A 39 LEU HG A 39 LEU HBy 1.0 1.8 5.3 379 326 A 39 LEU HG A 39 LEU HBx 1.0 1.8 5.3 380 327 A 39 LEU HG A 39 LEU HA 1.0 1.8 4.8 381 328 A 39 LEU HA A 39 LEU HBx 1.0 1.8 4.4 382 329 A 40 MET HA A 41 TYR HE% 1.0 1.8 6.9 383 330 A 40 MET HE% A 50 ILE HA 1.0 1.8 4.6 384 331 A 40 MET HA A 40 MET HGy 1.0 1.8 3.6 385 332 A 40 MET HE% A 42 VAL HGy% 1.0 1.8 5.6 386 333 A 40 MET HA A 40 MET HE% 1.0 1.8 5.8 387 334 A 50 ILE HA A 40 MET HGy 1.0 1.8 4.4 388 335 A 40 MET HGy A 40 MET HBy 1.0 1.8 4.4 389 336 A 40 MET HA A 40 MET HBx 1.0 1.8 3.6 390 337 A 50 ILE HG2% A 40 MET HE% 1.0 1.8 5.6 391 338 A 40 MET HA A 40 MET HBy 1.0 1.8 4.4 392 339 A 50 ILE HD1% A 40 MET HBx 1.0 1.8 6.7 393 339 A 50 ILE HD1% A 40 MET HBy 1.0 1.8 6.7 394 340 A 40 MET HE% A 40 MET HGy 1.0 1.8 5.4 395 341 A 40 MET HA A 41 TYR HD% 1.0 1.8 6.5 396 342 A 40 MET HGy A 40 MET HBx 1.0 1.8 4.4 397 343 A 50 ILE HG2% A 40 MET HBx 1.0 1.8 6.3 398 343 A 50 ILE HG2% A 40 MET HBy 1.0 1.8 6.3 399 344 A 40 MET HBy A 40 MET HBx 1.0 1.8 3.6 400 345 A 40 MET HBx A 42 VAL HGy% 1.0 1.8 7.5 401 345 A 40 MET HBy A 42 VAL HGy% 1.0 1.8 7.5 402 345 A 42 VAL HGx% A 40 MET HBx 1.0 1.8 7.5 403 345 A 42 VAL HGx% A 40 MET HBy 1.0 1.8 7.5 404 346 A 85 TYR HE% A 41 TYR HE% 1.0 1.8 8.7 405 347 A 41 TYR HE% A 85 TYR HBy 1.0 1.8 7.7 406 347 A 41 TYR HD% A 85 TYR HBy 1.0 1.8 7.7 407 347 A 85 TYR HBx A 41 TYR HE% 1.0 1.8 7.7 408 347 A 41 TYR HD% A 85 TYR HBx 1.0 1.8 7.7 409 348 A 41 TYR HE% A 41 TYR HBx 1.0 1.8 6.5 410 349 A 41 TYR HBy A 41 TYR HE% 1.0 1.8 6.9 411 350 A 85 TYR HD% A 41 TYR HE% 1.0 1.8 8.7 412 351 A 85 TYR HD% A 41 TYR HD% 1.0 1.8 8.7 413 352 A 41 TYR HA A 41 TYR HD% 1.0 1.8 6.5 414 353 A 41 TYR HD% A 41 TYR HBx 1.0 1.8 5.7 415 354 A 41 TYR HA A 41 TYR HBx 1.0 1.8 4.4 416 355 A 41 TYR HA A 42 VAL HGy% 1.0 1.8 5.4 417 356 A 41 TYR HBy A 41 TYR HA 1.0 1.8 4.4 418 357 A 41 TYR HBy A 41 TYR HBx 1.0 1.8 3.6 419 358 A 41 TYR HBy A 41 TYR HD% 1.0 1.8 5.7 420 359 A 42 VAL HB A 42 VAL HGy% 1.0 1.8 4.6 421 360 A 42 VAL HGx% A 59 VAL HGy% 1.0 1.8 8.8 422 360 A 42 VAL HGy% A 59 VAL HGy% 1.0 1.8 8.8 423 360 A 59 VAL HGx% A 42 VAL HGy% 1.0 1.8 8.8 424 360 A 42 VAL HGx% A 59 VAL HGx% 1.0 1.8 8.8 425 361 A 50 ILE HD1% A 42 VAL HGy% 1.0 1.8 7.6 426 361 A 42 VAL HGx% A 50 ILE HD1% 1.0 1.8 7.6 427 362 A 42 VAL HGx% A 42 VAL HGy% 1.0 1.8 4.8 428 363 A 42 VAL HGx% A 42 VAL HA 1.0 1.8 4.6 429 364 A 42 VAL HA A 42 VAL HGy% 1.0 1.8 4.6 430 365 A 61 ALA HB% A 42 VAL HGy% 1.0 1.8 5.6 431 366 A 61 ALA HB% A 42 VAL HGx% 1.0 1.8 5.6 432 367 A 42 VAL HGx% A 42 VAL HB 1.0 1.8 4.6 433 368 A 61 ALA HB% A 42 VAL HB 1.0 1.8 5.4 434 369 A 43 ARG HBy A 43 ARG HGy 1.0 1.8 3.6 435 370 A 43 ARG HA A 43 ARG HGy 1.0 1.8 5.3 436 370 A 43 ARG HA A 43 ARG HGx 1.0 1.8 5.3 437 371 A 43 ARG HA A 43 ARG HBy 1.0 1.8 5.3 438 371 A 43 ARG HBx A 43 ARG HA 1.0 1.8 5.3 439 372 A 43 ARG HA A 43 ARG HDy 1.0 1.8 5.3 440 372 A 43 ARG HA A 43 ARG HDx 1.0 1.8 5.3 441 373 A 46 THR HG2% A 43 ARG HBy 1.0 1.8 4.6 442 374 A 43 ARG HBy A 43 ARG HDy 1.0 1.8 5.4 443 374 A 43 ARG HBx A 43 ARG HDy 1.0 1.8 5.4 444 374 A 43 ARG HDx A 43 ARG HBy 1.0 1.8 5.4 445 374 A 43 ARG HBx A 43 ARG HDx 1.0 1.8 5.4 446 375 A 43 ARG HDy A 43 ARG HGy 1.0 1.8 5.4 447 375 A 43 ARG HDx A 43 ARG HGy 1.0 1.8 5.4 448 375 A 43 ARG HGx A 43 ARG HDy 1.0 1.8 5.4 449 375 A 43 ARG HGx A 43 ARG HDx 1.0 1.8 5.4 450 376 A 46 THR HG2% A 43 ARG HDy 1.0 1.8 6.3 451 376 A 43 ARG HDx A 46 THR HG2% 1.0 1.8 6.3 452 377 A 46 THR HG2% A 43 ARG HGy 1.0 1.8 5.4 453 378 A 44 ILE HD1% A 64 GLN HGy 1.0 1.8 5.8 454 379 A 44 ILE HD1% A 44 ILE HA 1.0 1.8 5.4 455 380 A 44 ILE HA A 44 ILE HB 1.0 1.8 3.6 456 381 A 61 ALA HB% A 44 ILE HA 1.0 1.8 4.6 457 382 A 44 ILE HG2% A 44 ILE HA 1.0 1.8 4.6 458 383 A 44 ILE HG1y A 44 ILE HA 1.0 1.8 3.6 459 384 A 84 PRO HA A 44 ILE HD1% 1.0 1.8 5.8 460 385 A 44 ILE HD1% A 64 GLN HA 1.0 1.8 4.6 461 386 A 44 ILE HG2% A 64 GLN HA 1.0 1.8 5.4 462 387 A 44 ILE HD1% A 64 GLN HGx 1.0 1.8 5.8 463 388 A 44 ILE HD1% A 63 ASP HA 1.0 1.8 4.6 464 389 A 44 ILE HG2% A 63 ASP HA 1.0 1.8 3.8 465 390 A 44 ILE HD1% A 44 ILE HG2% 1.0 1.8 5.6 466 391 A 44 ILE HG1y A 44 ILE HG2% 1.0 1.8 4.6 467 392 A 44 ILE HD1% A 44 ILE HG1y 1.0 1.8 4.6 468 393 A 44 ILE HG2% A 44 ILE HB 1.0 1.8 4.6 469 394 A 44 ILE HG2% A 61 ALA HB% 1.0 1.8 5.6 470 395 A 44 ILE HD1% A 44 ILE HG1x 1.0 1.8 4.6 471 396 A 44 ILE HD1% A 64 GLN HBy 1.0 1.8 5.4 472 397 A 44 ILE HD1% A 64 GLN HBx 1.0 1.8 5.4 473 398 A 84 PRO HBx A 44 ILE HD1% 1.0 1.8 5.8 474 399 A 44 ILE HD1% A 63 ASP HBy 1.0 1.8 6.7 475 399 A 44 ILE HD1% A 63 ASP HBx 1.0 1.8 6.7 476 400 A 44 ILE HG2% A 63 ASP HBy 1.0 1.8 6.3 477 400 A 44 ILE HG2% A 63 ASP HBx 1.0 1.8 6.3 478 401 A 46 THR HG2% A 46 THR HA 1.0 1.8 3.8 479 402 A 46 THR HA A 46 THR HB 1.0 1.8 2.8 480 403 A 47 THR HG2% A 58 GLU HA 1.0 1.8 5.8 481 404 A 47 THR HG2% A 59 VAL HGy% 1.0 1.8 6.8 482 405 A 47 THR HA A 59 VAL HGy% 1.0 1.8 6.6 483 405 A 59 VAL HGx% A 47 THR HA 1.0 1.8 6.6 484 406 A 47 THR HB A 71 THR HG2% 1.0 1.8 4.6 485 407 A 47 THR HG2% A 47 THR HB 1.0 1.8 4.6 486 408 A 47 THR HB A 58 GLU HGx 1.0 1.8 5.3 487 408 A 47 THR HB A 58 GLU HGy 1.0 1.8 5.3 488 409 A 47 THR HA A 47 THR HB 1.0 1.8 3.6 489 410 A 47 THR HG2% A 47 THR HA 1.0 1.8 4.6 490 411 A 47 THR HA A 60 GLU HA 1.0 1.8 4.4 491 412 A 47 THR HA A 71 THR HG2% 1.0 1.8 5.4 492 413 A 47 THR HG2% A 71 THR HA 1.0 1.8 5.4 493 414 A 47 THR HG2% A 60 GLU HBy 1.0 1.8 5.4 494 415 A 47 THR HB A 60 GLU HA 1.0 1.8 4.4 495 416 A 47 THR HG2% A 60 GLU HBx 1.0 1.8 5.4 496 417 A 47 THR HG2% A 60 GLU HGx 1.0 1.8 6.3 497 417 A 47 THR HG2% A 60 GLU HGy 1.0 1.8 6.3 498 418 A 47 THR HA A 60 GLU HBy 1.0 1.8 4.8 499 419 A 47 THR HG2% A 71 THR HB 1.0 1.8 5.4 500 420 A 48 ALA HB% A 48 ALA HA 1.0 1.8 4.6 501 421 A 58 GLU HA A 49 THR HA 1.0 1.8 3.6 502 422 A 49 THR HG2% A 49 THR HB 1.0 1.8 3.8 503 423 A 59 VAL HGx% A 49 THR HA 1.0 1.8 5.8 504 424 A 49 THR HA A 59 VAL HGy% 1.0 1.8 5.4 505 425 A 49 THR HA A 49 THR HB 1.0 1.8 4.4 506 426 A 49 THR HA A 58 GLU HBy 1.0 1.8 4.4 507 427 A 49 THR HA A 49 THR HG2% 1.0 1.8 4.6 508 428 A 49 THR HG2% A 56 GLU HA 1.0 1.8 5.4 509 429 A 50 ILE HD1% A 59 VAL HGy% 1.0 1.8 6.4 510 430 A 50 ILE HG1y A 50 ILE HG1x 1.0 1.8 3.6 511 431 A 50 ILE HD1% A 50 ILE HG1x 1.0 1.8 4.6 512 432 A 50 ILE HA A 50 ILE HB 1.0 1.8 3.6 513 433 A 50 ILE HB A 50 ILE HG1x 1.0 1.8 3.6 514 434 A 50 ILE HD1% A 59 VAL HGy% 1.0 1.8 6.8 515 434 A 50 ILE HD1% A 59 VAL HGx% 1.0 1.8 6.8 516 435 A 50 ILE HG2% A 50 ILE HD1% 1.0 1.8 5.6 517 436 A 50 ILE HG2% A 50 ILE HA 1.0 1.8 4.6 518 437 A 50 ILE HG2% A 50 ILE HG1x 1.0 1.8 4.6 519 438 A 50 ILE HA A 50 ILE HG1x 1.0 1.8 4.4 520 439 A 50 ILE HD1% A 50 ILE HA 1.0 1.8 5.4 521 440 A 50 ILE HA A 50 ILE HG1y 1.0 1.8 4.4 522 441 A 50 ILE HG2% A 57 PHE HD% 1.0 1.8 7.5 523 442 A 50 ILE HG2% A 50 ILE HG1y 1.0 1.8 4.6 524 443 A 50 ILE HD1% A 50 ILE HG1y 1.0 1.8 4.6 525 444 A 50 ILE HB A 57 PHE HD% 1.0 1.8 6.5 526 445 A 50 ILE HD1% A 57 PHE HD% 1.0 1.8 7.9 527 446 A 57 PHE HE% A 50 ILE HG1x 1.0 1.8 7.7 528 446 A 57 PHE HD% A 50 ILE HG1x 1.0 1.8 7.7 529 446 A 50 ILE HG1y A 57 PHE HE% 1.0 1.8 7.7 530 446 A 50 ILE HG1y A 57 PHE HD% 1.0 1.8 7.7 531 447 A 50 ILE HG2% A 52 ALA HB% 1.0 1.8 6.4 532 448 A 50 ILE HD1% A 50 ILE HB 1.0 1.8 4.6 533 449 A 50 ILE HB A 50 ILE HG1y 1.0 1.8 3.6 534 450 A 50 ILE HG2% A 50 ILE HB 1.0 1.8 4.6 535 451 A 59 VAL HGx% A 50 ILE HB 1.0 1.8 5.4 536 452 A 50 ILE HG1y A 57 PHE HD% 1.0 1.8 6.5 537 453 A 50 ILE HG1y A 57 PHE HBy 1.0 1.8 4.4 538 454 A 50 ILE HG1y A 57 PHE HBx 1.0 1.8 4.8 539 455 A 57 PHE HE% A 51 THR HA 1.0 1.8 6.9 540 456 A 51 THR HA A 56 GLU HGx 1.0 1.8 4.4 541 457 A 51 THR HA A 51 THR HB 1.0 1.8 3.6 542 458 A 51 THR HA A 51 THR HG2% 1.0 1.8 4.6 543 459 A 56 GLU HA A 51 THR HA 1.0 1.8 3.6 544 460 A 51 THR HB A 51 THR HG2% 1.0 1.8 3.8 545 461 A 57 PHE HD% A 51 THR HA 1.0 1.8 6.5 546 462 A 56 GLU HA A 51 THR HB 1.0 1.8 4.8 547 463 A 56 GLU HA A 51 THR HG2% 1.0 1.8 5.4 548 464 A 79 TRP HZ3 A 52 ALA HB% 1.0 1.8 4.6 549 465 A 57 PHE HE% A 52 ALA HB% 1.0 1.8 6.8 550 466 A 57 PHE HD% A 52 ALA HB% 1.0 1.8 6.7 551 467 A 52 ALA HB% A 52 ALA HA 1.0 1.8 5.4 552 468 A 79 TRP HH2 A 52 ALA HB% 1.0 1.8 4.6 553 469 A 79 TRP HZ3 A 53 ARG HGy 1.0 1.8 5.7 554 469 A 79 TRP HZ3 A 53 ARG HGx 1.0 1.8 5.7 555 470 A 79 TRP HH2 A 53 ARG HBy 1.0 1.8 5.7 556 470 A 79 TRP HH2 A 53 ARG HBx 1.0 1.8 5.7 557 471 A 53 ARG HA A 53 ARG HDy 1.0 1.8 4.4 558 472 A 53 ARG HA A 53 ARG HGy 1.0 1.8 4.4 559 473 A 53 ARG HBx A 53 ARG HA 1.0 1.8 4.4 560 474 A 53 ARG HA A 53 ARG HBy 1.0 1.8 3.6 561 475 A 53 ARG HGx A 53 ARG HA 1.0 1.8 3.6 562 476 A 53 ARG HA A 53 ARG HDx 1.0 1.8 4.8 563 477 A 53 ARG HBy A 53 ARG HGy 1.0 1.8 4.4 564 478 A 79 TRP HH2 A 53 ARG HGy 1.0 1.8 5.7 565 478 A 79 TRP HH2 A 53 ARG HGx 1.0 1.8 5.7 566 479 A 53 ARG HGx A 53 ARG HGy 1.0 1.8 3.6 567 480 A 53 ARG HDy A 53 ARG HGy 1.0 1.8 6.2 568 480 A 53 ARG HDx A 53 ARG HGy 1.0 1.8 6.2 569 480 A 53 ARG HGx A 53 ARG HDx 1.0 1.8 6.2 570 480 A 53 ARG HGx A 53 ARG HDy 1.0 1.8 6.2 571 481 A 53 ARG HGx A 53 ARG HDx 1.0 1.8 3.6 572 482 A 53 ARG HBx A 53 ARG HBy 1.0 1.8 2.8 573 483 A 53 ARG HBx A 55 HIS HD2 1.0 1.8 4.4 574 484 A 53 ARG HGx A 53 ARG HBy 1.0 1.8 4.4 575 485 A 53 ARG HGx A 53 ARG HDy 1.0 1.8 4.4 576 486 A 79 TRP HZ2 A 53 ARG HBy 1.0 1.8 5.7 577 486 A 53 ARG HBx A 79 TRP HZ2 1.0 1.8 5.7 578 487 A 53 ARG HGx A 53 ARG HBx 1.0 1.8 3.6 579 488 A 53 ARG HBy A 53 ARG HDx 1.0 1.8 4.4 580 489 A 53 ARG HDy A 53 ARG HDx 1.0 1.8 3.6 581 490 A 54 GLY HAy A 54 GLY HAx 1.0 1.8 3.6 582 491 A 55 HIS HBy A 55 HIS HBx 1.0 1.8 3.6 583 492 A 55 HIS HBy A 57 PHE HZ 1.0 1.8 4.4 584 493 A 57 PHE HE% A 55 HIS HBy 1.0 1.8 6.5 585 494 A 55 HIS HD2 A 55 HIS HBy 1.0 1.8 4.4 586 495 A 57 PHE HE% A 55 HIS HBx 1.0 1.8 6.5 587 496 A 55 HIS HBy A 55 HIS HA 1.0 1.8 3.6 588 497 A 55 HIS HBx A 55 HIS HA 1.0 1.8 4.4 589 498 A 55 HIS HBx A 57 PHE HZ 1.0 1.8 4.4 590 499 A 56 GLU HA A 57 PHE HE% 1.0 1.8 6.9 591 500 A 56 GLU HBx A 56 GLU HBy 1.0 1.8 2.8 592 501 A 56 GLU HBx A 56 GLU HGy 1.0 1.8 3.6 593 502 A 56 GLU HBx A 56 GLU HGx 1.0 1.8 4.4 594 503 A 56 GLU HA A 57 PHE HD% 1.0 1.8 6.5 595 504 A 56 GLU HA A 56 GLU HBy 1.0 1.8 3.6 596 505 A 56 GLU HA A 56 GLU HBx 1.0 1.8 3.6 597 506 A 56 GLU HA A 56 GLU HGx 1.0 1.8 4.4 598 507 A 56 GLU HA A 56 GLU HGy 1.0 1.8 4.4 599 508 A 57 PHE HZ A 77 PRO HGy 1.0 1.8 4.4 600 509 A 57 PHE HE% A 76 ALA HA 1.0 1.8 6.9 601 510 A 57 PHE HE% A 76 ALA HB% 1.0 1.8 7.9 602 511 A 80 LEU HDx% A 57 PHE HE% 1.0 1.8 8.0 603 512 A 57 PHE HE% A 80 LEU HDy% 1.0 1.8 7.9 604 513 A 57 PHE HBy A 57 PHE HBx 1.0 1.8 3.6 605 514 A 57 PHE HD% A 77 PRO HDy 1.0 1.8 6.5 606 515 A 57 PHE HD% A 76 ALA HB% 1.0 1.8 7.9 607 516 A 57 PHE HE% A 77 PRO HDx 1.0 1.8 6.5 608 517 A 59 VAL HGx% A 57 PHE HD% 1.0 1.8 7.5 609 518 A 57 PHE HD% A 77 PRO HDx 1.0 1.8 6.9 610 519 A 57 PHE HD% A 57 PHE HA 1.0 1.8 6.5 611 520 A 57 PHE HD% A 70 LEU HDx% 1.0 1.8 6.7 612 521 A 57 PHE HA A 70 LEU HDx% 1.0 1.8 5.8 613 522 A 57 PHE HBx A 57 PHE HA 1.0 1.8 4.4 614 523 A 57 PHE HBy A 57 PHE HA 1.0 1.8 3.6 615 524 A 57 PHE HD% A 57 PHE HBy 1.0 1.8 5.7 616 525 A 57 PHE HA A 70 LEU HDy% 1.0 1.8 5.4 617 526 A 59 VAL HGx% A 57 PHE HA 1.0 1.8 5.8 618 527 A 57 PHE HD% A 76 ALA HA 1.0 1.8 6.9 619 528 A 57 PHE HE% A 70 LEU HDy% 1.0 1.8 7.5 620 529 A 57 PHE HE% A 57 PHE HBy 1.0 1.8 6.5 621 530 A 57 PHE HD% A 57 PHE HBx 1.0 1.8 5.7 622 531 A 57 PHE HD% A 70 LEU HDy% 1.0 1.8 6.7 623 532 A 57 PHE HD% A 80 LEU HDy% 1.0 1.8 7.5 624 533 A 57 PHE HBy A 70 LEU HDy% 1.0 1.8 5.4 625 534 A 59 VAL HGx% A 57 PHE HBy 1.0 1.8 5.4 626 535 A 80 LEU HDx% A 57 PHE HD% 1.0 1.8 7.5 627 536 A 57 PHE HE% A 70 LEU HDx% 1.0 1.8 7.6 628 537 A 57 PHE HE% A 57 PHE HBx 1.0 1.8 6.9 629 538 A 57 PHE HBx A 70 LEU HDx% 1.0 1.8 5.4 630 539 A 57 PHE HBx A 70 LEU HDy% 1.0 1.8 4.6 631 540 A 59 VAL HGx% A 57 PHE HBx 1.0 1.8 5.4 632 541 A 57 PHE HE% A 77 PRO HDy 1.0 1.8 6.5 633 542 A 59 VAL HGx% A 58 GLU HA 1.0 1.8 5.4 634 543 A 58 GLU HA A 58 GLU HBy 1.0 1.8 4.4 635 544 A 58 GLU HA A 71 THR HG2% 1.0 1.8 5.8 636 545 A 58 GLU HA A 58 GLU HBx 1.0 1.8 4.4 637 546 A 58 GLU HA A 59 VAL HGy% 1.0 1.8 5.4 638 547 A 58 GLU HBy A 58 GLU HBx 1.0 1.8 3.6 639 548 A 71 THR HG2% A 58 GLU HBx 1.0 1.8 5.4 640 549 A 58 GLU HGy A 58 GLU HBx 1.0 1.8 2.8 641 550 A 58 GLU HA A 58 GLU HGx 1.0 1.8 4.5 642 550 A 58 GLU HA A 58 GLU HGy 1.0 1.8 4.5 643 551 A 59 VAL HGx% A 70 LEU HA 1.0 1.8 5.4 644 552 A 59 VAL HA A 70 LEU HBx 1.0 1.8 4.4 645 553 A 59 VAL HA A 70 LEU HG 1.0 1.8 4.8 646 554 A 71 THR HG2% A 59 VAL HA 1.0 1.8 5.4 647 555 A 59 VAL HA A 70 LEU HBy 1.0 1.8 4.8 648 556 A 59 VAL HA A 59 VAL HGy% 1.0 1.8 5.4 649 557 A 59 VAL HA A 70 LEU HDy% 1.0 1.8 5.4 650 558 A 59 VAL HGx% A 59 VAL HA 1.0 1.8 4.6 651 559 A 59 VAL HB A 59 VAL HA 1.0 1.8 3.6 652 560 A 59 VAL HA A 70 LEU HDx% 1.0 1.8 5.4 653 561 A 70 LEU HA A 59 VAL HA 1.0 1.8 3.6 654 562 A 70 LEU HA A 59 VAL HGy% 1.0 1.8 5.4 655 563 A 59 VAL HGx% A 59 VAL HGy% 1.0 1.8 4.8 656 564 A 59 VAL HGy% A 70 LEU HDy% 1.0 1.8 8.1 657 564 A 59 VAL HGx% A 70 LEU HDy% 1.0 1.8 8.1 658 564 A 70 LEU HDx% A 59 VAL HGy% 1.0 1.8 8.1 659 564 A 59 VAL HGx% A 70 LEU HDx% 1.0 1.8 8.1 660 565 A 59 VAL HB A 59 VAL HGx% 1.0 1.8 4.6 661 566 A 59 VAL HB A 59 VAL HGy% 1.0 1.8 4.6 662 567 A 71 THR HA A 60 GLU HBy 1.0 1.8 4.8 663 568 A 71 THR HG2% A 60 GLU HGx 1.0 1.8 6.3 664 568 A 71 THR HG2% A 60 GLU HGy 1.0 1.8 6.3 665 569 A 71 THR HG2% A 60 GLU HBy 1.0 1.8 5.4 666 570 A 60 GLU HA A 60 GLU HBx 1.0 1.8 4.8 667 571 A 60 GLU HA A 60 GLU HGy 1.0 1.8 4.8 668 572 A 60 GLU HA A 60 GLU HBy 1.0 1.8 4.4 669 573 A 71 THR HG2% A 60 GLU HBx 1.0 1.8 5.4 670 574 A 60 GLU HBy A 60 GLU HBx 1.0 1.8 3.6 671 575 A 60 GLU HBy A 60 GLU HGy 1.0 1.8 3.6 672 576 A 60 GLU HBx A 60 GLU HGy 1.0 1.8 3.6 673 577 A 61 ALA HB% A 61 ALA HA 1.0 1.8 4.6 674 578 A 62 LYS HA A 62 LYS HEy 1.0 1.8 5.7 675 578 A 62 LYS HEx A 62 LYS HA 1.0 1.8 5.7 676 579 A 62 LYS HA A 62 LYS HGx 1.0 1.8 3.6 677 580 A 62 LYS HA A 62 LYS HBx 1.0 1.8 4.5 678 580 A 62 LYS HA A 62 LYS HBy 1.0 1.8 4.5 679 581 A 62 LYS HA A 62 LYS HGy 1.0 1.8 4.4 680 582 A 62 LYS HGx A 62 LYS HBx 1.0 1.8 3.6 681 583 A 62 LYS HEx A 62 LYS HBx 1.0 1.8 4.4 682 584 A 62 LYS HGx A 62 LYS HGy 1.0 1.8 3.6 683 585 A 62 LYS HBy A 62 LYS HGy 1.0 1.8 3.6 684 586 A 62 LYS HGy A 62 LYS HBx 1.0 1.8 3.6 685 587 A 62 LYS HGy A 62 LYS HEy 1.0 1.8 4.4 686 588 A 62 LYS HGx A 62 LYS HEy 1.0 1.8 4.8 687 589 A 62 LYS HDy A 62 LYS HEy 1.0 1.8 3.6 688 590 A 62 LYS HEx A 62 LYS HGx 1.0 1.8 4.4 689 591 A 63 ASP HA A 63 ASP HBy 1.0 1.8 3.6 690 592 A 63 ASP HA A 63 ASP HBx 1.0 1.8 3.6 691 593 A 64 GLN HA A 64 GLN HGx 1.0 1.8 5.3 692 593 A 64 GLN HA A 64 GLN HGy 1.0 1.8 5.3 693 594 A 64 GLN HA A 64 GLN HBx 1.0 1.8 3.6 694 595 A 64 GLN HA A 64 GLN HBy 1.0 1.8 3.6 695 596 A 64 GLN HGy A 64 GLN HBy 1.0 1.8 4.4 696 597 A 64 GLN HGy A 64 GLN HBx 1.0 1.8 4.4 697 598 A 65 ASN HBx A 65 ASN HA 1.0 1.8 3.6 698 599 A 65 ASN HA A 65 ASN HBy 1.0 1.8 3.6 699 600 A 65 ASN HBx A 65 ASN HBy 1.0 1.8 3.6 700 601 A 66 CYS HBy A 66 CYS HA 1.0 1.8 3.6 701 602 A 66 CYS HA A 66 CYS HBx 1.0 1.8 3.6 702 603 A 82 ALA HB% A 66 CYS HBy 1.0 1.8 4.6 703 604 A 66 CYS HBx A 83 GLU HA 1.0 1.8 4.8 704 605 A 66 CYS HBy A 83 GLU HA 1.0 1.8 4.8 705 606 A 66 CYS HBy A 66 CYS HBx 1.0 1.8 3.6 706 607 A 82 ALA HB% A 66 CYS HBx 1.0 1.8 4.6 707 608 A 67 LYS HA A 67 LYS HBx 1.0 1.8 4.4 708 609 A 67 LYS HA A 67 LYS HDx 1.0 1.8 4.4 709 610 A 67 LYS HA A 67 LYS HBy 1.0 1.8 2.8 710 611 A 67 LYS HA A 67 LYS HEy 1.0 1.8 4.8 711 612 A 67 LYS HBx A 67 LYS HGy 1.0 1.8 3.6 712 613 A 67 LYS HEy A 67 LYS HBy 1.0 1.8 3.6 713 614 A 67 LYS HDx A 67 LYS HGy 1.0 1.8 3.6 714 615 A 67 LYS HDx A 67 LYS HGx 1.0 1.8 4.4 715 616 A 67 LYS HBy A 67 LYS HGx 1.0 1.8 3.6 716 617 A 67 LYS HDx A 67 LYS HBy 1.0 1.8 2.8 717 618 A 67 LYS HGy A 67 LYS HBy 1.0 1.8 3.6 718 619 A 67 LYS HEy A 67 LYS HBx 1.0 1.8 3.6 719 620 A 67 LYS HDx A 67 LYS HEy 1.0 1.8 4.4 720 621 A 67 LYS HEy A 67 LYS HGx 1.0 1.8 4.4 721 622 A 67 LYS HEy A 67 LYS HGy 1.0 1.8 4.4 722 623 A 68 VAL HA A 68 VAL HB 1.0 1.8 3.6 723 624 A 68 VAL HA A 68 VAL HGy% 1.0 1.8 4.6 724 625 A 68 VAL HA A 68 VAL HGx% 1.0 1.8 4.6 725 626 A 68 VAL HGx% A 80 LEU HBx 1.0 1.8 7.5 726 626 A 68 VAL HGy% A 80 LEU HBx 1.0 1.8 7.5 727 626 A 80 LEU HBy A 68 VAL HGy% 1.0 1.8 7.5 728 626 A 68 VAL HGx% A 80 LEU HBy 1.0 1.8 7.5 729 627 A 68 VAL HGy% A 80 LEU HDy% 1.0 1.8 8.9 730 627 A 68 VAL HGx% A 80 LEU HDy% 1.0 1.8 8.9 731 627 A 80 LEU HDx% A 68 VAL HGy% 1.0 1.8 8.9 732 627 A 68 VAL HGx% A 80 LEU HDx% 1.0 1.8 8.9 733 628 A 68 VAL HGx% A 68 VAL HGy% 1.0 1.8 4.8 734 629 A 76 ALA HB% A 68 VAL HGy% 1.0 1.8 5.6 735 630 A 80 LEU HG A 68 VAL HGy% 1.0 1.8 5.4 736 631 A 70 LEU HG A 68 VAL HGy% 1.0 1.8 5.4 737 632 A 68 VAL HB A 68 VAL HGy% 1.0 1.8 4.6 738 633 A 71 THR HA A 69 ILE HG2% 1.0 1.8 5.4 739 634 A 69 ILE HD1% A 69 ILE HA 1.0 1.8 4.6 740 635 A 69 ILE HA A 69 ILE HG1x 1.0 1.8 3.6 741 636 A 69 ILE HG2% A 69 ILE HA 1.0 1.8 3.8 742 637 A 69 ILE HA A 69 ILE HG1y 1.0 1.8 3.6 743 638 A 69 ILE HG1y A 69 ILE HB 1.0 1.8 3.6 744 639 A 69 ILE HD1% A 69 ILE HG1x 1.0 1.8 4.6 745 640 A 69 ILE HD1% A 69 ILE HG1y 1.0 1.8 4.6 746 641 A 69 ILE HD1% A 69 ILE HB 1.0 1.8 4.6 747 642 A 69 ILE HG2% A 69 ILE HB 1.0 1.8 3.8 748 643 A 70 LEU HDx% A 77 PRO HDx 1.0 1.8 7.6 749 643 A 70 LEU HDy% A 77 PRO HDx 1.0 1.8 7.6 750 643 A 77 PRO HDy A 70 LEU HDy% 1.0 1.8 7.6 751 643 A 70 LEU HDx% A 77 PRO HDy 1.0 1.8 7.6 752 644 A 70 LEU HA A 70 LEU HDx% 1.0 1.8 4.6 753 645 A 70 LEU HA A 70 LEU HG 1.0 1.8 4.4 754 646 A 70 LEU HA A 70 LEU HBx 1.0 1.8 3.6 755 647 A 70 LEU HA A 70 LEU HBy 1.0 1.8 3.6 756 648 A 70 LEU HA A 70 LEU HDy% 1.0 1.8 4.6 757 649 A 71 THR HG2% A 70 LEU HA 1.0 1.8 5.4 758 650 A 76 ALA HB% A 70 LEU HG 1.0 1.8 4.6 759 651 A 70 LEU HBy A 70 LEU HDy% 1.0 1.8 4.6 760 652 A 76 ALA HB% A 70 LEU HDy% 1.0 1.8 5.6 761 653 A 76 ALA HB% A 70 LEU HDx% 1.0 1.8 5.6 762 654 A 70 LEU HG A 70 LEU HDx% 1.0 1.8 3.8 763 655 A 70 LEU HG A 70 LEU HDy% 1.0 1.8 4.6 764 656 A 70 LEU HBy A 70 LEU HDx% 1.0 1.8 4.6 765 657 A 70 LEU HBx A 70 LEU HDy% 1.0 1.8 4.6 766 658 A 71 THR HG2% A 71 THR HA 1.0 1.8 3.8 767 659 A 71 THR HG2% A 71 THR HB 1.0 1.8 3.8 768 660 A 71 THR HA A 71 THR HB 1.0 1.8 2.8 769 661 A 72 ASN HBy A 72 ASN HBx 1.0 1.8 3.6 770 662 A 72 ASN HBx A 72 ASN HA 1.0 1.8 3.6 771 663 A 72 ASN HBy A 72 ASN HA 1.0 1.8 3.6 772 664 A 73 GLY HAx A 73 GLY HAy 1.0 1.8 3.6 773 665 A 74 LYS HDy A 74 LYS HGx 1.0 1.8 3.6 774 666 A 74 LYS HA A 74 LYS HBx 1.0 1.8 3.6 775 667 A 74 LYS HA A 74 LYS HDy 1.0 1.8 4.4 776 668 A 74 LYS HA A 74 LYS HEx 1.0 1.8 5.7 777 668 A 74 LYS HA A 74 LYS HEy 1.0 1.8 5.7 778 669 A 74 LYS HBy A 74 LYS HGy 1.0 1.8 3.6 779 670 A 74 LYS HBy A 74 LYS HGx 1.0 1.8 3.6 780 671 A 74 LYS HBy A 74 LYS HDy 1.0 1.8 3.6 781 672 A 74 LYS HBy A 74 LYS HEx 1.0 1.8 6.6 782 672 A 74 LYS HBx A 74 LYS HEx 1.0 1.8 6.6 783 672 A 74 LYS HEy A 74 LYS HBx 1.0 1.8 6.6 784 672 A 74 LYS HEy A 74 LYS HBy 1.0 1.8 6.6 785 673 A 75 GLN HA A 75 GLN HBx 1.0 1.8 3.6 786 674 A 75 GLN HA A 75 GLN HGy 1.0 1.8 3.6 787 675 A 75 GLN HBx A 75 GLN HGy 1.0 1.8 3.6 788 676 A 76 ALA HB% A 77 PRO HDx 1.0 1.8 4.6 789 677 A 76 ALA HA A 77 PRO HDx 1.0 1.8 3.6 790 678 A 76 ALA HA A 77 PRO HDy 1.0 1.8 3.6 791 679 A 76 ALA HA A 80 LEU HDy% 1.0 1.8 5.8 792 680 A 76 ALA HA A 76 ALA HB% 1.0 1.8 4.6 793 681 A 80 LEU HDx% A 76 ALA HB% 1.0 1.8 5.6 794 682 A 76 ALA HB% A 80 LEU HDy% 1.0 1.8 5.6 795 683 A 76 ALA HB% A 80 LEU HBx 1.0 1.8 6.3 796 683 A 76 ALA HB% A 80 LEU HBy 1.0 1.8 6.3 797 684 A 76 ALA HB% A 77 PRO HDy 1.0 1.8 4.6 798 685 A 77 PRO HDy A 77 PRO HDx 1.0 1.8 3.6 799 686 A 77 PRO HBy A 77 PRO HDx 1.0 1.8 4.8 800 687 A 77 PRO HGx A 77 PRO HDx 1.0 1.8 4.4 801 688 A 77 PRO HDx A 80 LEU HDy% 1.0 1.8 5.4 802 689 A 77 PRO HDx A 77 PRO HGy 1.0 1.8 4.4 803 690 A 80 LEU HBy A 77 PRO HDx 1.0 1.8 4.8 804 691 A 77 PRO HBx A 77 PRO HDx 1.0 1.8 4.4 805 692 A 77 PRO HA A 79 TRP HD1 1.0 1.8 4.8 806 693 A 77 PRO HA A 77 PRO HGx 1.0 1.8 4.4 807 694 A 77 PRO HA A 77 PRO HDx 1.0 1.8 4.4 808 695 A 77 PRO HBx A 77 PRO HA 1.0 1.8 3.6 809 696 A 77 PRO HBy A 77 PRO HA 1.0 1.8 3.6 810 697 A 77 PRO HDy A 77 PRO HA 1.0 1.8 4.4 811 698 A 77 PRO HA A 77 PRO HGy 1.0 1.8 4.4 812 699 A 77 PRO HBx A 77 PRO HGy 1.0 1.8 4.4 813 700 A 77 PRO HBy A 79 TRP HD1 1.0 1.8 4.4 814 701 A 77 PRO HBy A 77 PRO HGx 1.0 1.8 4.4 815 702 A 77 PRO HBx A 79 TRP HD1 1.0 1.8 4.4 816 703 A 77 PRO HGx A 77 PRO HGy 1.0 1.8 3.6 817 704 A 77 PRO HBy A 77 PRO HGy 1.0 1.8 4.4 818 705 A 77 PRO HBy A 77 PRO HBx 1.0 1.8 3.6 819 706 A 77 PRO HBx A 77 PRO HGx 1.0 1.8 4.4 820 707 A 79 TRP HZ2 A 77 PRO HBy 1.0 1.8 4.8 821 708 A 80 LEU HDx% A 77 PRO HDy 1.0 1.8 5.4 822 709 A 77 PRO HDy A 80 LEU HDy% 1.0 1.8 5.4 823 710 A 80 LEU HBy A 77 PRO HDy 1.0 1.8 4.8 824 711 A 77 PRO HDy A 77 PRO HBy 1.0 1.8 4.8 825 712 A 77 PRO HDy A 77 PRO HGy 1.0 1.8 4.4 826 713 A 77 PRO HDy A 80 LEU HBx 1.0 1.8 4.8 827 714 A 77 PRO HDy A 77 PRO HGx 1.0 1.8 4.4 828 715 A 79 TRP HZ2 A 77 PRO HBx 1.0 1.8 4.4 829 716 A 78 ASP HA A 78 ASP HBy 1.0 1.8 3.6 830 717 A 78 ASP HA A 78 ASP HBx 1.0 1.8 3.6 831 718 A 79 TRP HZ3 A 80 LEU HDy% 1.0 1.8 5.9 832 718 A 79 TRP HZ3 A 80 LEU HDx% 1.0 1.8 5.9 833 719 A 79 TRP HZ3 A 80 LEU HBx 1.0 1.8 5.7 834 719 A 79 TRP HZ3 A 80 LEU HBy 1.0 1.8 5.7 835 720 A 79 TRP HBx A 79 TRP HBy 1.0 1.8 3.6 836 721 A 79 TRP HD1 A 79 TRP HBy 1.0 1.8 3.6 837 722 A 79 TRP HH2 A 80 LEU HDy% 1.0 1.8 7.1 838 722 A 79 TRP HH2 A 80 LEU HDx% 1.0 1.8 7.1 839 723 A 79 TRP HD1 A 79 TRP HBx 1.0 1.8 4.4 840 724 A 79 TRP HA A 79 TRP HBy 1.0 1.8 3.6 841 725 A 79 TRP HA A 79 TRP HBx 1.0 1.8 3.6 842 726 A 79 TRP HE3 A 80 LEU HBx 1.0 1.8 5.7 843 726 A 79 TRP HE3 A 80 LEU HBy 1.0 1.8 5.7 844 727 A 79 TRP HE3 A 80 LEU HDy% 1.0 1.8 5.8 845 728 A 79 TRP HE3 A 79 TRP HBx 1.0 1.8 4.4 846 729 A 79 TRP HE3 A 80 LEU HA 1.0 1.8 4.8 847 730 A 79 TRP HE3 A 80 LEU HDy% 1.0 1.8 6.7 848 730 A 79 TRP HE3 A 80 LEU HDx% 1.0 1.8 6.7 849 731 A 80 LEU HDx% A 80 LEU HBy 1.0 1.8 4.6 850 732 A 80 LEU HBy A 80 LEU HBx 1.0 1.8 3.6 851 733 A 80 LEU HBy A 80 LEU HDy% 1.0 1.8 3.4 852 734 A 80 LEU HDx% A 80 LEU HDy% 1.0 1.8 4.8 853 735 A 80 LEU HG A 80 LEU HBy 1.0 1.8 4.4 854 736 A 80 LEU HG A 80 LEU HDy% 1.0 1.8 4.6 855 737 A 80 LEU HG A 80 LEU HDx% 1.0 1.8 4.6 856 738 A 80 LEU HBx A 80 LEU HDy% 1.0 1.8 4.6 857 739 A 80 LEU HBy A 80 LEU HA 1.0 1.8 4.8 858 740 A 80 LEU HA A 80 LEU HBx 1.0 1.8 4.8 859 741 A 80 LEU HA A 80 LEU HDy% 1.0 1.8 5.4 860 742 A 80 LEU HDx% A 80 LEU HA 1.0 1.8 5.4 861 743 A 80 LEU HG A 80 LEU HA 1.0 1.8 4.8 862 744 A 81 ALA HB% A 81 ALA HA 1.0 1.8 5.4 863 745 A 82 ALA HA A 82 ALA HB% 1.0 1.8 4.6 864 746 A 82 ALA HB% A 83 GLU HA 1.0 1.8 5.4 865 747 A 83 GLU HBy A 84 PRO HDx 1.0 1.8 4.4 866 748 A 83 GLU HGy A 83 GLU HBy 1.0 1.8 3.6 867 749 A 83 GLU HGy A 83 GLU HBx 1.0 1.8 3.6 868 750 A 83 GLU HA A 83 GLU HBy 1.0 1.8 3.6 869 751 A 83 GLU HA A 84 PRO HDx 1.0 1.8 3.6 870 752 A 83 GLU HBx A 83 GLU HA 1.0 1.8 3.6 871 753 A 83 GLU HGy A 83 GLU HA 1.0 1.8 4.4 872 754 A 83 GLU HA A 84 PRO HDy 1.0 1.8 3.6 873 755 A 84 PRO HDy A 84 PRO HGx 1.0 1.8 4.4 874 756 A 84 PRO HBx A 84 PRO HDy 1.0 1.8 4.4 875 757 A 84 PRO HBy A 84 PRO HDy 1.0 1.8 3.6 876 758 A 84 PRO HBx A 84 PRO HDx 1.0 1.8 4.8 877 759 A 84 PRO HA A 84 PRO HBx 1.0 1.8 3.6 878 760 A 84 PRO HA A 84 PRO HBy 1.0 1.8 4.4 879 761 A 84 PRO HA A 84 PRO HDx 1.0 1.8 4.8 880 762 A 84 PRO HA A 84 PRO HGy 1.0 1.8 5.3 881 762 A 84 PRO HA A 84 PRO HGx 1.0 1.8 5.3 882 763 A 84 PRO HA A 84 PRO HDy 1.0 1.8 4.8 883 764 A 84 PRO HBx A 84 PRO HGx 1.0 1.8 4.4 884 765 A 85 TYR HA A 85 TYR HE% 1.0 1.8 6.9 885 766 A 85 TYR HE% A 85 TYR HBx 1.0 1.8 6.5 886 767 A 85 TYR HE% A 85 TYR HBy 1.0 1.8 6.9 887 768 A 85 TYR HD% A 85 TYR HBy 1.0 1.8 5.7 888 769 A 85 TYR HD% A 85 TYR HBx 1.0 1.8 5.7 889 770 A 85 TYR HA A 85 TYR HD% 1.0 1.8 5.7 890 771 A 85 TYR HA A 85 TYR HBy 1.0 1.8 3.6 891 772 A 85 TYR HA A 85 TYR HBx 1.0 1.8 3.6 892 773 A 85 TYR HBx A 85 TYR HBy 1.0 1.8 3.6 893 774 A 8 GLY H A 8 GLY HAx 1.0 1.8 4.4 894 775 A 9 ARG H A 8 GLY HAx 1.0 1.8 5.3 895 775 A 8 GLY HAy A 9 ARG H 1.0 1.8 5.3 896 776 A 9 ARG HBx A 10 GLU H 1.0 1.8 4.4 897 777 A 9 ARG HBy A 10 GLU H 1.0 1.8 4.4 898 778 A 9 ARG HA A 10 GLU H 1.0 1.8 2.8 899 779 A 9 ARG HBx A 9 ARG H 1.0 1.8 3.6 900 780 A 9 ARG HA A 9 ARG H 1.0 1.8 4.4 901 781 A 9 ARG H A 9 ARG HGy 1.0 1.8 5.3 902 781 A 9 ARG H A 9 ARG HGx 1.0 1.8 5.3 903 782 A 9 ARG HBy A 9 ARG H 1.0 1.8 4.4 904 783 A 10 GLU H A 9 ARG HGy 1.0 1.8 5.3 905 783 A 10 GLU H A 9 ARG HGx 1.0 1.8 5.3 906 784 A 9 ARG H A 10 GLU H 1.0 1.8 3.6 907 785 A 10 GLU HBy A 10 GLU H 1.0 1.8 3.6 908 786 A 10 GLU H A 10 GLU HGx 1.0 1.8 4.5 909 786 A 10 GLU H A 10 GLU HGy 1.0 1.8 4.5 910 787 A 10 GLU HBx A 10 GLU H 1.0 1.8 3.6 911 788 A 10 GLU HA A 10 GLU H 1.0 1.8 4.4 912 789 A 10 GLU H A 11 ASN H 1.0 1.8 4.4 913 790 A 10 GLU HBy A 11 ASN H 1.0 1.8 4.4 914 791 A 10 GLU HBx A 11 ASN H 1.0 1.8 4.4 915 792 A 11 ASN H A 10 GLU HGx 1.0 1.8 5.3 916 792 A 10 GLU HGy A 11 ASN H 1.0 1.8 5.3 917 793 A 10 GLU HA A 11 ASN H 1.0 1.8 2.8 918 794 A 11 ASN H A 11 ASN HA 1.0 1.8 3.6 919 795 A 11 ASN HA A 12 LEU H 1.0 1.8 3.6 920 796 A 12 LEU H A 11 ASN HBx 1.0 1.8 5.3 921 796 A 12 LEU H A 11 ASN HBy 1.0 1.8 5.3 922 797 A 11 ASN H A 11 ASN HBx 1.0 1.8 4.5 923 797 A 11 ASN H A 11 ASN HBy 1.0 1.8 4.5 924 798 A 11 ASN H A 12 LEU H 1.0 1.8 3.6 925 799 A 12 LEU HG A 12 LEU H 1.0 1.8 4.4 926 800 A 13 TYR H A 12 LEU HDy% 1.0 1.8 5.4 927 801 A 12 LEU HG A 13 TYR H 1.0 1.8 4.4 928 802 A 13 TYR H A 12 LEU HDx% 1.0 1.8 5.4 929 803 A 12 LEU HA A 13 TYR H 1.0 1.8 2.8 930 804 A 12 LEU H A 12 LEU HBy 1.0 1.8 5.3 931 804 A 12 LEU H A 12 LEU HBx 1.0 1.8 5.3 932 805 A 12 LEU H A 12 LEU HDy% 1.0 1.8 6.6 933 805 A 12 LEU H A 12 LEU HDx% 1.0 1.8 6.6 934 806 A 13 TYR H A 12 LEU HBy 1.0 1.8 5.3 935 806 A 13 TYR H A 12 LEU HBx 1.0 1.8 5.3 936 807 A 12 LEU HA A 12 LEU H 1.0 1.8 4.4 937 808 A 13 TYR HA A 13 TYR H 1.0 1.8 4.4 938 809 A 13 TYR HBx A 13 TYR H 1.0 1.8 3.6 939 810 A 14 PHE HD% A 13 TYR H 1.0 1.8 6.9 940 811 A 13 TYR HD% A 13 TYR H 1.0 1.8 6.9 941 812 A 13 TYR HA A 14 PHE H 1.0 1.8 2.8 942 813 A 13 TYR HBy A 14 PHE H 1.0 1.8 4.4 943 814 A 13 TYR HBy A 13 TYR H 1.0 1.8 3.6 944 815 A 14 PHE HA A 15 GLN H 1.0 1.8 3.6 945 816 A 14 PHE HBx A 14 PHE H 1.0 1.8 4.4 946 817 A 14 PHE HBy A 14 PHE H 1.0 1.8 4.4 947 818 A 14 PHE HBy A 15 GLN H 1.0 1.8 4.4 948 819 A 14 PHE H A 15 GLN H 1.0 1.8 4.8 949 820 A 14 PHE HBx A 15 GLN H 1.0 1.8 4.4 950 821 A 15 GLN H A 16 GLY H 1.0 1.8 3.6 951 822 A 15 GLN HA A 15 GLN H 1.0 1.8 4.4 952 823 A 15 GLN HBx A 16 GLY H 1.0 1.8 4.4 953 824 A 15 GLN HBy A 15 GLN H 1.0 1.8 3.6 954 825 A 16 GLY H A 15 GLN HGy 1.0 1.8 5.3 955 825 A 16 GLY H A 15 GLN HGx 1.0 1.8 5.3 956 826 A 15 GLN H A 15 GLN HGy 1.0 1.8 4.5 957 826 A 15 GLN H A 15 GLN HGx 1.0 1.8 4.5 958 827 A 15 GLN HA A 16 GLY H 1.0 1.8 2.8 959 828 A 15 GLN HBy A 16 GLY H 1.0 1.8 4.4 960 829 A 15 GLN HBx A 15 GLN H 1.0 1.8 3.6 961 830 A 16 GLY H A 16 GLY HAx 1.0 1.8 4.4 962 831 A 17 HIS HBx A 18 MET H 1.0 1.8 4.4 963 832 A 18 MET H A 17 HIS HBy 1.0 1.8 4.4 964 833 A 17 HIS HBy A 17 HIS H 1.0 1.8 3.6 965 834 A 17 HIS HBx A 17 HIS H 1.0 1.8 3.6 966 835 A 20 ALA H A 18 MET HBx 1.0 1.8 5.7 967 835 A 18 MET HBy A 20 ALA H 1.0 1.8 5.7 968 836 A 19 ALA H A 18 MET HGy 1.0 1.8 5.3 969 836 A 18 MET HGx A 19 ALA H 1.0 1.8 5.3 970 837 A 18 MET H A 18 MET HBx 1.0 1.8 5.3 971 837 A 18 MET H A 18 MET HBy 1.0 1.8 5.3 972 838 A 20 ALA H A 18 MET HGy 1.0 1.8 5.7 973 838 A 20 ALA H A 18 MET HGx 1.0 1.8 5.7 974 839 A 18 MET HA A 19 ALA H 1.0 1.8 2.8 975 840 A 19 ALA H A 18 MET HBx 1.0 1.8 5.3 976 840 A 18 MET HBy A 19 ALA H 1.0 1.8 5.3 977 841 A 18 MET H A 18 MET HGy 1.0 1.8 5.3 978 841 A 18 MET H A 18 MET HGx 1.0 1.8 5.3 979 842 A 19 ALA HB% A 19 ALA H 1.0 1.8 4.6 980 843 A 20 ALA H A 19 ALA H 1.0 1.8 4.4 981 844 A 19 ALA HA A 19 ALA H 1.0 1.8 2.8 982 845 A 19 ALA HA A 20 ALA H 1.0 1.8 2.8 983 846 A 21 PRO HDy A 20 ALA H 1.0 1.8 4.8 984 847 A 20 ALA HA A 20 ALA H 1.0 1.8 4.4 985 848 A 20 ALA HB% A 20 ALA H 1.0 1.8 4.6 986 849 A 44 ILE HD1% A 22 ALA H 1.0 1.8 5.8 987 850 A 22 ALA HB% A 22 ALA H 1.0 1.8 5.4 988 851 A 22 ALA HA A 22 ALA H 1.0 1.8 4.4 989 852 A 22 ALA HB% A 64 GLN HE2x 1.0 1.8 6.3 990 852 A 22 ALA HB% A 64 GLN HE2y 1.0 1.8 6.3 991 853 A 24 PHE H A 23 ARG HGy 1.0 1.8 5.3 992 853 A 23 ARG HGx A 24 PHE H 1.0 1.8 5.3 993 854 A 23 ARG H A 23 ARG HGy 1.0 1.8 4.5 994 854 A 23 ARG HGx A 23 ARG H 1.0 1.8 4.5 995 855 A 23 ARG HA A 23 ARG H 1.0 1.8 3.6 996 856 A 24 PHE H A 23 ARG HBy 1.0 1.8 5.3 997 856 A 23 ARG HBx A 24 PHE H 1.0 1.8 5.3 998 857 A 23 ARG H A 23 ARG HBy 1.0 1.8 4.4 999 858 A 23 ARG HA A 24 PHE H 1.0 1.8 4.4 1000 859 A 23 ARG HBx A 23 ARG H 1.0 1.8 4.4 1001 860 A 24 PHE HA A 25 CYS H 1.0 1.8 3.6 1002 861 A 24 PHE HD% A 24 PHE H 1.0 1.8 6.5 1003 862 A 24 PHE HA A 24 PHE H 1.0 1.8 4.4 1004 863 A 24 PHE HBx A 24 PHE H 1.0 1.8 4.4 1005 864 A 25 CYS H A 24 PHE HBy 1.0 1.8 3.6 1006 865 A 44 ILE HD1% A 24 PHE H 1.0 1.8 5.8 1007 866 A 24 PHE HD% A 42 VAL H 1.0 1.8 6.5 1008 867 A 24 PHE H A 85 TYR H 1.0 1.8 4.4 1009 868 A 24 PHE HD% A 44 ILE H 1.0 1.8 6.5 1010 869 A 24 PHE H A 24 PHE HBy 1.0 1.8 4.4 1011 870 A 24 PHE HBx A 25 CYS H 1.0 1.8 4.4 1012 871 A 24 PHE HD% A 25 CYS H 1.0 1.8 6.5 1013 872 A 24 PHE HA A 44 ILE H 1.0 1.8 3.6 1014 873 A 24 PHE HD% A 43 ARG H 1.0 1.8 6.5 1015 874 A 44 ILE H A 24 PHE HBy 1.0 1.8 5.7 1016 874 A 24 PHE HBx A 44 ILE H 1.0 1.8 5.7 1017 875 A 24 PHE HBx A 85 TYR H 1.0 1.8 4.8 1018 876 A 24 PHE HBx A 42 VAL H 1.0 1.8 4.8 1019 877 A 42 VAL H A 24 PHE HBy 1.0 1.8 4.4 1020 878 A 24 PHE HA A 42 VAL H 1.0 1.8 4.8 1021 879 A 25 CYS HA A 85 TYR H 1.0 1.8 4.4 1022 880 A 42 VAL HGx% A 25 CYS H 1.0 1.8 5.4 1023 881 A 25 CYS H A 44 ILE H 1.0 1.8 4.4 1024 882 A 25 CYS HA A 25 CYS H 1.0 1.8 3.6 1025 883 A 26 VAL H A 25 CYS HBx 1.0 1.8 4.4 1026 884 A 43 ARG HA A 25 CYS H 1.0 1.8 4.4 1027 885 A 25 CYS H A 42 VAL HGy% 1.0 1.8 5.4 1028 886 A 25 CYS HA A 83 GLU H 1.0 1.8 4.4 1029 887 A 42 VAL H A 25 CYS HBx 1.0 1.8 4.8 1030 888 A 25 CYS HBy A 26 VAL H 1.0 1.8 3.6 1031 889 A 25 CYS HBy A 25 CYS H 1.0 1.8 3.6 1032 890 A 25 CYS HA A 26 VAL H 1.0 1.8 2.2 1033 891 A 25 CYS H A 25 CYS HBx 1.0 1.8 3.6 1034 892 A 44 ILE HD1% A 25 CYS H 1.0 1.8 5.8 1035 893 A 25 CYS H A 42 VAL H 1.0 1.8 3.6 1036 894 A 25 CYS H A 26 VAL H 1.0 1.8 4.8 1037 895 A 27 TYR HE% A 25 CYS H 1.0 1.8 6.9 1038 896 A 85 TYR H A 26 VAL H 1.0 1.8 4.4 1039 897 A 26 VAL HB A 27 TYR H 1.0 1.8 4.4 1040 898 A 26 VAL HA A 27 TYR H 1.0 1.8 2.2 1041 899 A 26 VAL H A 85 TYR HBy 1.0 1.8 5.3 1042 899 A 85 TYR HBx A 26 VAL H 1.0 1.8 5.3 1043 900 A 26 VAL H A 26 VAL HGy% 1.0 1.8 4.6 1044 901 A 26 VAL HGx% A 27 TYR H 1.0 1.8 4.6 1045 902 A 26 VAL HGx% A 83 GLU H 1.0 1.8 5.4 1046 903 A 26 VAL H A 27 TYR H 1.0 1.8 4.8 1047 904 A 26 VAL H A 83 GLU H 1.0 1.8 3.6 1048 905 A 42 VAL H A 26 VAL HGy% 1.0 1.8 5.8 1049 906 A 82 ALA HB% A 26 VAL H 1.0 1.8 5.4 1050 907 A 85 TYR H A 26 VAL HGy% 1.0 1.8 5.4 1051 908 A 27 TYR H A 26 VAL HGy% 1.0 1.8 5.4 1052 909 A 26 VAL HA A 40 MET H 1.0 1.8 4.4 1053 910 A 26 VAL HGx% A 26 VAL H 1.0 1.8 4.6 1054 911 A 27 TYR HE% A 26 VAL H 1.0 1.8 6.9 1055 912 A 82 ALA HA A 26 VAL H 1.0 1.8 4.8 1056 913 A 26 VAL HB A 26 VAL H 1.0 1.8 3.6 1057 914 A 84 PRO HA A 26 VAL H 1.0 1.8 4.4 1058 915 A 26 VAL HB A 83 GLU H 1.0 1.8 4.4 1059 916 A 26 VAL HA A 26 VAL H 1.0 1.8 4.4 1060 917 A 40 MET H A 26 VAL HGy% 1.0 1.8 6.6 1061 917 A 26 VAL HGx% A 40 MET H 1.0 1.8 6.6 1062 918 A 83 GLU H A 26 VAL HGy% 1.0 1.8 5.4 1063 919 A 27 TYR HE% A 69 ILE H 1.0 1.8 6.9 1064 920 A 81 ALA H A 27 TYR HBx 1.0 1.8 4.4 1065 921 A 27 TYR HD% A 40 MET H 1.0 1.8 6.5 1066 922 A 27 TYR HA A 27 TYR H 1.0 1.8 4.4 1067 923 A 27 TYR HD% A 27 TYR H 1.0 1.8 5.7 1068 924 A 28 TYR H A 27 TYR HBx 1.0 1.8 4.5 1069 924 A 27 TYR HBy A 28 TYR H 1.0 1.8 4.5 1070 925 A 39 LEU H A 27 TYR HBx 1.0 1.8 4.8 1071 926 A 27 TYR HE% A 42 VAL H 1.0 1.8 6.5 1072 927 A 27 TYR HD% A 83 GLU H 1.0 1.8 6.9 1073 928 A 27 TYR HD% A 81 ALA H 1.0 1.8 6.9 1074 929 A 27 TYR HA A 83 GLU H 1.0 1.8 4.4 1075 930 A 27 TYR H A 27 TYR HBx 1.0 1.8 4.5 1076 930 A 27 TYR HBy A 27 TYR H 1.0 1.8 4.5 1077 931 A 41 TYR HA A 27 TYR H 1.0 1.8 4.4 1078 932 A 27 TYR HD% A 28 TYR H 1.0 1.8 6.5 1079 933 A 27 TYR H A 28 TYR H 1.0 1.8 4.8 1080 934 A 27 TYR H A 40 MET H 1.0 1.8 3.6 1081 935 A 27 TYR HBy A 40 MET H 1.0 1.8 3.6 1082 936 A 27 TYR HA A 28 TYR H 1.0 1.8 2.2 1083 937 A 27 TYR HA A 81 ALA H 1.0 1.8 4.4 1084 938 A 27 TYR H A 42 VAL HGy% 1.0 1.8 5.4 1085 939 A 27 TYR HE% A 60 GLU H 1.0 1.8 6.9 1086 940 A 27 TYR HD% A 42 VAL H 1.0 1.8 6.9 1087 941 A 27 TYR HE% A 27 TYR H 1.0 1.8 6.9 1088 942 A 28 TYR HD% A 29 ASP H 1.0 1.8 6.5 1089 943 A 28 TYR HE% A 83 GLU H 1.0 1.8 6.9 1090 944 A 28 TYR HBy A 81 ALA H 1.0 1.8 4.4 1091 945 A 28 TYR HD% A 39 LEU H 1.0 1.8 6.5 1092 946 A 81 ALA HB% A 28 TYR H 1.0 1.8 5.4 1093 947 A 82 ALA HB% A 28 TYR H 1.0 1.8 5.4 1094 948 A 28 TYR HBx A 29 ASP H 1.0 1.8 4.4 1095 949 A 28 TYR HD% A 38 LEU H 1.0 1.8 6.5 1096 950 A 81 ALA H A 28 TYR H 1.0 1.8 4.4 1097 951 A 28 TYR HE% A 38 LEU H 1.0 1.8 6.5 1098 952 A 28 TYR HD% A 37 VAL H 1.0 1.8 6.9 1099 953 A 28 TYR HD% A 28 TYR H 1.0 1.8 6.5 1100 954 A 28 TYR HBx A 37 VAL H 1.0 1.8 4.4 1101 955 A 82 ALA HA A 28 TYR H 1.0 1.8 4.4 1102 956 A 28 TYR HA A 29 ASP H 1.0 1.8 2.8 1103 957 A 28 TYR HE% A 28 TYR H 1.0 1.8 6.9 1104 958 A 28 TYR HBy A 28 TYR H 1.0 1.8 3.6 1105 959 A 28 TYR HA A 39 LEU H 1.0 1.8 3.6 1106 960 A 28 TYR H A 29 ASP H 1.0 1.8 4.8 1107 961 A 28 TYR HD% A 83 GLU H 1.0 1.8 6.5 1108 962 A 28 TYR HD% A 36 ARG H 1.0 1.8 6.9 1109 963 A 28 TYR HA A 28 TYR H 1.0 1.8 4.4 1110 964 A 29 ASP H A 29 ASP HBy 1.0 1.8 3.6 1111 965 A 39 LEU HG A 29 ASP H 1.0 1.8 3.6 1112 966 A 39 LEU HDx% A 29 ASP H 1.0 1.8 5.4 1113 967 A 30 GLY H A 29 ASP HBy 1.0 1.8 4.4 1114 968 A 29 ASP HBx A 37 VAL H 1.0 1.8 4.4 1115 969 A 29 ASP HBx A 29 ASP H 1.0 1.8 3.6 1116 970 A 37 VAL HB A 29 ASP H 1.0 1.8 4.4 1117 971 A 29 ASP HA A 81 ALA H 1.0 1.8 4.4 1118 972 A 80 LEU HDx% A 29 ASP H 1.0 1.8 5.8 1119 973 A 29 ASP H A 37 VAL H 1.0 1.8 4.4 1120 974 A 38 LEU HA A 29 ASP H 1.0 1.8 4.4 1121 975 A 29 ASP HBx A 30 GLY H 1.0 1.8 4.8 1122 976 A 39 LEU H A 29 ASP H 1.0 1.8 4.4 1123 977 A 29 ASP HA A 30 GLY H 1.0 1.8 2.2 1124 978 A 81 ALA HB% A 30 GLY H 1.0 1.8 5.4 1125 979 A 79 TRP HA A 30 GLY H 1.0 1.8 4.4 1126 980 A 30 GLY HAy A 30 GLY H 1.0 1.8 3.6 1127 981 A 79 TRP HE3 A 30 GLY H 1.0 1.8 4.4 1128 982 A 30 GLY HAy A 31 HIS H 1.0 1.8 2.8 1129 983 A 80 LEU HDx% A 30 GLY H 1.0 1.8 5.8 1130 984 A 30 GLY H A 31 HIS H 1.0 1.8 4.4 1131 985 A 30 GLY H A 80 LEU H 1.0 1.8 4.8 1132 986 A 30 GLY H A 79 TRP HBy 1.0 1.8 5.7 1133 986 A 30 GLY H A 79 TRP HBx 1.0 1.8 5.7 1134 987 A 30 GLY HAx A 31 HIS H 1.0 1.8 2.8 1135 988 A 30 GLY HAx A 30 GLY H 1.0 1.8 3.6 1136 989 A 31 HIS HBy A 31 HIS H 1.0 1.8 3.6 1137 990 A 31 HIS HBx A 32 LEU H 1.0 1.8 4.4 1138 991 A 31 HIS HD2 A 31 HIS H 1.0 1.8 4.8 1139 992 A 31 HIS HBy A 32 LEU H 1.0 1.8 4.4 1140 993 A 31 HIS HA A 32 LEU H 1.0 1.8 4.8 1141 994 A 31 HIS HA A 31 HIS H 1.0 1.8 4.4 1142 995 A 31 HIS HBx A 31 HIS H 1.0 1.8 4.4 1143 996 A 31 HIS H A 32 LEU H 1.0 1.8 3.6 1144 997 A 33 PRO HDx A 32 LEU H 1.0 1.8 4.8 1145 998 A 32 LEU HA A 32 LEU H 1.0 1.8 3.6 1146 999 A 36 ARG HBy A 32 LEU H 1.0 1.8 4.4 1147 1000 A 32 LEU HG A 32 LEU H 1.0 1.8 4.4 1148 1001 A 32 LEU H A 32 LEU HDy% 1.0 1.8 6.7 1149 1001 A 32 LEU H A 32 LEU HDx% 1.0 1.8 6.7 1150 1002 A 34 ALA H A 32 LEU HDy% 1.0 1.8 6.7 1151 1002 A 32 LEU HDx% A 34 ALA H 1.0 1.8 6.7 1152 1003 A 36 ARG HBx A 32 LEU H 1.0 1.8 4.4 1153 1004 A 36 ARG H A 32 LEU H 1.0 1.8 4.8 1154 1005 A 32 LEU HG A 34 ALA H 1.0 1.8 4.4 1155 1006 A 35 THR H A 32 LEU HDy% 1.0 1.8 6.7 1156 1006 A 32 LEU HDx% A 35 THR H 1.0 1.8 6.7 1157 1007 A 32 LEU HBx A 32 LEU H 1.0 1.8 3.6 1158 1008 A 33 PRO HA A 34 ALA H 1.0 1.8 4.4 1159 1009 A 33 PRO HGy A 34 ALA H 1.0 1.8 4.4 1160 1010 A 34 ALA H A 33 PRO HDy 1.0 1.8 4.4 1161 1011 A 33 PRO HDx A 34 ALA H 1.0 1.8 4.4 1162 1012 A 33 PRO HGx A 34 ALA H 1.0 1.8 4.4 1163 1013 A 33 PRO HBy A 34 ALA H 1.0 1.8 4.4 1164 1014 A 33 PRO HBx A 34 ALA H 1.0 1.8 4.4 1165 1015 A 35 THR HG2% A 34 ALA H 1.0 1.8 5.8 1166 1016 A 34 ALA H A 34 ALA HA 1.0 1.8 3.6 1167 1017 A 34 ALA HB% A 35 THR H 1.0 1.8 4.6 1168 1018 A 34 ALA H A 35 THR H 1.0 1.8 3.6 1169 1019 A 35 THR H A 34 ALA HA 1.0 1.8 4.4 1170 1020 A 34 ALA HB% A 34 ALA H 1.0 1.8 3.8 1171 1021 A 36 ARG H A 34 ALA H 1.0 1.8 4.8 1172 1022 A 36 ARG H A 35 THR H 1.0 1.8 2.8 1173 1023 A 35 THR HG2% A 35 THR H 1.0 1.8 4.6 1174 1024 A 35 THR HA A 35 THR H 1.0 1.8 3.6 1175 1025 A 35 THR HB A 35 THR H 1.0 1.8 4.4 1176 1026 A 35 THR HA A 36 ARG H 1.0 1.8 4.4 1177 1027 A 35 THR HB A 36 ARG H 1.0 1.8 4.4 1178 1028 A 36 ARG HBy A 37 VAL H 1.0 1.8 4.4 1179 1029 A 36 ARG HA A 36 ARG H 1.0 1.8 3.6 1180 1030 A 36 ARG H A 36 ARG HE 1.0 1.8 4.4 1181 1031 A 37 VAL H A 36 ARG H 1.0 1.8 4.8 1182 1032 A 36 ARG HDy A 36 ARG H 1.0 1.8 4.4 1183 1033 A 36 ARG HBx A 37 VAL H 1.0 1.8 4.4 1184 1034 A 36 ARG HGx A 36 ARG H 1.0 1.8 4.4 1185 1035 A 36 ARG HBx A 36 ARG H 1.0 1.8 3.6 1186 1036 A 36 ARG HA A 37 VAL H 1.0 1.8 2.8 1187 1037 A 36 ARG HGy A 36 ARG H 1.0 1.8 4.4 1188 1038 A 36 ARG HBy A 36 ARG H 1.0 1.8 3.6 1189 1039 A 37 VAL H A 37 VAL HGy% 1.0 1.8 4.6 1190 1040 A 37 VAL HA A 38 LEU H 1.0 1.8 2.2 1191 1041 A 37 VAL HB A 38 LEU H 1.0 1.8 4.4 1192 1042 A 38 LEU H A 37 VAL HGy% 1.0 1.8 5.9 1193 1042 A 38 LEU H A 37 VAL HGx% 1.0 1.8 5.9 1194 1043 A 37 VAL H A 37 VAL HGx% 1.0 1.8 4.6 1195 1044 A 37 VAL HA A 37 VAL H 1.0 1.8 3.6 1196 1045 A 37 VAL HB A 37 VAL H 1.0 1.8 3.6 1197 1046 A 38 LEU HBx A 38 LEU H 1.0 1.8 3.6 1198 1047 A 38 LEU HDy% A 38 LEU H 1.0 1.8 5.4 1199 1048 A 38 LEU HDx% A 40 MET H 1.0 1.8 5.4 1200 1049 A 38 LEU HA A 38 LEU H 1.0 1.8 4.4 1201 1050 A 38 LEU HBx A 39 LEU H 1.0 1.8 4.8 1202 1051 A 38 LEU HBy A 38 LEU H 1.0 1.8 3.6 1203 1052 A 38 LEU HDy% A 39 LEU H 1.0 1.8 5.4 1204 1053 A 38 LEU HDx% A 39 LEU H 1.0 1.8 5.4 1205 1054 A 38 LEU HDy% A 40 MET H 1.0 1.8 5.4 1206 1055 A 38 LEU HA A 39 LEU H 1.0 1.8 3.6 1207 1056 A 38 LEU HDx% A 38 LEU H 1.0 1.8 5.4 1208 1057 A 38 LEU HA A 40 MET H 1.0 1.8 4.8 1209 1058 A 40 MET H A 39 LEU HDy% 1.0 1.8 5.4 1210 1059 A 39 LEU HBx A 40 MET H 1.0 1.8 3.6 1211 1060 A 39 LEU HG A 40 MET H 1.0 1.8 4.4 1212 1061 A 39 LEU H A 39 LEU HBy 1.0 1.8 4.4 1213 1062 A 39 LEU HA A 40 MET H 1.0 1.8 4.4 1214 1063 A 39 LEU HDx% A 39 LEU H 1.0 1.8 5.4 1215 1064 A 39 LEU H A 39 LEU HDy% 1.0 1.8 5.4 1216 1065 A 39 LEU HBx A 39 LEU H 1.0 1.8 3.6 1217 1066 A 39 LEU HG A 39 LEU H 1.0 1.8 3.6 1218 1067 A 39 LEU HA A 39 LEU H 1.0 1.8 4.4 1219 1068 A 40 MET H A 39 LEU H 1.0 1.8 3.6 1220 1069 A 39 LEU HDx% A 40 MET H 1.0 1.8 5.4 1221 1070 A 40 MET H A 39 LEU HBy 1.0 1.8 3.6 1222 1071 A 40 MET HGy A 41 TYR H 1.0 1.8 3.6 1223 1072 A 40 MET HBy A 40 MET H 1.0 1.8 4.4 1224 1073 A 40 MET HBy A 41 TYR H 1.0 1.8 4.4 1225 1074 A 40 MET H A 40 MET HBx 1.0 1.8 4.4 1226 1075 A 40 MET HE% A 51 THR H 1.0 1.8 5.4 1227 1076 A 40 MET HE% A 49 THR H 1.0 1.8 5.4 1228 1077 A 40 MET HA A 41 TYR H 1.0 1.8 2.2 1229 1078 A 41 TYR H A 40 MET HBx 1.0 1.8 4.4 1230 1079 A 40 MET H A 41 TYR H 1.0 1.8 4.4 1231 1080 A 40 MET HA A 40 MET H 1.0 1.8 3.6 1232 1081 A 40 MET HGy A 40 MET H 1.0 1.8 4.4 1233 1082 A 42 VAL H A 41 TYR H 1.0 1.8 4.8 1234 1083 A 41 TYR HD% A 42 VAL H 1.0 1.8 6.9 1235 1084 A 41 TYR HBy A 42 VAL H 1.0 1.8 3.6 1236 1085 A 41 TYR HA A 42 VAL H 1.0 1.8 2.2 1237 1086 A 41 TYR HBx A 42 VAL H 1.0 1.8 4.4 1238 1087 A 41 TYR HD% A 41 TYR H 1.0 1.8 5.7 1239 1088 A 41 TYR HA A 41 TYR H 1.0 1.8 4.4 1240 1089 A 41 TYR HBx A 41 TYR H 1.0 1.8 3.6 1241 1090 A 41 TYR HBy A 41 TYR H 1.0 1.8 3.6 1242 1091 A 42 VAL HA A 43 ARG H 1.0 1.8 2.2 1243 1092 A 42 VAL HGx% A 42 VAL H 1.0 1.8 5.4 1244 1093 A 61 ALA H A 42 VAL HGy% 1.0 1.8 5.8 1245 1093 A 42 VAL HGx% A 61 ALA H 1.0 1.8 5.8 1246 1094 A 60 GLU H A 42 VAL HGy% 1.0 1.8 7.0 1247 1094 A 42 VAL HGx% A 60 GLU H 1.0 1.8 7.0 1248 1095 A 59 VAL H A 42 VAL HGy% 1.0 1.8 7.0 1249 1095 A 42 VAL HGx% A 59 VAL H 1.0 1.8 7.0 1250 1096 A 42 VAL H A 43 ARG H 1.0 1.8 4.4 1251 1097 A 42 VAL H A 42 VAL HGy% 1.0 1.8 4.6 1252 1098 A 42 VAL HA A 42 VAL H 1.0 1.8 3.6 1253 1099 A 48 ALA H A 42 VAL HGy% 1.0 1.8 5.4 1254 1100 A 42 VAL HGx% A 46 THR H 1.0 1.8 5.4 1255 1101 A 42 VAL HB A 43 ARG H 1.0 1.8 4.4 1256 1102 A 42 VAL HGx% A 43 ARG H 1.0 1.8 4.6 1257 1103 A 43 ARG H A 42 VAL HGy% 1.0 1.8 5.4 1258 1104 A 42 VAL HGx% A 48 ALA H 1.0 1.8 5.4 1259 1105 A 46 THR H A 43 ARG HBy 1.0 1.8 4.4 1260 1106 A 44 ILE H A 43 ARG HGy 1.0 1.8 4.4 1261 1107 A 44 ILE H A 43 ARG HBy 1.0 1.8 4.4 1262 1108 A 44 ILE H A 43 ARG HDy 1.0 1.8 4.4 1263 1109 A 46 THR HG2% A 43 ARG H 1.0 1.8 5.4 1264 1110 A 43 ARG H A 43 ARG HBy 1.0 1.8 3.6 1265 1111 A 44 ILE H A 43 ARG H 1.0 1.8 4.4 1266 1112 A 43 ARG H A 43 ARG HGy 1.0 1.8 4.4 1267 1113 A 43 ARG HA A 44 ILE H 1.0 1.8 3.6 1268 1114 A 43 ARG HA A 43 ARG H 1.0 1.8 3.6 1269 1115 A 43 ARG H A 43 ARG HDy 1.0 1.8 4.8 1270 1116 A 44 ILE HA A 46 THR H 1.0 1.8 3.6 1271 1117 A 44 ILE HG2% A 46 THR H 1.0 1.8 5.4 1272 1118 A 44 ILE HG1y A 45 GLY H 1.0 1.8 4.8 1273 1119 A 44 ILE HG2% A 44 ILE H 1.0 1.8 5.4 1274 1120 A 44 ILE HG1y A 44 ILE H 1.0 1.8 3.6 1275 1121 A 44 ILE HA A 44 ILE H 1.0 1.8 3.6 1276 1122 A 44 ILE HD1% A 63 ASP H 1.0 1.8 5.4 1277 1123 A 44 ILE HD1% A 64 GLN H 1.0 1.8 5.4 1278 1124 A 44 ILE HA A 45 GLY H 1.0 1.8 2.4 1279 1125 A 44 ILE HD1% A 45 GLY H 1.0 1.8 5.8 1280 1126 A 44 ILE HD1% A 85 TYR H 1.0 1.8 5.8 1281 1127 A 46 THR HG2% A 44 ILE H 1.0 1.8 5.8 1282 1128 A 44 ILE HG2% A 45 GLY H 1.0 1.8 4.6 1283 1129 A 44 ILE HD1% A 64 GLN HE2x 1.0 1.8 6.7 1284 1129 A 44 ILE HD1% A 64 GLN HE2y 1.0 1.8 6.7 1285 1130 A 44 ILE HG2% A 64 GLN H 1.0 1.8 5.4 1286 1131 A 44 ILE HB A 45 GLY H 1.0 1.8 4.4 1287 1132 A 44 ILE H A 45 GLY H 1.0 1.8 4.8 1288 1133 A 44 ILE HB A 44 ILE H 1.0 1.8 2.8 1289 1134 A 44 ILE HD1% A 44 ILE H 1.0 1.8 5.4 1290 1135 A 44 ILE HG2% A 63 ASP H 1.0 1.8 4.6 1291 1136 A 62 LYS HA A 45 GLY H 1.0 1.8 4.4 1292 1137 A 61 ALA H A 45 GLY H 1.0 1.8 4.4 1293 1138 A 46 THR H A 45 GLY HAy 1.0 1.8 3.6 1294 1139 A 45 GLY H A 45 GLY HAx 1.0 1.8 3.6 1295 1140 A 46 THR H A 45 GLY H 1.0 1.8 2.8 1296 1141 A 46 THR H A 45 GLY HAx 1.0 1.8 3.6 1297 1142 A 46 THR HG2% A 45 GLY H 1.0 1.8 5.4 1298 1143 A 61 ALA HB% A 45 GLY H 1.0 1.8 4.6 1299 1144 A 45 GLY H A 45 GLY HAy 1.0 1.8 3.6 1300 1145 A 46 THR HB A 47 THR H 1.0 1.8 2.8 1301 1146 A 61 ALA H A 46 THR H 1.0 1.8 4.4 1302 1147 A 46 THR HA A 47 THR H 1.0 1.8 2.2 1303 1148 A 46 THR H A 47 THR H 1.0 1.8 4.4 1304 1149 A 61 ALA HB% A 46 THR H 1.0 1.8 4.6 1305 1150 A 46 THR HG2% A 46 THR H 1.0 1.8 4.6 1306 1151 A 46 THR HA A 46 THR H 1.0 1.8 3.6 1307 1152 A 48 ALA H A 47 THR H 1.0 1.8 4.4 1308 1153 A 47 THR HA A 48 ALA H 1.0 1.8 2.2 1309 1154 A 47 THR HG2% A 61 ALA H 1.0 1.8 5.4 1310 1155 A 47 THR HB A 59 VAL H 1.0 1.8 4.8 1311 1156 A 47 THR HA A 61 ALA H 1.0 1.8 3.6 1312 1157 A 47 THR HB A 48 ALA H 1.0 1.8 2.4 1313 1158 A 47 THR HG2% A 47 THR H 1.0 1.8 4.6 1314 1159 A 47 THR HB A 47 THR H 1.0 1.8 3.6 1315 1160 A 47 THR HA A 47 THR H 1.0 1.8 3.6 1316 1161 A 47 THR HG2% A 48 ALA H 1.0 1.8 4.6 1317 1162 A 48 ALA HB% A 48 ALA H 1.0 1.8 4.6 1318 1163 A 58 GLU HGy A 48 ALA H 1.0 1.8 4.4 1319 1164 A 58 GLU HA A 48 ALA H 1.0 1.8 4.4 1320 1165 A 59 VAL HGx% A 48 ALA H 1.0 1.8 5.8 1321 1166 A 59 VAL H A 48 ALA H 1.0 1.8 3.6 1322 1167 A 48 ALA HA A 49 THR H 1.0 1.8 2.2 1323 1168 A 48 ALA HB% A 49 THR H 1.0 1.8 3.8 1324 1169 A 49 THR H A 48 ALA H 1.0 1.8 4.4 1325 1170 A 61 ALA H A 48 ALA H 1.0 1.8 4.4 1326 1171 A 48 ALA HA A 48 ALA H 1.0 1.8 3.6 1327 1172 A 48 ALA H A 59 VAL HGy% 1.0 1.8 4.6 1328 1173 A 49 THR HA A 58 GLU H 1.0 1.8 4.8 1329 1174 A 49 THR HB A 50 ILE H 1.0 1.8 4.8 1330 1175 A 49 THR HA A 59 VAL H 1.0 1.8 4.4 1331 1176 A 49 THR H A 58 GLU HGx 1.0 1.8 5.7 1332 1176 A 58 GLU HGy A 49 THR H 1.0 1.8 5.7 1333 1177 A 49 THR HA A 50 ILE H 1.0 1.8 2.2 1334 1178 A 49 THR HA A 57 PHE H 1.0 1.8 4.4 1335 1179 A 49 THR H A 59 VAL HGy% 1.0 1.8 5.8 1336 1180 A 49 THR HB A 49 THR H 1.0 1.8 3.6 1337 1181 A 49 THR HA A 49 THR H 1.0 1.8 3.6 1338 1182 A 49 THR HG2% A 49 THR H 1.0 1.8 5.4 1339 1183 A 49 THR H A 50 ILE H 1.0 1.8 4.8 1340 1184 A 59 VAL HGx% A 50 ILE H 1.0 1.8 5.8 1341 1185 A 50 ILE HA A 50 ILE H 1.0 1.8 3.6 1342 1186 A 50 ILE HG2% A 57 PHE H 1.0 1.8 5.8 1343 1187 A 50 ILE HD1% A 51 THR H 1.0 1.8 5.4 1344 1188 A 50 ILE HD1% A 57 PHE H 1.0 1.8 5.8 1345 1189 A 50 ILE H A 59 VAL HGy% 1.0 1.8 5.8 1346 1190 A 57 PHE HBy A 50 ILE H 1.0 1.8 4.8 1347 1191 A 50 ILE H A 50 ILE HG1x 1.0 1.8 3.6 1348 1192 A 50 ILE HB A 50 ILE H 1.0 1.8 3.6 1349 1193 A 50 ILE HB A 52 ALA H 1.0 1.8 4.8 1350 1194 A 50 ILE HG1y A 57 PHE H 1.0 1.8 4.8 1351 1195 A 50 ILE HG2% A 52 ALA H 1.0 1.8 5.8 1352 1196 A 50 ILE HG2% A 51 THR H 1.0 1.8 5.4 1353 1197 A 50 ILE HB A 51 THR H 1.0 1.8 3.6 1354 1198 A 50 ILE HA A 51 THR H 1.0 1.8 2.2 1355 1199 A 50 ILE HD1% A 50 ILE H 1.0 1.8 5.8 1356 1200 A 50 ILE HG2% A 50 ILE H 1.0 1.8 5.4 1357 1201 A 50 ILE HG1y A 50 ILE H 1.0 1.8 4.4 1358 1202 A 57 PHE HBx A 50 ILE H 1.0 1.8 4.8 1359 1203 A 56 GLU HA A 50 ILE H 1.0 1.8 4.8 1360 1204 A 58 GLU HA A 50 ILE H 1.0 1.8 4.4 1361 1205 A 59 VAL H A 50 ILE H 1.0 1.8 4.4 1362 1206 A 51 THR H A 50 ILE H 1.0 1.8 4.8 1363 1207 A 51 THR HG2% A 52 ALA H 1.0 1.8 4.6 1364 1208 A 51 THR HG2% A 55 HIS H 1.0 1.8 5.4 1365 1209 A 51 THR HA A 55 HIS H 1.0 1.8 4.4 1366 1210 A 51 THR H A 57 PHE H 1.0 1.8 4.8 1367 1211 A 51 THR H A 52 ALA H 1.0 1.8 4.4 1368 1212 A 51 THR HA A 57 PHE H 1.0 1.8 4.4 1369 1213 A 51 THR HG2% A 54 GLY H 1.0 1.8 5.4 1370 1214 A 51 THR HA A 52 ALA H 1.0 1.8 2.2 1371 1215 A 52 ALA HB% A 51 THR H 1.0 1.8 5.4 1372 1216 A 51 THR HB A 51 THR H 1.0 1.8 3.6 1373 1217 A 51 THR HA A 51 THR H 1.0 1.8 3.6 1374 1218 A 51 THR HB A 52 ALA H 1.0 1.8 4.4 1375 1219 A 51 THR HG2% A 51 THR H 1.0 1.8 5.4 1376 1220 A 57 PHE HD% A 52 ALA H 1.0 1.8 6.5 1377 1221 A 52 ALA HB% A 55 HIS H 1.0 1.8 5.4 1378 1222 A 52 ALA HB% A 53 ARG H 1.0 1.8 4.6 1379 1223 A 55 HIS HBy A 52 ALA H 1.0 1.8 4.8 1380 1224 A 55 HIS HBx A 52 ALA H 1.0 1.8 4.4 1381 1225 A 52 ALA HB% A 52 ALA H 1.0 1.8 4.6 1382 1226 A 52 ALA HA A 52 ALA H 1.0 1.8 4.4 1383 1227 A 56 GLU HA A 52 ALA H 1.0 1.8 4.4 1384 1228 A 57 PHE HE% A 52 ALA H 1.0 1.8 6.5 1385 1229 A 52 ALA H A 55 HIS H 1.0 1.8 3.6 1386 1230 A 52 ALA H A 54 GLY H 1.0 1.8 4.4 1387 1231 A 54 GLY H A 53 ARG HBy 1.0 1.8 4.4 1388 1232 A 54 GLY H A 53 ARG H 1.0 1.8 3.6 1389 1233 A 55 HIS H A 53 ARG H 1.0 1.8 4.4 1390 1234 A 53 ARG HBx A 55 HIS H 1.0 1.8 4.8 1391 1235 A 54 GLY H A 53 ARG HGy 1.0 1.8 4.8 1392 1236 A 53 ARG HBx A 54 GLY H 1.0 1.8 4.8 1393 1237 A 53 ARG HA A 55 HIS H 1.0 1.8 4.4 1394 1238 A 53 ARG HA A 54 GLY H 1.0 1.8 2.8 1395 1239 A 53 ARG H A 53 ARG HGy 1.0 1.8 4.4 1396 1240 A 53 ARG HBx A 53 ARG H 1.0 1.8 4.8 1397 1241 A 53 ARG HA A 53 ARG H 1.0 1.8 3.6 1398 1242 A 53 ARG HGx A 53 ARG H 1.0 1.8 4.4 1399 1243 A 54 GLY HAx A 55 HIS H 1.0 1.8 4.4 1400 1244 A 54 GLY HAy A 55 HIS H 1.0 1.8 4.4 1401 1245 A 55 HIS H A 54 GLY H 1.0 1.8 3.6 1402 1246 A 54 GLY HAy A 54 GLY H 1.0 1.8 3.6 1403 1247 A 54 GLY HAx A 54 GLY H 1.0 1.8 3.6 1404 1248 A 57 PHE HZ A 55 HIS H 1.0 1.8 4.8 1405 1249 A 55 HIS HA A 56 GLU H 1.0 1.8 2.2 1406 1250 A 57 PHE HE% A 55 HIS H 1.0 1.8 6.5 1407 1251 A 55 HIS HD2 A 55 HIS H 1.0 1.8 4.4 1408 1252 A 55 HIS HBy A 56 GLU H 1.0 1.8 3.6 1409 1253 A 55 HIS HBx A 56 GLU H 1.0 1.8 4.4 1410 1254 A 55 HIS HBy A 55 HIS H 1.0 1.8 4.4 1411 1255 A 55 HIS HBx A 55 HIS H 1.0 1.8 3.6 1412 1256 A 55 HIS H A 56 GLU H 1.0 1.8 4.4 1413 1257 A 55 HIS HA A 55 HIS H 1.0 1.8 3.6 1414 1258 A 56 GLU HBy A 57 PHE H 1.0 1.8 4.4 1415 1259 A 56 GLU HBy A 56 GLU H 1.0 1.8 3.6 1416 1260 A 56 GLU HBx A 56 GLU H 1.0 1.8 3.6 1417 1261 A 57 PHE HD% A 56 GLU H 1.0 1.8 6.9 1418 1262 A 56 GLU HBx A 57 PHE H 1.0 1.8 4.4 1419 1263 A 57 PHE H A 56 GLU HGy 1.0 1.8 5.3 1420 1263 A 57 PHE H A 56 GLU HGx 1.0 1.8 5.3 1421 1264 A 56 GLU H A 56 GLU HGx 1.0 1.8 3.6 1422 1265 A 56 GLU HA A 56 GLU H 1.0 1.8 3.6 1423 1266 A 57 PHE H A 56 GLU H 1.0 1.8 4.4 1424 1267 A 56 GLU HA A 57 PHE H 1.0 1.8 2.2 1425 1268 A 57 PHE HE% A 57 PHE H 1.0 1.8 6.9 1426 1269 A 57 PHE HBx A 58 GLU H 1.0 1.8 4.4 1427 1270 A 57 PHE HA A 58 GLU H 1.0 1.8 2.2 1428 1271 A 57 PHE HBy A 58 GLU H 1.0 1.8 4.4 1429 1272 A 57 PHE HD% A 58 GLU H 1.0 1.8 6.5 1430 1273 A 58 GLU H A 57 PHE H 1.0 1.8 4.4 1431 1274 A 57 PHE HD% A 57 PHE H 1.0 1.8 5.7 1432 1275 A 57 PHE HBx A 57 PHE H 1.0 1.8 3.6 1433 1276 A 57 PHE HBy A 57 PHE H 1.0 1.8 4.4 1434 1277 A 57 PHE HA A 57 PHE H 1.0 1.8 3.6 1435 1278 A 58 GLU HBx A 71 THR H 1.0 1.8 4.4 1436 1279 A 71 THR HG2% A 58 GLU H 1.0 1.8 5.8 1437 1280 A 58 GLU HBx A 59 VAL H 1.0 1.8 4.4 1438 1281 A 58 GLU HBy A 58 GLU H 1.0 1.8 3.6 1439 1282 A 58 GLU HBx A 58 GLU H 1.0 1.8 3.6 1440 1283 A 58 GLU H A 58 GLU HGx 1.0 1.8 5.3 1441 1283 A 58 GLU HGy A 58 GLU H 1.0 1.8 5.3 1442 1284 A 58 GLU HA A 58 GLU H 1.0 1.8 3.6 1443 1285 A 59 VAL H A 58 GLU H 1.0 1.8 4.4 1444 1286 A 58 GLU HBy A 59 VAL H 1.0 1.8 4.4 1445 1287 A 58 GLU HA A 59 VAL H 1.0 1.8 2.2 1446 1288 A 59 VAL HA A 71 THR H 1.0 1.8 3.6 1447 1289 A 60 GLU H A 59 VAL HGy% 1.0 1.8 5.4 1448 1290 A 59 VAL HGx% A 60 GLU H 1.0 1.8 4.6 1449 1291 A 69 ILE H A 59 VAL HGy% 1.0 1.8 5.8 1450 1292 A 59 VAL HA A 60 GLU H 1.0 1.8 2.2 1451 1293 A 60 GLU H A 59 VAL H 1.0 1.8 4.4 1452 1294 A 71 THR HG2% A 59 VAL H 1.0 1.8 5.8 1453 1295 A 59 VAL HGx% A 71 THR H 1.0 1.8 5.4 1454 1296 A 59 VAL HGx% A 69 ILE H 1.0 1.8 5.8 1455 1297 A 61 ALA H A 59 VAL HGy% 1.0 1.8 7.0 1456 1297 A 59 VAL HGx% A 61 ALA H 1.0 1.8 7.0 1457 1298 A 59 VAL H A 59 VAL HGy% 1.0 1.8 4.6 1458 1299 A 59 VAL HGx% A 59 VAL H 1.0 1.8 4.6 1459 1300 A 59 VAL HA A 59 VAL H 1.0 1.8 3.6 1460 1301 A 60 GLU H A 71 THR H 1.0 1.8 4.4 1461 1302 A 71 THR HG2% A 60 GLU H 1.0 1.8 5.4 1462 1303 A 60 GLU HBy A 60 GLU H 1.0 1.8 3.6 1463 1304 A 60 GLU HBx A 60 GLU H 1.0 1.8 3.6 1464 1305 A 60 GLU HA A 60 GLU H 1.0 1.8 3.6 1465 1306 A 60 GLU HBx A 61 ALA H 1.0 1.8 4.8 1466 1307 A 70 LEU HA A 60 GLU H 1.0 1.8 4.4 1467 1308 A 60 GLU H A 61 ALA H 1.0 1.8 4.4 1468 1309 A 69 ILE H A 60 GLU H 1.0 1.8 4.8 1469 1310 A 60 GLU HBy A 61 ALA H 1.0 1.8 4.4 1470 1311 A 60 GLU HGy A 61 ALA H 1.0 1.8 4.4 1471 1312 A 60 GLU HA A 61 ALA H 1.0 1.8 2.2 1472 1313 A 61 ALA H A 62 LYS H 1.0 1.8 4.8 1473 1314 A 61 ALA HB% A 61 ALA H 1.0 1.8 4.6 1474 1315 A 61 ALA HA A 61 ALA H 1.0 1.8 4.4 1475 1316 A 63 ASP H A 62 LYS HBx 1.0 1.8 4.5 1476 1316 A 62 LYS HBy A 63 ASP H 1.0 1.8 4.5 1477 1317 A 62 LYS HA A 63 ASP H 1.0 1.8 4.4 1478 1318 A 62 LYS HGy A 62 LYS H 1.0 1.8 4.4 1479 1319 A 62 LYS HGx A 62 LYS H 1.0 1.8 3.6 1480 1320 A 62 LYS HBy A 62 LYS H 1.0 1.8 3.6 1481 1321 A 62 LYS H A 62 LYS HBx 1.0 1.8 3.6 1482 1322 A 62 LYS HA A 62 LYS H 1.0 1.8 3.6 1483 1323 A 63 ASP H A 62 LYS H 1.0 1.8 2.8 1484 1324 A 62 LYS HGx A 63 ASP H 1.0 1.8 4.4 1485 1325 A 62 LYS HGy A 63 ASP H 1.0 1.8 4.4 1486 1326 A 63 ASP H A 63 ASP HBy 1.0 1.8 4.5 1487 1326 A 63 ASP HBx A 63 ASP H 1.0 1.8 4.5 1488 1327 A 63 ASP HA A 63 ASP H 1.0 1.8 3.6 1489 1328 A 63 ASP H A 64 GLN H 1.0 1.8 4.4 1490 1329 A 63 ASP HA A 64 GLN H 1.0 1.8 2.8 1491 1330 A 64 GLN H A 63 ASP HBy 1.0 1.8 4.5 1492 1330 A 63 ASP HBx A 64 GLN H 1.0 1.8 4.5 1493 1331 A 63 ASP H A 65 ASN H 1.0 1.8 4.4 1494 1332 A 63 ASP H A 66 CYS H 1.0 1.8 4.4 1495 1333 A 64 GLN HA A 66 CYS H 1.0 1.8 4.4 1496 1334 A 65 ASN H A 64 GLN HBx 1.0 1.8 5.3 1497 1334 A 65 ASN H A 64 GLN HBy 1.0 1.8 5.3 1498 1335 A 64 GLN HA A 65 ASN H 1.0 1.8 4.4 1499 1336 A 64 GLN HBx A 64 GLN HE2x 1.0 1.8 6.5 1500 1336 A 64 GLN HBy A 64 GLN HE2x 1.0 1.8 6.5 1501 1336 A 64 GLN HE2y A 64 GLN HBx 1.0 1.8 6.5 1502 1336 A 64 GLN HE2y A 64 GLN HBy 1.0 1.8 6.5 1503 1337 A 66 CYS H A 64 GLN HBx 1.0 1.8 5.7 1504 1337 A 66 CYS H A 64 GLN HBy 1.0 1.8 5.7 1505 1338 A 64 GLN H A 65 ASN H 1.0 1.8 3.6 1506 1339 A 64 GLN HA A 64 GLN H 1.0 1.8 3.6 1507 1340 A 64 GLN H A 64 GLN HGx 1.0 1.8 3.6 1508 1341 A 64 GLN H A 64 GLN HBx 1.0 1.8 3.6 1509 1342 A 64 GLN H A 64 GLN HBy 1.0 1.8 3.6 1510 1343 A 64 GLN HE2x A 64 GLN HGx 1.0 1.8 5.3 1511 1343 A 64 GLN HE2y A 64 GLN HGx 1.0 1.8 5.3 1512 1343 A 64 GLN HGy A 64 GLN HE2x 1.0 1.8 5.3 1513 1343 A 64 GLN HGy A 64 GLN HE2y 1.0 1.8 5.3 1514 1344 A 65 ASN H A 64 GLN HGx 1.0 1.8 5.3 1515 1344 A 64 GLN HGy A 65 ASN H 1.0 1.8 5.3 1516 1345 A 65 ASN HBy A 65 ASN H 1.0 1.8 3.6 1517 1346 A 65 ASN HBx A 65 ASN H 1.0 1.8 3.6 1518 1347 A 65 ASN HBy A 66 CYS H 1.0 1.8 4.4 1519 1348 A 65 ASN HBx A 66 CYS H 1.0 1.8 4.4 1520 1349 A 65 ASN HA A 66 CYS H 1.0 1.8 4.4 1521 1350 A 65 ASN HA A 65 ASN HD2x 1.0 1.8 5.7 1522 1350 A 65 ASN HA A 65 ASN HD2y 1.0 1.8 5.7 1523 1351 A 65 ASN HA A 65 ASN H 1.0 1.8 3.6 1524 1352 A 65 ASN H A 67 LYS H 1.0 1.8 4.8 1525 1353 A 65 ASN H A 66 CYS H 1.0 1.8 2.8 1526 1354 A 65 ASN HBy A 65 ASN HD2x 1.0 1.8 4.5 1527 1354 A 65 ASN HBy A 65 ASN HD2y 1.0 1.8 4.5 1528 1355 A 65 ASN HBx A 65 ASN HD2x 1.0 1.8 4.5 1529 1355 A 65 ASN HBx A 65 ASN HD2y 1.0 1.8 4.5 1530 1356 A 65 ASN H A 65 ASN HD2x 1.0 1.8 5.3 1531 1356 A 65 ASN H A 65 ASN HD2y 1.0 1.8 5.3 1532 1357 A 66 CYS HA A 67 LYS H 1.0 1.8 2.8 1533 1358 A 66 CYS HBy A 66 CYS H 1.0 1.8 4.4 1534 1359 A 66 CYS HBx A 66 CYS H 1.0 1.8 4.4 1535 1360 A 66 CYS HBy A 67 LYS H 1.0 1.8 4.8 1536 1361 A 66 CYS HBx A 67 LYS H 1.0 1.8 4.4 1537 1362 A 66 CYS H A 67 LYS H 1.0 1.8 3.6 1538 1363 A 66 CYS HA A 66 CYS H 1.0 1.8 2.8 1539 1364 A 68 VAL H A 67 LYS HGy 1.0 1.8 4.4 1540 1365 A 67 LYS HDx A 68 VAL H 1.0 1.8 4.4 1541 1366 A 68 VAL H A 67 LYS HBy 1.0 1.8 4.5 1542 1366 A 68 VAL H A 67 LYS HBx 1.0 1.8 4.5 1543 1367 A 69 ILE HD1% A 67 LYS H 1.0 1.8 5.4 1544 1368 A 67 LYS H A 67 LYS HGx 1.0 1.8 4.5 1545 1368 A 67 LYS H A 67 LYS HGy 1.0 1.8 4.5 1546 1369 A 67 LYS HDx A 67 LYS H 1.0 1.8 3.6 1547 1370 A 67 LYS HEy A 67 LYS H 1.0 1.8 4.4 1548 1371 A 69 ILE H A 67 LYS HBy 1.0 1.8 5.7 1549 1371 A 69 ILE H A 67 LYS HBx 1.0 1.8 5.7 1550 1372 A 67 LYS HA A 68 VAL H 1.0 1.8 2.2 1551 1373 A 67 LYS H A 68 VAL H 1.0 1.8 4.4 1552 1374 A 67 LYS H A 67 LYS HBy 1.0 1.8 4.5 1553 1374 A 67 LYS H A 67 LYS HBx 1.0 1.8 4.5 1554 1375 A 67 LYS HA A 67 LYS H 1.0 1.8 3.6 1555 1376 A 68 VAL H A 68 VAL HGy% 1.0 1.8 5.4 1556 1377 A 68 VAL HA A 68 VAL H 1.0 1.8 4.4 1557 1378 A 69 ILE H A 68 VAL H 1.0 1.8 4.4 1558 1379 A 70 LEU H A 68 VAL HGy% 1.0 1.8 5.8 1559 1380 A 68 VAL HGx% A 68 VAL H 1.0 1.8 4.6 1560 1381 A 68 VAL HB A 68 VAL H 1.0 1.8 3.6 1561 1382 A 76 ALA H A 68 VAL HGy% 1.0 1.8 6.6 1562 1382 A 68 VAL HGx% A 76 ALA H 1.0 1.8 6.6 1563 1383 A 69 ILE H A 68 VAL HGy% 1.0 1.8 4.6 1564 1384 A 68 VAL HA A 69 ILE H 1.0 1.8 2.8 1565 1385 A 69 ILE HG1x A 69 ILE H 1.0 1.8 4.4 1566 1386 A 69 ILE HA A 69 ILE H 1.0 1.8 4.4 1567 1387 A 69 ILE H A 70 LEU H 1.0 1.8 4.4 1568 1388 A 69 ILE HA A 70 LEU H 1.0 1.8 2.2 1569 1389 A 69 ILE HG1x A 70 LEU H 1.0 1.8 4.8 1570 1390 A 69 ILE HD1% A 69 ILE H 1.0 1.8 5.4 1571 1391 A 69 ILE HB A 69 ILE H 1.0 1.8 3.6 1572 1392 A 74 LYS H A 70 LEU HDy% 1.0 1.8 6.7 1573 1392 A 70 LEU HDx% A 74 LYS H 1.0 1.8 6.7 1574 1393 A 73 GLY H A 70 LEU HDy% 1.0 1.8 7.1 1575 1393 A 70 LEU HDx% A 73 GLY H 1.0 1.8 7.1 1576 1394 A 70 LEU HBy A 73 GLY H 1.0 1.8 4.4 1577 1395 A 70 LEU HBx A 73 GLY H 1.0 1.8 4.4 1578 1396 A 70 LEU HBx A 72 ASN H 1.0 1.8 4.4 1579 1397 A 70 LEU HA A 72 ASN H 1.0 1.8 4.4 1580 1398 A 70 LEU HDx% A 71 THR H 1.0 1.8 5.4 1581 1399 A 70 LEU HBx A 71 THR H 1.0 1.8 3.6 1582 1400 A 70 LEU HG A 70 LEU H 1.0 1.8 4.4 1583 1401 A 76 ALA HB% A 70 LEU H 1.0 1.8 5.8 1584 1402 A 71 THR H A 70 LEU H 1.0 1.8 4.4 1585 1403 A 70 LEU H A 70 LEU HDy% 1.0 1.8 5.9 1586 1403 A 70 LEU HDx% A 70 LEU H 1.0 1.8 5.9 1587 1404 A 70 LEU H A 74 LYS H 1.0 1.8 4.8 1588 1405 A 70 LEU HA A 70 LEU H 1.0 1.8 3.6 1589 1406 A 70 LEU HBx A 70 LEU H 1.0 1.8 3.6 1590 1407 A 70 LEU HBy A 70 LEU H 1.0 1.8 3.6 1591 1408 A 70 LEU H A 73 GLY H 1.0 1.8 4.8 1592 1409 A 70 LEU HDy% A 72 ASN HD2x 1.0 1.8 7.5 1593 1409 A 70 LEU HDx% A 72 ASN HD2x 1.0 1.8 7.5 1594 1409 A 72 ASN HD2y A 70 LEU HDy% 1.0 1.8 7.5 1595 1409 A 70 LEU HDx% A 72 ASN HD2y 1.0 1.8 7.5 1596 1410 A 72 ASN H A 70 LEU HDy% 1.0 1.8 6.7 1597 1410 A 70 LEU HDx% A 72 ASN H 1.0 1.8 6.7 1598 1411 A 70 LEU HBy A 72 ASN H 1.0 1.8 3.6 1599 1412 A 70 LEU HA A 71 THR H 1.0 1.8 2.4 1600 1413 A 71 THR H A 70 LEU HDy% 1.0 1.8 4.6 1601 1414 A 70 LEU HG A 71 THR H 1.0 1.8 4.4 1602 1415 A 70 LEU HBy A 71 THR H 1.0 1.8 3.6 1603 1416 A 70 LEU HG A 72 ASN HD2x 1.0 1.8 5.3 1604 1416 A 70 LEU HG A 72 ASN HD2y 1.0 1.8 5.3 1605 1417 A 70 LEU H A 72 ASN H 1.0 1.8 4.8 1606 1418 A 76 ALA H A 70 LEU HDy% 1.0 1.8 6.7 1607 1418 A 70 LEU HDx% A 76 ALA H 1.0 1.8 6.7 1608 1419 A 75 GLN H A 70 LEU HDy% 1.0 1.8 7.1 1609 1419 A 70 LEU HDx% A 75 GLN H 1.0 1.8 7.1 1610 1420 A 70 LEU HBx A 74 LYS H 1.0 1.8 4.4 1611 1421 A 71 THR HB A 72 ASN H 1.0 1.8 4.4 1612 1422 A 71 THR HB A 71 THR H 1.0 1.8 4.4 1613 1423 A 71 THR H A 73 GLY H 1.0 1.8 4.8 1614 1424 A 71 THR HG2% A 73 GLY H 1.0 1.8 5.8 1615 1425 A 71 THR H A 74 LYS H 1.0 1.8 4.8 1616 1426 A 71 THR H A 72 ASN H 1.0 1.8 3.6 1617 1427 A 71 THR HG2% A 72 ASN H 1.0 1.8 5.4 1618 1428 A 71 THR HA A 72 ASN H 1.0 1.8 3.6 1619 1429 A 71 THR HG2% A 71 THR H 1.0 1.8 3.8 1620 1430 A 71 THR HA A 71 THR H 1.0 1.8 3.6 1621 1431 A 72 ASN HA A 73 GLY H 1.0 1.8 4.4 1622 1432 A 74 LYS H A 72 ASN H 1.0 1.8 4.4 1623 1433 A 74 LYS H A 72 ASN HD2x 1.0 1.8 5.7 1624 1433 A 74 LYS H A 72 ASN HD2y 1.0 1.8 5.7 1625 1434 A 72 ASN HBx A 74 LYS H 1.0 1.8 4.8 1626 1435 A 72 ASN HA A 72 ASN HD2x 1.0 1.8 5.3 1627 1435 A 72 ASN HA A 72 ASN HD2y 1.0 1.8 5.3 1628 1436 A 72 ASN HD2y A 74 LYS HGx 1.0 1.8 6.1 1629 1436 A 72 ASN HD2x A 74 LYS HGx 1.0 1.8 6.1 1630 1436 A 74 LYS HGy A 72 ASN HD2x 1.0 1.8 6.1 1631 1436 A 72 ASN HD2y A 74 LYS HGy 1.0 1.8 6.1 1632 1437 A 72 ASN HBy A 73 GLY H 1.0 1.8 4.8 1633 1438 A 72 ASN HBx A 73 GLY H 1.0 1.8 4.8 1634 1439 A 73 GLY H A 72 ASN H 1.0 1.8 2.8 1635 1440 A 72 ASN H A 72 ASN HD2x 1.0 1.8 5.7 1636 1440 A 72 ASN H A 72 ASN HD2y 1.0 1.8 5.7 1637 1441 A 72 ASN HA A 72 ASN H 1.0 1.8 3.6 1638 1442 A 72 ASN HBy A 72 ASN H 1.0 1.8 3.6 1639 1443 A 72 ASN HBx A 72 ASN H 1.0 1.8 4.4 1640 1444 A 72 ASN HBy A 72 ASN HD2x 1.0 1.8 4.5 1641 1444 A 72 ASN HBy A 72 ASN HD2y 1.0 1.8 4.5 1642 1445 A 72 ASN HBx A 72 ASN HD2x 1.0 1.8 4.5 1643 1445 A 72 ASN HBx A 72 ASN HD2y 1.0 1.8 4.5 1644 1446 A 72 ASN HD2x A 74 LYS HBx 1.0 1.8 6.1 1645 1446 A 72 ASN HD2y A 74 LYS HBx 1.0 1.8 6.1 1646 1446 A 74 LYS HBy A 72 ASN HD2x 1.0 1.8 6.1 1647 1446 A 74 LYS HBy A 72 ASN HD2y 1.0 1.8 6.1 1648 1447 A 73 GLY HAx A 74 LYS H 1.0 1.8 4.4 1649 1448 A 73 GLY HAy A 74 LYS H 1.0 1.8 4.4 1650 1449 A 73 GLY H A 74 LYS HGx 1.0 1.8 4.8 1651 1450 A 74 LYS H A 73 GLY H 1.0 1.8 2.8 1652 1451 A 74 LYS HA A 73 GLY H 1.0 1.8 4.8 1653 1452 A 73 GLY HAx A 73 GLY H 1.0 1.8 3.6 1654 1453 A 73 GLY HAy A 73 GLY H 1.0 1.8 3.6 1655 1454 A 75 GLN H A 74 LYS HBx 1.0 1.8 3.7 1656 1454 A 74 LYS HBy A 75 GLN H 1.0 1.8 3.7 1657 1455 A 74 LYS HA A 75 GLN H 1.0 1.8 2.2 1658 1456 A 74 LYS H A 74 LYS HGx 1.0 1.8 3.6 1659 1457 A 74 LYS H A 74 LYS HDy 1.0 1.8 4.4 1660 1458 A 74 LYS HA A 74 LYS H 1.0 1.8 3.6 1661 1459 A 74 LYS HEy A 74 LYS H 1.0 1.8 4.8 1662 1460 A 75 GLN H A 74 LYS HDx 1.0 1.8 5.3 1663 1460 A 75 GLN H A 74 LYS HDy 1.0 1.8 5.3 1664 1461 A 75 GLN H A 74 LYS HGx 1.0 1.8 5.3 1665 1461 A 75 GLN H A 74 LYS HGy 1.0 1.8 5.3 1666 1462 A 74 LYS H A 75 GLN H 1.0 1.8 4.4 1667 1463 A 74 LYS HBy A 74 LYS H 1.0 1.8 3.6 1668 1464 A 75 GLN HA A 75 GLN HE2x 1.0 1.8 5.7 1669 1464 A 75 GLN HA A 75 GLN HE2y 1.0 1.8 5.7 1670 1465 A 75 GLN H A 75 GLN HBx 1.0 1.8 2.8 1671 1466 A 75 GLN HE2x A 75 GLN HGy 1.0 1.8 6.1 1672 1466 A 75 GLN HE2y A 75 GLN HGy 1.0 1.8 6.1 1673 1466 A 75 GLN HGx A 75 GLN HE2x 1.0 1.8 6.1 1674 1466 A 75 GLN HE2y A 75 GLN HGx 1.0 1.8 6.1 1675 1467 A 76 ALA H A 75 GLN HBy 1.0 1.8 4.5 1676 1467 A 76 ALA H A 75 GLN HBx 1.0 1.8 4.5 1677 1468 A 76 ALA H A 75 GLN HGy 1.0 1.8 4.5 1678 1468 A 76 ALA H A 75 GLN HGx 1.0 1.8 4.5 1679 1469 A 75 GLN HA A 76 ALA H 1.0 1.8 2.8 1680 1470 A 75 GLN H A 75 GLN HGy 1.0 1.8 4.4 1681 1471 A 75 GLN HA A 75 GLN H 1.0 1.8 3.6 1682 1472 A 76 ALA H A 75 GLN H 1.0 1.8 4.4 1683 1473 A 76 ALA H A 77 PRO HDx 1.0 1.8 4.8 1684 1474 A 77 PRO HDy A 76 ALA H 1.0 1.8 4.8 1685 1475 A 76 ALA HB% A 76 ALA H 1.0 1.8 3.8 1686 1476 A 79 TRP HE1 A 77 PRO HGy 1.0 1.8 4.8 1687 1477 A 79 TRP HE1 A 77 PRO HGx 1.0 1.8 4.8 1688 1478 A 80 LEU H A 77 PRO HGy 1.0 1.8 5.3 1689 1478 A 80 LEU H A 77 PRO HGx 1.0 1.8 5.3 1690 1479 A 77 PRO HBx A 80 LEU H 1.0 1.8 4.8 1691 1480 A 77 PRO HBy A 79 TRP HE1 1.0 1.8 4.4 1692 1481 A 77 PRO HBx A 79 TRP HE1 1.0 1.8 3.6 1693 1482 A 77 PRO HBy A 80 LEU H 1.0 1.8 4.4 1694 1483 A 77 PRO HBy A 79 TRP H 1.0 1.8 3.6 1695 1484 A 77 PRO HBx A 79 TRP H 1.0 1.8 4.4 1696 1485 A 77 PRO HBy A 78 ASP H 1.0 1.8 4.4 1697 1486 A 77 PRO HBx A 78 ASP H 1.0 1.8 3.6 1698 1487 A 78 ASP HA A 79 TRP H 1.0 1.8 3.6 1699 1488 A 80 LEU H A 78 ASP H 1.0 1.8 4.8 1700 1489 A 78 ASP HA A 78 ASP H 1.0 1.8 2.8 1701 1490 A 78 ASP HA A 80 LEU H 1.0 1.8 4.4 1702 1491 A 79 TRP H A 78 ASP HBy 1.0 1.8 5.3 1703 1491 A 79 TRP H A 78 ASP HBx 1.0 1.8 5.3 1704 1492 A 78 ASP H A 78 ASP HBy 1.0 1.8 3.6 1705 1493 A 79 TRP H A 78 ASP H 1.0 1.8 3.6 1706 1494 A 79 TRP HD1 A 80 LEU H 1.0 1.8 4.8 1707 1495 A 79 TRP HE3 A 81 ALA H 1.0 1.8 4.8 1708 1496 A 79 TRP HE3 A 80 LEU H 1.0 1.8 4.4 1709 1497 A 80 LEU H A 79 TRP HBy 1.0 1.8 4.8 1710 1498 A 80 LEU H A 79 TRP HBx 1.0 1.8 4.8 1711 1499 A 79 TRP HA A 80 LEU H 1.0 1.8 4.4 1712 1500 A 79 TRP HE1 A 79 TRP H 1.0 1.8 4.4 1713 1501 A 79 TRP HD1 A 79 TRP H 1.0 1.8 3.6 1714 1502 A 80 LEU H A 79 TRP H 1.0 1.8 2.8 1715 1503 A 79 TRP H A 79 TRP HBy 1.0 1.8 3.6 1716 1504 A 79 TRP HBx A 79 TRP H 1.0 1.8 4.4 1717 1505 A 79 TRP HA A 79 TRP H 1.0 1.8 3.6 1718 1506 A 80 LEU HA A 81 ALA H 1.0 1.8 2.2 1719 1507 A 80 LEU HG A 81 ALA H 1.0 1.8 4.4 1720 1508 A 80 LEU HG A 80 LEU H 1.0 1.8 4.4 1721 1509 A 80 LEU HBy A 81 ALA H 1.0 1.8 4.4 1722 1510 A 80 LEU HDx% A 81 ALA H 1.0 1.8 4.6 1723 1511 A 81 ALA H A 80 LEU HBx 1.0 1.8 4.8 1724 1512 A 80 LEU H A 80 LEU HBx 1.0 1.8 3.6 1725 1513 A 80 LEU HDx% A 80 LEU H 1.0 1.8 5.4 1726 1514 A 80 LEU HBy A 80 LEU H 1.0 1.8 3.6 1727 1515 A 80 LEU HA A 80 LEU H 1.0 1.8 3.6 1728 1516 A 81 ALA H A 80 LEU H 1.0 1.8 4.4 1729 1517 A 81 ALA HB% A 82 ALA H 1.0 1.8 4.6 1730 1518 A 81 ALA HA A 82 ALA H 1.0 1.8 2.2 1731 1519 A 81 ALA H A 82 ALA H 1.0 1.8 4.4 1732 1520 A 81 ALA HB% A 83 GLU H 1.0 1.8 5.8 1733 1521 A 81 ALA HA A 81 ALA H 1.0 1.8 3.6 1734 1522 A 81 ALA HB% A 81 ALA H 1.0 1.8 4.6 1735 1523 A 82 ALA HB% A 82 ALA H 1.0 1.8 4.6 1736 1524 A 82 ALA HA A 82 ALA H 1.0 1.8 3.6 1737 1525 A 82 ALA HA A 83 GLU H 1.0 1.8 2.2 1738 1526 A 82 ALA HB% A 83 GLU H 1.0 1.8 4.6 1739 1527 A 83 GLU H A 82 ALA H 1.0 1.8 4.4 1740 1528 A 84 PRO HDx A 83 GLU H 1.0 1.8 4.8 1741 1529 A 84 PRO HDy A 83 GLU H 1.0 1.8 4.8 1742 1530 A 83 GLU HBy A 83 GLU H 1.0 1.8 4.4 1743 1531 A 83 GLU HBx A 83 GLU H 1.0 1.8 4.4 1744 1532 A 83 GLU HGy A 83 GLU H 1.0 1.8 4.4 1745 1533 A 83 GLU HA A 83 GLU H 1.0 1.8 3.6 1746 1534 A 84 PRO HA A 85 TYR H 1.0 1.8 2.2 1747 1535 A 85 TYR H A 84 PRO HGy 1.0 1.8 5.7 1748 1535 A 84 PRO HGx A 85 TYR H 1.0 1.8 5.7 1749 1536 A 84 PRO HBx A 85 TYR H 1.0 1.8 4.4 1750 1537 A 84 PRO HBy A 85 TYR H 1.0 1.8 4.4 1751 1538 A 85 TYR HA A 85 TYR H 1.0 1.8 3.6 1752 1539 A 85 TYR HBx A 85 TYR H 1.0 1.8 4.4 1753 1540 A 85 TYR H A 85 TYR HBy 1.0 1.8 3.6 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 25 CYS H A 42 VAL O 1.0 1.8 2.0 2 2 A 42 VAL O A 25 CYS N 1.0 1.8 3.0 3 3 A 26 VAL H A 83 GLU O 1.0 1.8 2.0 4 4 A 83 GLU O A 26 VAL N 1.0 1.8 3.0 5 5 A 27 TYR H A 40 MET O 1.0 1.8 2.0 6 6 A 40 MET O A 27 TYR N 1.0 1.8 3.0 7 7 A 28 TYR H A 81 ALA O 1.0 1.8 2.0 8 8 A 81 ALA O A 28 TYR N 1.0 1.8 3.0 9 9 A 29 ASP H A 37 VAL O 1.0 1.8 2.0 10 10 A 37 VAL O A 29 ASP N 1.0 1.8 3.0 11 11 A 30 GLY H A 79 TRP O 1.0 1.8 2.0 12 12 A 79 TRP O A 30 GLY N 1.0 1.8 3.0 13 13 A 42 VAL H A 25 CYS O 1.0 1.8 2.0 14 14 A 25 CYS O A 42 VAL N 1.0 1.8 3.0 15 15 A 44 ILE H A 23 ARG O 1.0 1.8 2.0 16 16 A 23 ARG O A 44 ILE N 1.0 1.8 3.0 17 17 A 45 GLY H A 61 ALA O 1.0 1.8 2.0 18 18 A 61 ALA O A 45 GLY N 1.0 1.8 3.0 19 19 A 46 THR H A 43 ARG O 1.0 1.8 2.0 20 20 A 43 ARG O A 46 THR N 1.0 1.8 3.0 21 21 A 48 ALA H A 59 VAL O 1.0 1.8 2.0 22 22 A 59 VAL O A 48 ALA N 1.0 1.8 3.0 23 23 A 50 ILE H A 57 PHE O 1.0 1.8 2.0 24 24 A 57 PHE O A 50 ILE N 1.0 1.8 3.0 25 25 A 52 ALA H A 55 HIS O 1.0 1.8 2.0 26 26 A 55 HIS O A 52 ALA N 1.0 1.8 3.0 27 27 A 57 PHE H A 50 ILE O 1.0 1.8 2.0 28 28 A 50 ILE O A 57 PHE N 1.0 1.8 3.0 29 29 A 59 VAL H A 48 ALA O 1.0 1.8 2.0 30 30 A 48 ALA O A 59 VAL N 1.0 1.8 3.0 31 31 A 60 GLU H A 69 ILE O 1.0 1.8 2.0 32 32 A 69 ILE O A 60 GLU N 1.0 1.8 3.0 33 33 A 61 ALA H A 46 THR O 1.0 1.8 2.0 34 34 A 46 THR O A 61 ALA N 1.0 1.8 3.0 35 35 A 81 ALA H A 28 TYR O 1.0 1.8 2.0 36 36 A 28 TYR O A 81 ALA N 1.0 1.8 3.0 37 37 A 83 GLU H A 26 VAL O 1.0 1.8 2.0 38 38 A 26 VAL O A 83 GLU N 1.0 1.8 3.0 39 39 A 85 TYR H A 24 PHE O 1.0 1.8 2.0 40 40 A 24 PHE O A 85 TYR N 1.0 1.8 3.0 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _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 21 PRO C A 22 ALA N A 22 ALA CA A 22 ALA C 1.0 -144.0 -72.0 PHI 2 2 A 22 ALA N A 22 ALA CA A 22 ALA C A 23 ARG N 1.0 95.0 151.0 PSI 3 3 A 23 ARG C A 24 PHE N A 24 PHE CA A 24 PHE C 1.0 -166.0 -82.0 PHI 4 4 A 24 PHE N A 24 PHE CA A 24 PHE C A 25 CYS N 1.0 110.0 186.0 PSI 5 5 A 24 PHE C A 25 CYS N A 25 CYS CA A 25 CYS C 1.0 -168.0 -112.0 PHI 6 6 A 25 CYS N A 25 CYS CA A 25 CYS C A 26 VAL N 1.0 129.0 161.0 PSI 7 7 A 25 CYS C A 26 VAL N A 26 VAL CA A 26 VAL C 1.0 -133.0 -89.0 PHI 8 8 A 26 VAL N A 26 VAL CA A 26 VAL C A 27 TYR N 1.0 92.0 164.0 PSI 9 9 A 26 VAL C A 27 TYR N A 27 TYR CA A 27 TYR C 1.0 -145.0 -65.0 PHI 10 10 A 27 TYR N A 27 TYR CA A 27 TYR C A 28 TYR N 1.0 116.0 168.0 PSI 11 11 A 27 TYR C A 28 TYR N A 28 TYR CA A 28 TYR C 1.0 -164.0 -120.0 PHI 12 12 A 28 TYR N A 28 TYR CA A 28 TYR C A 29 ASP N 1.0 139.0 179.0 PSI 13 13 A 28 TYR C A 29 ASP N A 29 ASP CA A 29 ASP C 1.0 -132.0 -80.0 PHI 14 14 A 29 ASP N A 29 ASP CA A 29 ASP C A 30 GLY N 1.0 96.0 152.0 PSI 15 15 A 33 PRO C A 34 ALA N A 34 ALA CA A 34 ALA C 1.0 -94.0 -46.0 PHI 16 16 A 34 ALA N A 34 ALA CA A 34 ALA C A 35 THR N 1.0 -62.0 2.0 PSI 17 17 A 34 ALA C A 35 THR N A 35 THR CA A 35 THR C 1.0 -135.0 -83.0 PHI 18 18 A 35 THR N A 35 THR CA A 35 THR C A 36 ARG N 1.0 -27.0 25.0 PSI 19 19 A 35 THR C A 36 ARG N A 36 ARG CA A 36 ARG C 1.0 -98.0 -54.0 PHI 20 20 A 36 ARG N A 36 ARG CA A 36 ARG C A 37 VAL N 1.0 108.0 180.0 PSI 21 21 A 36 ARG C A 37 VAL N A 37 VAL CA A 37 VAL C 1.0 -146.0 -90.0 PHI 22 22 A 37 VAL N A 37 VAL CA A 37 VAL C A 38 LEU N 1.0 114.0 162.0 PSI 23 23 A 37 VAL C A 38 LEU N A 38 LEU CA A 38 LEU C 1.0 -96.0 -60.0 PHI 24 24 A 38 LEU N A 38 LEU CA A 38 LEU C A 39 LEU N 1.0 111.0 147.0 PSI 25 25 A 38 LEU C A 39 LEU N A 39 LEU CA A 39 LEU C 1.0 -124.0 -68.0 PHI 26 26 A 39 LEU N A 39 LEU CA A 39 LEU C A 40 MET N 1.0 -62.0 -10.0 PSI 27 27 A 39 LEU C A 40 MET N A 40 MET CA A 40 MET C 1.0 -182.0 -134.0 PHI 28 28 A 40 MET N A 40 MET CA A 40 MET C A 41 TYR N 1.0 119.0 167.0 PSI 29 29 A 40 MET C A 41 TYR N A 41 TYR CA A 41 TYR C 1.0 -166.0 -66.0 PHI 30 30 A 41 TYR N A 41 TYR CA A 41 TYR C A 42 VAL N 1.0 75.0 183.0 PSI 31 31 A 41 TYR C A 42 VAL N A 42 VAL CA A 42 VAL C 1.0 -143.0 -79.0 PHI 32 32 A 42 VAL N A 42 VAL CA A 42 VAL C A 43 ARG N 1.0 93.0 161.0 PSI 33 33 A 42 VAL C A 43 ARG N A 43 ARG CA A 43 ARG C 1.0 -134.0 -42.0 PHI 34 34 A 43 ARG N A 43 ARG CA A 43 ARG C A 44 ILE N 1.0 100.0 156.0 PSI 35 35 A 45 GLY C A 46 THR N A 46 THR CA A 46 THR C 1.0 -173.0 -89.0 PHI 36 36 A 46 THR N A 46 THR CA A 46 THR C A 47 THR N 1.0 151.0 175.0 PSI 37 37 A 46 THR C A 47 THR N A 47 THR CA A 47 THR C 1.0 -152.0 -100.0 PHI 38 38 A 47 THR N A 47 THR CA A 47 THR C A 48 ALA N 1.0 139.0 163.0 PSI 39 39 A 47 THR C A 48 ALA N A 48 ALA CA A 48 ALA C 1.0 -201.0 -101.0 PHI 40 40 A 48 ALA N A 48 ALA CA A 48 ALA C A 49 THR N 1.0 124.0 176.0 PSI 41 41 A 48 ALA C A 49 THR N A 49 THR CA A 49 THR C 1.0 -123.0 -83.0 PHI 42 42 A 49 THR N A 49 THR CA A 49 THR C A 50 ILE N 1.0 106.0 142.0 PSI 43 43 A 49 THR C A 50 ILE N A 50 ILE CA A 50 ILE C 1.0 -135.0 -95.0 PHI 44 44 A 50 ILE N A 50 ILE CA A 50 ILE C A 51 THR N 1.0 110.0 146.0 PSI 45 45 A 50 ILE C A 51 THR N A 51 THR CA A 51 THR C 1.0 -139.0 -83.0 PHI 46 46 A 51 THR N A 51 THR CA A 51 THR C A 52 ALA N 1.0 108.0 144.0 PSI 47 47 A 51 THR C A 52 ALA N A 52 ALA CA A 52 ALA C 1.0 -183.0 -51.0 PHI 48 48 A 52 ALA N A 52 ALA CA A 52 ALA C A 53 ARG N 1.0 133.0 181.0 PSI 49 49 A 52 ALA C A 53 ARG N A 53 ARG CA A 53 ARG C 1.0 39.0 63.0 PHI 50 50 A 53 ARG N A 53 ARG CA A 53 ARG C A 54 GLY N 1.0 27.0 47.0 PSI 51 51 A 53 ARG C A 54 GLY N A 54 GLY CA A 54 GLY C 1.0 65.0 89.0 PHI 52 52 A 54 GLY N A 54 GLY CA A 54 GLY C A 55 HIS N 1.0 -16.0 24.0 PSI 53 53 A 54 GLY C A 55 HIS N A 55 HIS CA A 55 HIS C 1.0 -148.0 -80.0 PHI 54 54 A 55 HIS N A 55 HIS CA A 55 HIS C A 56 GLU N 1.0 80.0 204.0 PSI 55 55 A 55 HIS C A 56 GLU N A 56 GLU CA A 56 GLU C 1.0 -149.0 -69.0 PHI 56 56 A 56 GLU N A 56 GLU CA A 56 GLU C A 57 PHE N 1.0 114.0 174.0 PSI 57 57 A 56 GLU C A 57 PHE N A 57 PHE CA A 57 PHE C 1.0 -164.0 -84.0 PHI 58 58 A 57 PHE N A 57 PHE CA A 57 PHE C A 58 GLU N 1.0 106.0 166.0 PSI 59 59 A 57 PHE C A 58 GLU N A 58 GLU CA A 58 GLU C 1.0 -139.0 -75.0 PHI 60 60 A 58 GLU N A 58 GLU CA A 58 GLU C A 59 VAL N 1.0 109.0 161.0 PSI 61 61 A 58 GLU C A 59 VAL N A 59 VAL CA A 59 VAL C 1.0 -161.0 -85.0 PHI 62 62 A 59 VAL N A 59 VAL CA A 59 VAL C A 60 GLU N 1.0 136.0 184.0 PSI 63 63 A 59 VAL C A 60 GLU N A 60 GLU CA A 60 GLU C 1.0 -166.0 -86.0 PHI 64 64 A 60 GLU N A 60 GLU CA A 60 GLU C A 61 ALA N 1.0 106.0 146.0 PSI 65 65 A 60 GLU C A 61 ALA N A 61 ALA CA A 61 ALA C 1.0 -101.0 -77.0 PHI 66 66 A 61 ALA N A 61 ALA CA A 61 ALA C A 62 LYS N 1.0 64.0 164.0 PSI 67 67 A 61 ALA C A 62 LYS N A 62 LYS CA A 62 LYS C 1.0 -106.0 -46.0 PHI 68 68 A 62 LYS N A 62 LYS CA A 62 LYS C A 63 ASP N 1.0 -57.0 -21.0 PSI 69 69 A 67 LYS C A 68 VAL N A 68 VAL CA A 68 VAL C 1.0 -114.0 -46.0 PHI 70 70 A 68 VAL N A 68 VAL CA A 68 VAL C A 69 ILE N 1.0 92.0 156.0 PSI 71 71 A 68 VAL C A 69 ILE N A 69 ILE CA A 69 ILE C 1.0 -152.0 -84.0 PHI 72 72 A 69 ILE N A 69 ILE CA A 69 ILE C A 70 LEU N 1.0 119.0 163.0 PSI 73 73 A 69 ILE C A 70 LEU N A 70 LEU CA A 70 LEU C 1.0 -107.0 -71.0 PHI 74 74 A 70 LEU N A 70 LEU CA A 70 LEU C A 71 THR N 1.0 129.0 209.0 PSI 75 75 A 70 LEU C A 71 THR N A 71 THR CA A 71 THR C 1.0 -78.0 -50.0 PHI 76 76 A 71 THR N A 71 THR CA A 71 THR C A 72 ASN N 1.0 -42.0 6.0 PSI 77 77 A 71 THR C A 72 ASN N A 72 ASN CA A 72 ASN C 1.0 -106.0 -70.0 PHI 78 78 A 72 ASN N A 72 ASN CA A 72 ASN C A 73 GLY N 1.0 -13.0 31.0 PSI 79 79 A 72 ASN C A 73 GLY N A 73 GLY CA A 73 GLY C 1.0 74.0 114.0 PHI 80 80 A 73 GLY N A 73 GLY CA A 73 GLY C A 74 LYS N 1.0 -22.0 22.0 PSI 81 81 A 77 PRO C A 78 ASP N A 78 ASP CA A 78 ASP C 1.0 -82.0 -46.0 PHI 82 82 A 78 ASP N A 78 ASP CA A 78 ASP C A 79 TRP N 1.0 -46.0 -2.0 PSI 83 83 A 79 TRP C A 80 LEU N A 80 LEU CA A 80 LEU C 1.0 -132.0 -64.0 PHI 84 84 A 80 LEU N A 80 LEU CA A 80 LEU C A 81 ALA N 1.0 94.0 154.0 PSI 85 85 A 80 LEU C A 81 ALA N A 81 ALA CA A 81 ALA C 1.0 -140.0 -100.0 PHI 86 86 A 81 ALA N A 81 ALA CA A 81 ALA C A 82 ALA N 1.0 125.0 181.0 PSI 87 87 A 81 ALA C A 82 ALA N A 82 ALA CA A 82 ALA C 1.0 -153.0 -77.0 PHI 88 88 A 82 ALA N A 82 ALA CA A 82 ALA C A 83 GLU N 1.0 130.0 162.0 PSI 89 89 A 82 ALA C A 83 GLU N A 83 GLU CA A 83 GLU C 1.0 -164.0 -100.0 PHI 90 90 A 83 GLU N A 83 GLU CA A 83 GLU C A 84 PRO N 1.0 60.0 196.0 PSI stop_ save_