data_nef_c19848_4csq save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 4csq stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 SER middle . . 3 A 3 HIS middle . . 4 A 4 MET middle . . 5 A 5 THR middle . . 6 A 6 THR middle . . 7 A 7 GLN middle . . 8 A 8 ARG middle . . 9 A 9 TYR middle . . 10 A 10 LEU middle . . 11 A 11 LEU middle . . 12 A 12 ASP middle . . 13 A 13 GLU middle . . 14 A 14 LEU middle . . 15 A 15 GLU middle . . 16 A 16 THR middle . . 17 A 17 ALA middle . . 18 A 18 ASP middle . . 19 A 19 MET middle . . 20 A 20 LEU middle . . 21 A 21 GLU middle . . 22 A 22 ILE middle . . 23 A 23 ASP middle . . 24 A 24 GLY middle . false 25 A 25 LEU middle . . 26 A 26 HIS middle . . 27 A 27 ALA middle . . 28 A 28 TRP middle . . 29 A 29 ARG middle . . 30 A 30 PHE middle . . 31 A 31 GLU middle . . 32 A 32 LEU middle . . 33 A 33 ASN middle . . 34 A 34 GLU middle . . 35 A 35 ASN middle . . 36 A 36 LEU middle . . 37 A 37 LEU middle . . 38 A 38 ASP middle . . 39 A 39 GLN middle . . 40 A 40 ALA middle . . 41 A 41 ASP middle . . 42 A 42 LEU middle . . 43 A 43 ALA middle . . 44 A 44 ALA middle . . 45 A 45 GLU middle . . 46 A 46 ALA middle . . 47 A 47 ASP middle . . 48 A 48 GLN middle . . 49 A 49 PRO middle . false 50 A 50 PHE middle . . 51 A 51 ALA middle . . 52 A 52 SER middle . . 53 A 53 GLU middle . . 54 A 54 ASP middle . . 55 A 55 TRP middle . . 56 A 56 VAL middle . . 57 A 57 LEU middle . . 58 A 58 ALA middle . . 59 A 59 VAL middle . . 60 A 60 GLU middle . . 61 A 61 SER middle . . 62 A 62 LEU middle . . 63 A 63 ASP middle . . 64 A 64 GLY middle . false 65 A 65 ARG middle . . 66 A 66 THR middle . . 67 A 67 ARG middle . . 68 A 68 ARG middle . . 69 A 69 GLU middle . . 70 A 70 TRP middle . . 71 A 71 ARG middle . . 72 A 72 PHE middle . . 73 A 73 SER middle . . 74 A 74 TYR middle . . 75 A 75 ASN middle . . 76 A 76 ALA middle . . 77 A 77 VAL middle . . 78 A 78 MET middle . . 79 A 79 GLU middle . . 80 A 80 ALA middle . . 81 A 81 GLU middle . . 82 A 82 PRO middle . false 83 A 83 GLN middle . . 84 A 84 ALA middle . . 85 A 85 ASP middle . . 86 A 86 GLY middle . false 87 A 87 GLU middle . . 88 A 88 SER middle . . 89 A 89 TRP middle . . 90 A 90 ARG middle . . 91 A 91 LEU middle . . 92 A 92 THR middle . . 93 A 93 THR middle . . 94 A 94 GLY middle . false 95 A 95 GLU middle . . 96 A 96 GLY middle . false 97 A 97 ALA middle . . 98 A 98 TYR middle . . 99 A 99 GLN middle . . 100 A 100 LEU middle . . 101 A 101 ARG middle . . 102 A 102 CYS middle . . 103 A 103 LEU middle . . 104 A 104 GLY middle . false 105 A 105 ALA middle . . 106 A 106 VAL middle . . 107 A 107 SER middle . . 108 A 108 ALA middle . . 109 A 109 SER middle . . 110 A 110 GLY middle . false 111 A 111 GLU middle . . 112 A 112 ASP middle . . 113 A 113 GLU end . . stop_ save_ save_assigned_chem_shift_list _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 2 SER C C 13 174.305 . A 2 SER CA C 13 58.316 . A 2 SER CB C 13 63.945 . A 3 HIS H H 1 8.670 0.003 A 3 HIS HA H 1 4.673 0.007 A 3 HIS HBx H 1 3.079 0.006 A 3 HIS HBy H 1 3.206 0.007 A 3 HIS C C 13 174.438 . A 3 HIS CA C 13 55.429 0.021 A 3 HIS CB C 13 29.164 . A 3 HIS N N 15 120.574 0.003 A 4 MET H H 1 8.497 0.001 A 4 MET HA H 1 4.505 0.002 A 4 MET HBy H 1 2.069 0.002 A 4 MET HBx H 1 1.961 0.003 A 4 MET HE% H 1 2.018 . A 4 MET HGx H 1 2.457 0.006 A 4 MET HGy H 1 2.525 0.005 A 4 MET C C 13 176.426 0.023 A 4 MET CA C 13 55.669 0.037 A 4 MET CB C 13 33.003 . A 4 MET CE C 13 16.988 . A 4 MET N N 15 121.675 0.016 A 5 THR H H 1 8.249 0.007 A 5 THR HA H 1 4.420 0.003 A 5 THR HB H 1 4.273 0.004 A 5 THR HG2% H 1 1.174 0.004 A 5 THR C C 13 174.677 . A 5 THR CA C 13 61.859 0.024 A 5 THR CB C 13 69.698 0.023 A 5 THR CG2 C 13 21.493 0.157 A 5 THR N N 15 114.821 0.069 A 6 THR H H 1 8.032 0.002 A 6 THR HA H 1 4.285 0.012 A 6 THR HB H 1 4.241 . A 6 THR HG2% H 1 1.157 0.006 A 6 THR C C 13 174.190 . A 6 THR CA C 13 61.894 0.005 A 6 THR CB C 13 69.549 . A 6 THR CG2 C 13 21.734 0.032 A 6 THR N N 15 114.661 0.032 A 7 GLN H H 1 8.080 0.002 A 7 GLN HA H 1 4.258 0.01 A 7 GLN HB3 H 1 1.901 0.003 A 7 GLN HGy H 1 2.142 0.002 A 7 GLN HGx H 1 2.082 0.008 A 7 GLN C C 13 174.642 . A 7 GLN CA C 13 55.509 0.027 A 7 GLN CB C 13 29.930 0.003 A 7 GLN CG C 13 33.539 0.01 A 7 GLN N N 15 122.286 0.041 A 8 ARG H H 1 8.180 0.002 A 8 ARG HA H 1 4.449 0.004 A 8 ARG HBx H 1 1.559 0.006 A 8 ARG HBy H 1 1.906 0.006 A 8 ARG HDy H 1 3.138 0.001 A 8 ARG HDx H 1 2.872 . A 8 ARG HGx H 1 1.566 0.001 A 8 ARG HGy H 1 1.641 0.003 A 8 ARG C C 13 175.412 . A 8 ARG CA C 13 55.841 0.026 A 8 ARG CB C 13 32.341 0.004 A 8 ARG CD C 13 43.875 0.006 A 8 ARG CG C 13 26.924 0.04 A 8 ARG N N 15 122.318 0.032 A 9 TYR H H 1 8.753 0.005 A 9 TYR HA H 1 4.707 0.006 A 9 TYR HBx H 1 2.746 0.003 A 9 TYR HBy H 1 3.151 0.006 A 9 TYR HD1 H 1 7.157 0.003 A 9 TYR HD2 H 1 7.157 0.003 A 9 TYR HE1 H 1 6.745 0.006 A 9 TYR HE2 H 1 6.745 0.006 A 9 TYR CA C 13 57.336 . A 9 TYR CB C 13 40.043 0.004 A 9 TYR CD1 C 13 133.375 0.002 A 9 TYR CD2 C 13 133.375 0.002 A 9 TYR CE1 C 13 118.063 0.003 A 9 TYR CE2 C 13 118.063 0.003 A 9 TYR N N 15 122.043 0.023 A 10 LEU H H 1 8.048 0.002 A 10 LEU HA H 1 2.939 0.003 A 10 LEU HBx H 1 -1.001 0.005 A 10 LEU HBy H 1 0.799 0.004 A 10 LEU HDx% H 1 0.106 0.014 A 10 LEU HDy% H 1 -0.426 0.002 A 10 LEU HG H 1 0.593 0.006 A 10 LEU C C 13 177.931 0.027 A 10 LEU CA C 13 57.737 0.069 A 10 LEU CB C 13 38.327 0.009 A 10 LEU CDy C 13 26.380 0.11 A 10 LEU CDx C 13 20.580 0.019 A 10 LEU CG C 13 26.421 0.012 A 10 LEU N N 15 127.828 0.025 A 11 LEU H H 1 8.253 0.019 A 11 LEU HA H 1 3.592 0.002 A 11 LEU HBx H 1 1.200 0.005 A 11 LEU HBy H 1 1.388 0.007 A 11 LEU HDx% H 1 0.752 0.007 A 11 LEU HDy% H 1 0.742 0.007 A 11 LEU HG H 1 1.432 0.004 A 11 LEU C C 13 177.614 . A 11 LEU CA C 13 58.470 0.04 A 11 LEU CB C 13 41.373 0.042 A 11 LEU CDx C 13 24.699 0.157 A 11 LEU CDy C 13 25.027 0.031 A 11 LEU CG C 13 27.126 0.012 A 11 LEU N N 15 117.419 0.035 A 12 ASP H H 1 6.630 0.011 A 12 ASP HA H 1 4.232 0.003 A 12 ASP HBx H 1 2.724 0.003 A 12 ASP HBy H 1 2.879 0.009 A 12 ASP C C 13 178.861 . A 12 ASP CA C 13 57.184 0.013 A 12 ASP CB C 13 40.622 0.034 A 12 ASP N N 15 114.907 0.025 A 13 GLU H H 1 7.214 0.007 A 13 GLU HA H 1 3.969 0.001 A 13 GLU HBx H 1 1.981 0.002 A 13 GLU HBy H 1 2.108 0.004 A 13 GLU HGx H 1 2.258 0.006 A 13 GLU HGy H 1 2.587 0.001 A 13 GLU C C 13 179.488 . A 13 GLU CA C 13 58.862 0.013 A 13 GLU CB C 13 29.599 0.044 A 13 GLU CG C 13 36.899 0.023 A 13 GLU N N 15 118.984 0.026 A 14 LEU H H 1 8.441 0.005 A 14 LEU HA H 1 3.786 0.003 A 14 LEU HBx H 1 1.239 0.006 A 14 LEU HBy H 1 1.907 0.003 A 14 LEU HDx% H 1 0.495 0.007 A 14 LEU HDy% H 1 0.409 0.006 A 14 LEU HG H 1 1.440 0.009 A 14 LEU C C 13 178.805 . A 14 LEU CA C 13 57.521 0.007 A 14 LEU CB C 13 42.687 0.045 A 14 LEU CDy C 13 27.283 0.023 A 14 LEU CDx C 13 24.590 0.047 A 14 LEU CG C 13 26.457 . A 14 LEU N N 15 119.707 0.023 A 15 GLU H H 1 7.596 0.006 A 15 GLU HA H 1 3.990 0.004 A 15 GLU HB2 H 1 2.111 0.002 A 15 GLU HGx H 1 2.310 0.004 A 15 GLU HGy H 1 2.608 0.005 A 15 GLU C C 13 177.173 . A 15 GLU CA C 13 58.337 0.028 A 15 GLU CB C 13 28.969 0.02 A 15 GLU CG C 13 34.552 0.011 A 15 GLU N N 15 114.220 0.046 A 16 THR H H 1 7.178 0.009 A 16 THR HA H 1 4.519 0.005 A 16 THR HB H 1 4.453 0.006 A 16 THR HG2% H 1 1.156 0.004 A 16 THR C C 13 174.274 . A 16 THR CA C 13 60.696 0.008 A 16 THR CB C 13 69.809 . A 16 THR CG2 C 13 21.672 0.007 A 16 THR N N 15 105.295 0.039 A 17 ALA H H 1 7.247 0.006 A 17 ALA HA H 1 4.136 0.005 A 17 ALA HB% H 1 1.355 0.004 A 17 ALA C C 13 176.901 0.028 A 17 ALA CA C 13 53.041 0.062 A 17 ALA CB C 13 19.189 0.051 A 17 ALA N N 15 125.854 0.013 A 18 ASP H H 1 8.656 0.003 A 18 ASP HA H 1 4.854 0.007 A 18 ASP HBy H 1 2.659 0.005 A 18 ASP HBx H 1 2.658 0.005 A 18 ASP C C 13 176.256 0.002 A 18 ASP CA C 13 55.640 0.034 A 18 ASP CB C 13 43.205 0.048 A 18 ASP N N 15 119.900 0.042 A 19 MET H H 1 8.108 0.003 A 19 MET HA H 1 4.794 0.007 A 19 MET HBy H 1 2.023 0.007 A 19 MET HBx H 1 1.963 0.002 A 19 MET HE% H 1 2.004 0.001 A 19 MET HGx H 1 2.414 0.002 A 19 MET HGy H 1 2.540 0.003 A 19 MET CA C 13 54.423 0.016 A 19 MET CB C 13 37.266 0.026 A 19 MET CE C 13 17.100 . A 19 MET CG C 13 31.981 0.005 A 19 MET N N 15 116.235 0.019 A 20 LEU H H 1 8.516 0.005 A 20 LEU HA H 1 5.012 0.005 A 20 LEU HBx H 1 0.881 0.005 A 20 LEU HBy H 1 0.986 0.007 A 20 LEU HDx% H 1 0.266 0.006 A 20 LEU HDy% H 1 0.166 0.005 A 20 LEU HG H 1 0.744 0.003 A 20 LEU CA C 13 53.055 0.028 A 20 LEU CB C 13 46.162 . A 20 LEU CDx C 13 25.470 0.013 A 20 LEU CDy C 13 26.073 0.015 A 20 LEU CG C 13 26.997 0.01 A 20 LEU N N 15 120.411 0.035 A 21 GLU H H 1 8.537 0.008 A 21 GLU HA H 1 5.034 0.002 A 21 GLU HB2 H 1 1.687 0.002 A 21 GLU HGx H 1 1.746 . A 21 GLU HGy H 1 1.851 0.003 A 21 GLU C C 13 175.135 . A 21 GLU CA C 13 54.280 0.033 A 21 GLU CB C 13 33.907 . A 21 GLU CG C 13 36.674 0.003 A 21 GLU N N 15 121.645 0.025 A 22 ILE H H 1 8.646 0.009 A 22 ILE HA H 1 4.907 0.003 A 22 ILE HB H 1 0.845 0.006 A 22 ILE HD1% H 1 -0.104 0.003 A 22 ILE HG1x H 1 0.342 0.006 A 22 ILE HG1y H 1 0.736 0.004 A 22 ILE HG2% H 1 0.164 0.005 A 22 ILE C C 13 174.708 . A 22 ILE CA C 13 57.911 0.05 A 22 ILE CB C 13 39.813 0.053 A 22 ILE CD1 C 13 12.549 0.01 A 22 ILE CG1 C 13 27.633 0.021 A 22 ILE CG2 C 13 15.580 0.022 A 22 ILE N N 15 123.928 0.1 A 23 ASP H H 1 9.775 0.008 A 23 ASP HA H 1 4.336 0.005 A 23 ASP HBy H 1 3.004 0.004 A 23 ASP HBx H 1 2.760 0.004 A 23 ASP C C 13 176.219 . A 23 ASP CA C 13 55.815 0.03 A 23 ASP CB C 13 39.727 0.065 A 23 ASP N N 15 128.270 0.025 A 24 GLY H H 1 8.497 0.009 A 24 GLY HAx H 1 3.467 0.006 A 24 GLY HAy H 1 4.081 0.004 A 24 GLY CA C 13 45.332 0.034 A 24 GLY N N 15 102.182 0.041 A 25 LEU H H 1 8.256 0.004 A 25 LEU HA H 1 4.582 0.003 A 25 LEU HBy H 1 2.027 0.005 A 25 LEU HBx H 1 1.599 0.004 A 25 LEU HDx% H 1 1.091 0.002 A 25 LEU HDy% H 1 0.941 0.006 A 25 LEU HG H 1 1.707 0.002 A 25 LEU CA C 13 53.707 0.018 A 25 LEU CB C 13 42.616 0.004 A 25 LEU CDy C 13 25.500 0.012 A 25 LEU CDx C 13 23.765 0.013 A 25 LEU CG C 13 26.979 0.007 A 25 LEU N N 15 122.939 0.019 A 26 HIS H H 1 9.131 0.039 A 26 HIS HA H 1 4.570 . A 26 HIS HBy H 1 3.282 0.007 A 26 HIS HBx H 1 3.274 0.007 A 26 HIS CA C 13 56.262 0.076 A 26 HIS CB C 13 28.868 0.027 A 26 HIS N N 15 122.086 0.149 A 27 ALA H H 1 8.712 0.01 A 27 ALA HA H 1 4.570 0.003 A 27 ALA HB% H 1 1.308 0.004 A 27 ALA C C 13 174.362 . A 27 ALA CA C 13 52.228 0.002 A 27 ALA CB C 13 19.662 0.02 A 27 ALA N N 15 130.070 0.023 A 28 TRP H H 1 9.127 0.019 A 28 TRP HA H 1 4.799 0.006 A 28 TRP HBx H 1 3.244 0.004 A 28 TRP HBy H 1 3.559 0.002 A 28 TRP HD1 H 1 7.350 0.002 A 28 TRP HE1 H 1 10.373 0.002 A 28 TRP HE3 H 1 7.540 0.009 A 28 TRP HH2 H 1 7.121 0.001 A 28 TRP HZ2 H 1 7.395 0.002 A 28 TRP HZ3 H 1 7.052 0.001 A 28 TRP CA C 13 58.450 0.025 A 28 TRP CB C 13 29.941 . A 28 TRP CD1 C 13 126.316 0.013 A 28 TRP CE3 C 13 120.925 0.015 A 28 TRP CH2 C 13 124.578 0.035 A 28 TRP CZ2 C 13 114.453 0.006 A 28 TRP CZ3 C 13 121.937 0.034 A 28 TRP N N 15 124.794 0.145 A 28 TRP NE1 N 15 129.951 0.024 A 29 ARG H H 1 7.786 0.012 A 29 ARG HA H 1 4.540 0.004 A 29 ARG HBy H 1 1.374 0.01 A 29 ARG HBx H 1 1.296 0.001 A 29 ARG HD2 H 1 2.720 0.005 A 29 ARG HGx H 1 1.024 0.016 A 29 ARG HGy H 1 1.135 0.02 A 29 ARG CA C 13 55.013 0.025 A 29 ARG CB C 13 33.467 . A 29 ARG CD C 13 43.154 . A 29 ARG CG C 13 26.481 . A 29 ARG N N 15 115.650 0.081 A 30 PHE H H 1 8.199 0.007 A 30 PHE HA H 1 5.568 0.004 A 30 PHE HBy H 1 3.092 0.005 A 30 PHE HBx H 1 2.974 0.007 A 30 PHE HD1 H 1 6.821 0.004 A 30 PHE HD2 H 1 6.821 0.004 A 30 PHE HE1 H 1 7.077 0.004 A 30 PHE HE2 H 1 7.077 0.004 A 30 PHE HZ H 1 7.231 0.01 A 30 PHE C C 13 172.715 . A 30 PHE CA C 13 56.033 0.009 A 30 PHE CB C 13 42.685 0.04 A 30 PHE CD1 C 13 132.005 0.016 A 30 PHE CD2 C 13 132.005 0.016 A 30 PHE CE1 C 13 130.855 0.072 A 30 PHE CE2 C 13 130.855 0.072 A 30 PHE CZ C 13 130.711 0.012 A 30 PHE N N 15 117.799 0.026 A 31 GLU H H 1 9.274 0.005 A 31 GLU HA H 1 4.669 0.007 A 31 GLU HBx H 1 1.987 0.005 A 31 GLU HBy H 1 2.047 0.007 A 31 GLU HGy H 1 2.247 0.008 A 31 GLU HGx H 1 2.239 0.007 A 31 GLU C C 13 174.177 . A 31 GLU CA C 13 54.880 0.033 A 31 GLU CB C 13 34.196 0.066 A 31 GLU CG C 13 35.848 . A 31 GLU N N 15 119.040 0.031 A 32 LEU H H 1 8.755 0.004 A 32 LEU HA H 1 5.754 0.002 A 32 LEU HBx H 1 1.214 0.003 A 32 LEU HBy H 1 1.751 0.003 A 32 LEU HDx% H 1 0.971 0.004 A 32 LEU HDy% H 1 0.867 0.003 A 32 LEU HG H 1 1.749 0.003 A 32 LEU C C 13 177.413 . A 32 LEU CA C 13 52.405 0.027 A 32 LEU CB C 13 44.293 0.028 A 32 LEU CDx C 13 25.005 0.017 A 32 LEU CDy C 13 25.805 0.032 A 32 LEU CG C 13 28.089 0.008 A 32 LEU N N 15 122.224 0.026 A 33 ASN H H 1 7.798 0.006 A 33 ASN HA H 1 4.052 0.005 A 33 ASN HBx H 1 -0.142 0.007 A 33 ASN HBy H 1 2.447 0.009 A 33 ASN HD21 H 1 6.650 0.002 A 33 ASN HD22 H 1 6.757 0.008 A 33 ASN C C 13 174.905 . A 33 ASN CA C 13 50.972 0.06 A 33 ASN CB C 13 36.513 0.049 A 33 ASN N N 15 118.878 0.026 A 33 ASN ND2 N 15 112.339 0.063 A 34 GLU H H 1 7.893 0.008 A 34 GLU HA H 1 3.782 0.004 A 34 GLU HBy H 1 2.091 0.007 A 34 GLU HBx H 1 1.906 0.006 A 34 GLU HGx H 1 2.234 0.012 A 34 GLU HGy H 1 2.392 0.012 A 34 GLU C C 13 177.677 . A 34 GLU CA C 13 59.363 0.077 A 34 GLU CB C 13 29.002 . A 34 GLU CG C 13 35.510 0.01 A 34 GLU N N 15 125.410 0.038 A 35 ASN H H 1 8.009 0.004 A 35 ASN HA H 1 4.332 0.004 A 35 ASN HBx H 1 2.654 0.006 A 35 ASN HBy H 1 2.754 0.001 A 35 ASN HD21 H 1 6.943 0.002 A 35 ASN HD22 H 1 7.746 0.003 A 35 ASN C C 13 177.433 0.038 A 35 ASN CA C 13 56.386 0.035 A 35 ASN CB C 13 38.540 0.006 A 35 ASN N N 15 116.447 0.026 A 35 ASN ND2 N 15 113.443 0.026 A 36 LEU H H 1 6.768 0.006 A 36 LEU HA H 1 3.929 0.003 A 36 LEU HBx H 1 1.261 0.002 A 36 LEU HBy H 1 1.437 0.004 A 36 LEU HDx% H 1 0.853 0.004 A 36 LEU HDy% H 1 0.658 0.002 A 36 LEU HG H 1 1.433 0.003 A 36 LEU C C 13 178.770 0.034 A 36 LEU CA C 13 57.061 0.035 A 36 LEU CB C 13 42.654 0.021 A 36 LEU CDx C 13 24.998 0.007 A 36 LEU CDy C 13 27.347 0.008 A 36 LEU CG C 13 27.401 . A 36 LEU N N 15 122.239 0.024 A 37 LEU H H 1 7.708 0.006 A 37 LEU HA H 1 3.740 0.006 A 37 LEU HBx H 1 1.351 0.006 A 37 LEU HBy H 1 1.733 0.005 A 37 LEU HDx% H 1 0.801 0.004 A 37 LEU HDy% H 1 0.743 0.005 A 37 LEU HG H 1 1.581 0.003 A 37 LEU C C 13 179.335 . A 37 LEU CA C 13 57.695 0.046 A 37 LEU CB C 13 40.112 0.034 A 37 LEU CDx C 13 23.344 0.048 A 37 LEU CDy C 13 25.838 0.057 A 37 LEU CG C 13 26.728 0.05 A 37 LEU N N 15 118.468 0.019 A 38 ASP H H 1 8.032 0.009 A 38 ASP HA H 1 4.285 0.011 A 38 ASP HBx H 1 2.559 0.006 A 38 ASP HBy H 1 2.796 0.006 A 38 ASP C C 13 179.021 0.018 A 38 ASP CA C 13 57.264 0.082 A 38 ASP CB C 13 39.899 0.024 A 38 ASP N N 15 119.550 0.021 A 39 GLN H H 1 7.280 0.005 A 39 GLN HA H 1 3.745 0.004 A 39 GLN HBx H 1 1.941 0.003 A 39 GLN HBy H 1 2.115 0.008 A 39 GLN HE21 H 1 6.777 0.001 A 39 GLN HE22 H 1 7.219 0.001 A 39 GLN HGx H 1 2.294 0.004 A 39 GLN HGy H 1 2.464 0.003 A 39 GLN C C 13 178.631 0.039 A 39 GLN CA C 13 58.710 0.039 A 39 GLN CB C 13 28.282 0.063 A 39 GLN CG C 13 33.988 0.02 A 39 GLN N N 15 119.422 0.03 A 39 GLN NE2 N 15 112.088 0.027 A 40 ALA H H 1 7.811 0.01 A 40 ALA HA H 1 2.526 0.01 A 40 ALA HB% H 1 0.849 0.005 A 40 ALA C C 13 180.378 0.042 A 40 ALA CA C 13 54.512 0.077 A 40 ALA CB C 13 17.488 0.038 A 40 ALA N N 15 124.686 0.03 A 41 ASP H H 1 8.023 0.015 A 41 ASP HA H 1 4.299 0.003 A 41 ASP HBx H 1 2.589 0.008 A 41 ASP HBy H 1 2.731 0.006 A 41 ASP C C 13 178.661 . A 41 ASP CA C 13 57.056 0.045 A 41 ASP CB C 13 40.042 0.027 A 41 ASP N N 15 120.308 0.045 A 42 LEU H H 1 7.608 0.005 A 42 LEU HA H 1 3.949 0.002 A 42 LEU HBx H 1 1.431 0.008 A 42 LEU HBy H 1 1.687 0.008 A 42 LEU HDx% H 1 0.783 0.004 A 42 LEU HDy% H 1 0.780 0.005 A 42 LEU HG H 1 1.652 0.004 A 42 LEU C C 13 179.950 . A 42 LEU CA C 13 57.686 0.019 A 42 LEU CB C 13 41.789 0.032 A 42 LEU CDy C 13 25.170 0.031 A 42 LEU CDx C 13 23.374 0.052 A 42 LEU CG C 13 26.825 0.019 A 42 LEU N N 15 121.265 0.021 A 43 ALA H H 1 7.472 0.008 A 43 ALA HA H 1 4.107 0.003 A 43 ALA HB% H 1 1.448 0.003 A 43 ALA C C 13 179.356 0.039 A 43 ALA CA C 13 54.836 0.045 A 43 ALA CB C 13 18.097 0.033 A 43 ALA N N 15 122.351 0.017 A 44 ALA H H 1 7.841 0.008 A 44 ALA HA H 1 4.136 0.016 A 44 ALA HB% H 1 1.478 0.007 A 44 ALA C C 13 181.814 0.065 A 44 ALA CA C 13 55.045 0.061 A 44 ALA CB C 13 17.992 0.043 A 44 ALA N N 15 120.895 0.016 A 45 GLU H H 1 8.055 0.009 A 45 GLU HA H 1 4.016 0.006 A 45 GLU HBy H 1 2.053 0.012 A 45 GLU HBx H 1 2.049 0.009 A 45 GLU HGx H 1 2.269 0.01 A 45 GLU HGy H 1 2.356 0.002 A 45 GLU C C 13 176.918 . A 45 GLU CA C 13 58.414 0.016 A 45 GLU CB C 13 29.278 0.059 A 45 GLU CG C 13 36.051 0.003 A 45 GLU N N 15 119.036 0.038 A 46 ALA H H 1 7.389 0.008 A 46 ALA HA H 1 4.396 0.007 A 46 ALA HB% H 1 1.421 0.007 A 46 ALA C C 13 176.348 0.011 A 46 ALA CA C 13 51.517 0.056 A 46 ALA CB C 13 19.018 0.018 A 46 ALA N N 15 120.960 0.01 A 47 ASP H H 1 8.058 0.005 A 47 ASP HA H 1 4.271 0.006 A 47 ASP HBx H 1 2.559 0.006 A 47 ASP HBy H 1 3.014 0.008 A 47 ASP C C 13 174.822 . A 47 ASP CA C 13 55.339 0.042 A 47 ASP CB C 13 39.585 0.086 A 47 ASP N N 15 118.025 0.018 A 48 GLN H H 1 8.117 0.01 A 48 GLN HA H 1 4.738 . A 48 GLN HBx H 1 1.808 0.002 A 48 GLN HBy H 1 2.041 0.002 A 48 GLN HE21 H 1 6.810 0.002 A 48 GLN HE22 H 1 7.365 0.002 A 48 GLN HG3 H 1 2.321 0.002 A 48 GLN CA C 13 52.289 0.03 A 48 GLN CB C 13 29.999 0.008 A 48 GLN CG C 13 33.197 0.005 A 48 GLN N N 15 117.551 0.017 A 48 GLN NE2 N 15 112.557 0.018 A 49 PRO HA H 1 4.411 0.002 A 49 PRO HBx H 1 1.834 0.006 A 49 PRO HBy H 1 2.229 0.002 A 49 PRO HDx H 1 3.607 0.001 A 49 PRO HDy H 1 3.740 0.001 A 49 PRO HGy H 1 1.981 . A 49 PRO HGx H 1 1.957 0.018 A 49 PRO C C 13 175.677 . A 49 PRO CA C 13 62.621 0.014 A 49 PRO CB C 13 32.378 0.058 A 49 PRO CD C 13 50.485 0.001 A 49 PRO CG C 13 27.290 0.007 A 50 PHE H H 1 8.489 0.003 A 50 PHE HA H 1 4.445 0.004 A 50 PHE HBx H 1 2.752 0.005 A 50 PHE HBy H 1 2.804 0.003 A 50 PHE HD1 H 1 6.684 0.006 A 50 PHE HD2 H 1 6.684 0.006 A 50 PHE HE1 H 1 6.415 0.004 A 50 PHE HE2 H 1 6.415 0.004 A 50 PHE HZ H 1 6.806 0.003 A 50 PHE C C 13 172.546 . A 50 PHE CA C 13 58.810 0.031 A 50 PHE CB C 13 42.255 0.011 A 50 PHE CD1 C 13 131.726 0.028 A 50 PHE CD2 C 13 131.726 0.028 A 50 PHE CE1 C 13 130.662 0.042 A 50 PHE CE2 C 13 130.662 0.042 A 50 PHE CZ C 13 129.314 0.012 A 50 PHE N N 15 122.069 0.01 A 51 ALA H H 1 7.127 0.008 A 51 ALA HA H 1 4.305 0.003 A 51 ALA HB% H 1 1.276 0.005 A 51 ALA C C 13 174.959 . A 51 ALA CA C 13 51.228 0.034 A 51 ALA CB C 13 22.106 0.041 A 51 ALA N N 15 129.924 0.064 A 52 SER H H 1 8.122 0.002 A 52 SER HA H 1 4.180 0.011 A 52 SER HBx H 1 3.002 0.004 A 52 SER HBy H 1 3.534 0.005 A 52 SER C C 13 173.469 . A 52 SER CA C 13 59.409 0.033 A 52 SER CB C 13 64.291 0.069 A 52 SER N N 15 111.157 0.019 A 53 GLU H H 1 8.688 0.003 A 53 GLU HA H 1 4.533 0.005 A 53 GLU HBy H 1 2.401 0.008 A 53 GLU HBx H 1 1.748 0.003 A 53 GLU HGx H 1 2.194 0.004 A 53 GLU HGy H 1 2.371 0.005 A 53 GLU C C 13 176.203 . A 53 GLU CA C 13 55.805 0.038 A 53 GLU CB C 13 29.811 0.041 A 53 GLU CG C 13 36.442 0.015 A 53 GLU N N 15 126.215 0.011 A 54 ASP H H 1 8.781 0.002 A 54 ASP HA H 1 4.626 0.003 A 54 ASP HBx H 1 2.480 0.008 A 54 ASP HBy H 1 2.547 0.006 A 54 ASP C C 13 175.091 . A 54 ASP CA C 13 53.759 0.009 A 54 ASP CB C 13 40.930 . A 54 ASP N N 15 123.083 0.019 A 55 TRP H H 1 8.370 0.003 A 55 TRP HA H 1 4.300 0.004 A 55 TRP HBy H 1 3.208 0.002 A 55 TRP HBx H 1 3.076 0.008 A 55 TRP HD1 H 1 7.429 0.003 A 55 TRP HE1 H 1 10.216 0.003 A 55 TRP HE3 H 1 7.155 0.002 A 55 TRP HH2 H 1 6.848 0.005 A 55 TRP HZ2 H 1 7.340 0.003 A 55 TRP HZ3 H 1 7.073 0.003 A 55 TRP C C 13 172.383 0.01 A 55 TRP CA C 13 57.476 0.084 A 55 TRP CB C 13 28.337 0.04 A 55 TRP CD1 C 13 126.867 0.02 A 55 TRP CE3 C 13 119.910 0.003 A 55 TRP CH2 C 13 123.286 0.084 A 55 TRP CZ2 C 13 114.733 0.027 A 55 TRP CZ3 C 13 119.042 0.04 A 55 TRP N N 15 120.539 0.036 A 55 TRP NE1 N 15 131.174 0.018 A 56 VAL H H 1 9.379 0.006 A 56 VAL HA H 1 4.375 0.001 A 56 VAL HB H 1 1.746 0.004 A 56 VAL HGx% H 1 1.165 0.006 A 56 VAL HGy% H 1 0.823 0.003 A 56 VAL C C 13 171.991 0.023 A 56 VAL CA C 13 59.957 0.036 A 56 VAL CB C 13 36.499 0.007 A 56 VAL CGy C 13 24.682 0.026 A 56 VAL CGx C 13 21.170 0.022 A 56 VAL N N 15 115.758 0.027 A 57 LEU H H 1 7.820 0.005 A 57 LEU HA H 1 5.659 0.007 A 57 LEU HBx H 1 1.239 0.005 A 57 LEU HBy H 1 1.760 0.005 A 57 LEU HDx% H 1 0.980 0.006 A 57 LEU HDy% H 1 0.468 0.004 A 57 LEU HG H 1 1.474 0.006 A 57 LEU C C 13 173.209 . A 57 LEU CA C 13 53.670 0.019 A 57 LEU CB C 13 47.188 0.044 A 57 LEU CDx C 13 23.986 0.035 A 57 LEU CDy C 13 25.929 0.033 A 57 LEU CG C 13 28.118 0.012 A 57 LEU N N 15 123.492 0.017 A 58 ALA H H 1 9.479 0.008 A 58 ALA HA H 1 5.449 0.003 A 58 ALA HB% H 1 1.002 0.003 A 58 ALA C C 13 175.983 . A 58 ALA CA C 13 50.755 0.03 A 58 ALA CB C 13 21.410 0.059 A 58 ALA N N 15 130.783 0.016 A 59 VAL H H 1 9.129 0.005 A 59 VAL HA H 1 4.761 0.006 A 59 VAL HB H 1 2.146 0.006 A 59 VAL HGx% H 1 0.872 0.004 A 59 VAL HGy% H 1 0.969 0.005 A 59 VAL C C 13 173.902 . A 59 VAL CA C 13 61.304 0.036 A 59 VAL CB C 13 35.823 0.048 A 59 VAL CGx C 13 21.813 0.02 A 59 VAL CGy C 13 23.047 0.042 A 59 VAL N N 15 121.429 0.035 A 60 GLU H H 1 8.801 0.007 A 60 GLU HA H 1 5.724 0.006 A 60 GLU HBx H 1 1.947 0.008 A 60 GLU HBy H 1 2.127 0.013 A 60 GLU HG2 H 1 2.177 0.005 A 60 GLU HG3 H 1 2.177 0.005 A 60 GLU C C 13 175.511 0.012 A 60 GLU CA C 13 54.854 0.055 A 60 GLU CB C 13 34.505 0.083 A 60 GLU CG C 13 37.010 . A 60 GLU N N 15 125.229 0.015 A 61 SER H H 1 9.270 0.008 A 61 SER HA H 1 4.986 0.007 A 61 SER HBy H 1 4.019 0.004 A 61 SER HBx H 1 3.852 0.008 A 61 SER CA C 13 57.707 0.008 A 61 SER CB C 13 66.320 0.003 A 61 SER N N 15 118.138 0.047 A 62 LEU H H 1 8.439 0.019 A 62 LEU HA H 1 4.711 0.003 A 62 LEU HBx H 1 1.068 0.007 A 62 LEU HBy H 1 1.390 0.003 A 62 LEU HDx% H 1 0.276 0.005 A 62 LEU HDy% H 1 0.438 0.002 A 62 LEU HG H 1 1.171 0.002 A 62 LEU CA C 13 54.481 0.005 A 62 LEU CB C 13 43.030 0.003 A 62 LEU CDy C 13 24.081 0.023 A 62 LEU CDx C 13 23.691 0.014 A 62 LEU CG C 13 27.349 0.019 A 62 LEU N N 15 126.190 0.044 A 63 ASP H H 1 8.370 0.002 A 63 ASP HA H 1 4.687 0.014 A 63 ASP HBx H 1 2.590 0.002 A 63 ASP HBy H 1 2.728 0.003 A 63 ASP C C 13 176.724 . A 63 ASP CA C 13 53.475 0.18 A 63 ASP CB C 13 41.581 . A 63 ASP N N 15 124.072 0.024 A 64 GLY H H 1 8.637 0.008 A 64 GLY HAx H 1 3.649 0.007 A 64 GLY HAy H 1 4.017 0.005 A 64 GLY C C 13 174.549 . A 64 GLY CA C 13 46.596 0.032 A 64 GLY N N 15 112.770 0.029 A 65 ARG H H 1 8.668 0.003 A 65 ARG HA H 1 4.189 0.004 A 65 ARG HBy H 1 1.940 0.001 A 65 ARG HBx H 1 1.765 0.001 A 65 ARG HD2 H 1 3.134 0.004 A 65 ARG HG3 H 1 1.579 0.001 A 65 ARG C C 13 176.099 . A 65 ARG CA C 13 56.605 0.024 A 65 ARG CB C 13 30.032 . A 65 ARG CD C 13 43.202 0.001 A 65 ARG CG C 13 27.332 0.015 A 65 ARG N N 15 122.178 0.043 A 66 THR H H 1 7.869 0.005 A 66 THR HA H 1 4.284 0.005 A 66 THR HB H 1 4.099 0.003 A 66 THR HG2% H 1 1.068 0.003 A 66 THR CA C 13 61.649 0.006 A 66 THR CB C 13 70.320 0.027 A 66 THR CG2 C 13 21.269 0.011 A 66 THR N N 15 115.677 0.014 A 67 ARG H H 1 8.497 0.005 A 67 ARG HA H 1 4.672 0.005 A 67 ARG HBy H 1 1.664 0.005 A 67 ARG HBx H 1 1.564 0.003 A 67 ARG HDy H 1 3.019 0.006 A 67 ARG HDx H 1 3.007 0.009 A 67 ARG HGx H 1 1.276 0.002 A 67 ARG HGy H 1 1.439 0.002 A 67 ARG CA C 13 55.864 0.03 A 67 ARG CB C 13 31.417 0.006 A 67 ARG CD C 13 43.297 0.005 A 67 ARG CG C 13 27.642 0.005 A 67 ARG N N 15 126.915 0.019 A 68 ARG H H 1 8.602 0.003 A 68 ARG HA H 1 4.260 0.004 A 68 ARG HBx H 1 0.950 0.006 A 68 ARG HBy H 1 1.276 0.004 A 68 ARG HDy H 1 2.818 0.003 A 68 ARG HDx H 1 2.814 0.004 A 68 ARG HGx H 1 0.954 0.001 A 68 ARG HGy H 1 1.128 0.01 A 68 ARG C C 13 173.508 . A 68 ARG CA C 13 54.685 0.015 A 68 ARG CB C 13 33.236 0.003 A 68 ARG CD C 13 43.168 0.001 A 68 ARG CG C 13 26.985 0.011 A 68 ARG N N 15 126.006 0.027 A 69 GLU H H 1 7.847 0.003 A 69 GLU HA H 1 5.245 0.007 A 69 GLU HBx H 1 1.697 0.007 A 69 GLU HBy H 1 1.731 0.003 A 69 GLU HGy H 1 1.959 0.004 A 69 GLU HGx H 1 1.876 0.006 A 69 GLU C C 13 174.857 . A 69 GLU CA C 13 54.168 0.037 A 69 GLU CB C 13 33.486 0.005 A 69 GLU CG C 13 36.567 0.015 A 69 GLU N N 15 120.790 0.02 A 70 TRP H H 1 9.107 0.004 A 70 TRP HA H 1 4.446 0.007 A 70 TRP HBx H 1 2.224 0.009 A 70 TRP HBy H 1 2.514 0.006 A 70 TRP HD1 H 1 6.392 0.009 A 70 TRP HE1 H 1 9.583 0.003 A 70 TRP HE3 H 1 7.298 0.005 A 70 TRP HH2 H 1 6.914 0.003 A 70 TRP HZ2 H 1 7.342 0.002 A 70 TRP HZ3 H 1 6.623 0.005 A 70 TRP C C 13 174.933 0.047 A 70 TRP CA C 13 57.575 0.039 A 70 TRP CB C 13 34.305 0.044 A 70 TRP CD1 C 13 126.297 0.01 A 70 TRP CE3 C 13 121.061 0.044 A 70 TRP CH2 C 13 123.678 0.006 A 70 TRP CZ2 C 13 114.136 0.029 A 70 TRP CZ3 C 13 121.074 0.031 A 70 TRP N N 15 124.044 0.024 A 70 TRP NE1 N 15 128.129 0.019 A 71 ARG H H 1 8.099 0.006 A 71 ARG HA H 1 5.154 0.004 A 71 ARG HBy H 1 1.580 0.002 A 71 ARG HBx H 1 1.513 0.002 A 71 ARG HDy H 1 2.689 0.001 A 71 ARG HDx H 1 2.558 . A 71 ARG HGx H 1 1.246 0.007 A 71 ARG HGy H 1 1.385 0.004 A 71 ARG C C 13 174.665 . A 71 ARG CA C 13 55.082 0.018 A 71 ARG CB C 13 33.346 0.035 A 71 ARG CD C 13 43.164 0.006 A 71 ARG CG C 13 28.359 0.021 A 71 ARG N N 15 121.223 0.05 A 72 PHE H H 1 9.136 0.007 A 72 PHE HA H 1 5.085 0.005 A 72 PHE HBx H 1 2.597 0.005 A 72 PHE HBy H 1 2.914 0.004 A 72 PHE HD1 H 1 6.857 0.004 A 72 PHE HD2 H 1 6.857 0.004 A 72 PHE HE1 H 1 6.620 0.005 A 72 PHE HE2 H 1 6.620 0.005 A 72 PHE HZ H 1 6.157 0.004 A 72 PHE C C 13 175.880 . A 72 PHE CA C 13 55.778 0.022 A 72 PHE CB C 13 42.828 0.031 A 72 PHE CD1 C 13 131.897 0.005 A 72 PHE CD2 C 13 131.897 0.005 A 72 PHE CE1 C 13 130.536 0.012 A 72 PHE CE2 C 13 130.536 0.012 A 72 PHE CZ C 13 128.489 . A 72 PHE N N 15 120.568 0.019 A 73 SER H H 1 9.661 0.005 A 73 SER HA H 1 4.846 0.004 A 73 SER HB3 H 1 4.130 0.004 A 73 SER CA C 13 57.179 0.036 A 73 SER CB C 13 66.281 0.048 A 73 SER N N 15 122.100 0.02 A 74 TYR H H 1 8.225 0.004 A 74 TYR HA H 1 3.778 0.004 A 74 TYR HBx H 1 2.744 0.002 A 74 TYR HBy H 1 3.452 0.003 A 74 TYR HD1 H 1 6.904 0.002 A 74 TYR HD2 H 1 6.904 0.002 A 74 TYR HE1 H 1 6.723 0.003 A 74 TYR HE2 H 1 6.723 0.003 A 74 TYR C C 13 176.920 . A 74 TYR CA C 13 62.967 0.013 A 74 TYR CB C 13 38.559 0.028 A 74 TYR CD1 C 13 132.298 0.007 A 74 TYR CD2 C 13 132.298 0.007 A 74 TYR CE1 C 13 118.555 0.005 A 74 TYR CE2 C 13 118.555 0.005 A 74 TYR N N 15 120.166 0.019 A 75 ASN H H 1 7.882 0.005 A 75 ASN HA H 1 4.302 0.003 A 75 ASN HBx H 1 2.648 0.004 A 75 ASN HBy H 1 2.838 0.004 A 75 ASN HD21 H 1 6.731 0.004 A 75 ASN HD22 H 1 7.782 0.001 A 75 ASN C C 13 176.603 . A 75 ASN CA C 13 55.918 0.019 A 75 ASN CB C 13 37.252 0.003 A 75 ASN N N 15 116.015 0.048 A 75 ASN ND2 N 15 111.622 0.022 A 76 ALA H H 1 8.341 0.004 A 76 ALA HA H 1 4.101 0.005 A 76 ALA HB% H 1 1.592 0.003 A 76 ALA C C 13 180.978 0.023 A 76 ALA CA C 13 55.288 0.041 A 76 ALA CB C 13 18.353 0.023 A 76 ALA N N 15 122.427 0.025 A 77 VAL H H 1 7.743 0.005 A 77 VAL HA H 1 3.315 0.002 A 77 VAL HB H 1 1.885 0.004 A 77 VAL HGx% H 1 0.600 0.003 A 77 VAL HGy% H 1 0.417 0.001 A 77 VAL C C 13 178.112 0.028 A 77 VAL CA C 13 66.204 0.057 A 77 VAL CB C 13 31.510 0.037 A 77 VAL CGy C 13 23.952 0.042 A 77 VAL CGx C 13 20.841 0.026 A 77 VAL N N 15 117.507 0.017 A 78 MET H H 1 8.136 0.004 A 78 MET HA H 1 4.303 0.003 A 78 MET HBy H 1 2.078 0.009 A 78 MET HBx H 1 1.944 0.009 A 78 MET HE% H 1 1.832 0.008 A 78 MET HGx H 1 1.871 0.006 A 78 MET HGy H 1 2.380 0.004 A 78 MET C C 13 178.890 . A 78 MET CA C 13 56.321 0.056 A 78 MET CB C 13 30.297 0.007 A 78 MET CE C 13 16.610 0.044 A 78 MET CG C 13 32.436 0.01 A 78 MET N N 15 118.321 0.029 A 79 GLU H H 1 7.792 0.004 A 79 GLU HA H 1 4.382 0.006 A 79 GLU HBy H 1 2.242 0.007 A 79 GLU HBx H 1 1.913 0.002 A 79 GLU HGx H 1 2.313 0.009 A 79 GLU HGy H 1 2.460 0.004 A 79 GLU C C 13 175.807 . A 79 GLU CA C 13 55.492 0.037 A 79 GLU CB C 13 29.814 0.046 A 79 GLU CG C 13 36.263 0.011 A 79 GLU N N 15 117.037 0.022 A 80 ALA H H 1 7.088 0.005 A 80 ALA HA H 1 4.513 0.007 A 80 ALA HB% H 1 1.409 0.004 A 80 ALA C C 13 176.774 . A 80 ALA CA C 13 53.305 0.025 A 80 ALA CB C 13 21.634 0.03 A 80 ALA N N 15 124.620 0.02 A 81 GLU H H 1 8.679 0.002 A 81 GLU HA H 1 5.078 0.006 A 81 GLU HBy H 1 2.022 0.002 A 81 GLU HBx H 1 2.021 0.004 A 81 GLU HGx H 1 2.156 0.001 A 81 GLU HGy H 1 2.430 0.006 A 81 GLU CA C 13 52.939 0.035 A 81 GLU CB C 13 32.681 0.042 A 81 GLU CG C 13 36.007 0.015 A 81 GLU N N 15 121.248 0.024 A 82 PRO HA H 1 3.618 0.007 A 82 PRO HBx H 1 0.652 0.003 A 82 PRO HBy H 1 1.401 0.007 A 82 PRO HDx H 1 3.867 0.002 A 82 PRO HDy H 1 4.089 0.004 A 82 PRO HGy H 1 1.905 0.005 A 82 PRO HGx H 1 1.715 0.006 A 82 PRO C C 13 177.142 . A 82 PRO CA C 13 62.890 0.038 A 82 PRO CB C 13 30.609 0.023 A 82 PRO CD C 13 51.236 0.019 A 82 PRO CG C 13 26.359 0.007 A 83 GLN H H 1 7.933 0.005 A 83 GLN HA H 1 4.292 0.005 A 83 GLN HBx H 1 1.865 0.005 A 83 GLN HBy H 1 2.137 0.004 A 83 GLN HE21 H 1 7.500 0.004 A 83 GLN HE22 H 1 6.883 0.002 A 83 GLN HGx H 1 1.870 0.005 A 83 GLN HGy H 1 2.133 0.006 A 83 GLN C C 13 177.368 . A 83 GLN CA C 13 53.998 0.062 A 83 GLN CB C 13 30.170 0.035 A 83 GLN CG C 13 34.842 0.025 A 83 GLN N N 15 120.019 0.009 A 83 GLN NE2 N 15 116.900 0.028 A 84 ALA H H 1 8.578 0.002 A 84 ALA HA H 1 3.945 0.009 A 84 ALA HB% H 1 1.318 0.003 A 84 ALA C C 13 177.397 . A 84 ALA CA C 13 54.258 0.01 A 84 ALA CB C 13 18.246 0.014 A 84 ALA N N 15 123.577 0.018 A 85 ASP H H 1 7.537 0.004 A 85 ASP HA H 1 4.233 0.006 A 85 ASP HBx H 1 2.602 0.004 A 85 ASP HBy H 1 2.895 0.003 A 85 ASP C C 13 177.170 . A 85 ASP CA C 13 54.399 0.02 A 85 ASP CB C 13 39.778 0.036 A 85 ASP N N 15 115.428 0.013 A 86 GLY H H 1 7.736 0.004 A 86 GLY HAy H 1 4.051 0.006 A 86 GLY HAx H 1 3.615 0.002 A 86 GLY C C 13 173.572 . A 86 GLY CA C 13 46.098 0.027 A 86 GLY N N 15 108.060 0.017 A 87 GLU H H 1 8.146 0.004 A 87 GLU HA H 1 4.566 0.006 A 87 GLU HBy H 1 2.007 0.01 A 87 GLU HBx H 1 1.673 0.002 A 87 GLU HGy H 1 2.035 0.007 A 87 GLU HGx H 1 2.034 0.007 A 87 GLU CA C 13 56.439 0.048 A 87 GLU CB C 13 33.430 . A 87 GLU CG C 13 35.770 0.024 A 87 GLU N N 15 117.343 0.036 A 88 SER H H 1 9.196 0.013 A 88 SER HA H 1 5.275 0.01 A 88 SER HBx H 1 3.629 0.005 A 88 SER HBy H 1 3.751 0.003 A 88 SER C C 13 173.480 0.007 A 88 SER CA C 13 58.319 0.042 A 88 SER CB C 13 64.644 0.009 A 88 SER N N 15 117.041 0.04 A 89 TRP H H 1 9.327 0.005 A 89 TRP HA H 1 5.039 0.007 A 89 TRP HBx H 1 2.698 0.009 A 89 TRP HBy H 1 2.822 0.003 A 89 TRP HD1 H 1 7.035 0.009 A 89 TRP HE1 H 1 10.194 0.002 A 89 TRP HE3 H 1 6.889 0.003 A 89 TRP HH2 H 1 6.746 0.011 A 89 TRP HZ2 H 1 7.026 0.006 A 89 TRP HZ3 H 1 6.940 0.007 A 89 TRP C C 13 174.573 . A 89 TRP CA C 13 56.463 0.03 A 89 TRP CB C 13 33.661 0.035 A 89 TRP CD1 C 13 127.314 0.023 A 89 TRP CE3 C 13 119.418 0.019 A 89 TRP CH2 C 13 124.225 0.031 A 89 TRP CZ2 C 13 113.719 0.025 A 89 TRP CZ3 C 13 122.056 0.001 A 89 TRP N N 15 121.993 0.014 A 89 TRP NE1 N 15 131.918 0.026 A 90 ARG H H 1 9.111 0.01 A 90 ARG HA H 1 5.305 0.008 A 90 ARG HBy H 1 1.838 0.004 A 90 ARG HBx H 1 1.547 0.001 A 90 ARG HD2 H 1 3.060 0.002 A 90 ARG HGy H 1 1.418 0.003 A 90 ARG HGx H 1 1.335 0.003 A 90 ARG C C 13 175.380 0.03 A 90 ARG CA C 13 55.014 0.034 A 90 ARG CB C 13 33.103 . A 90 ARG CD C 13 43.388 0.028 A 90 ARG CG C 13 27.982 . A 90 ARG N N 15 122.084 0.024 A 91 LEU H H 1 9.275 0.005 A 91 LEU HA H 1 4.927 0.006 A 91 LEU HBy H 1 1.305 0.003 A 91 LEU HBx H 1 1.300 0.005 A 91 LEU HDx% H 1 0.179 0.004 A 91 LEU HDy% H 1 0.070 0.005 A 91 LEU HG H 1 1.299 0.002 A 91 LEU C C 13 175.427 . A 91 LEU CA C 13 54.783 0.054 A 91 LEU CB C 13 45.081 0.018 A 91 LEU CDy C 13 26.345 0.011 A 91 LEU CDx C 13 26.145 0.041 A 91 LEU CG C 13 28.844 0.017 A 91 LEU N N 15 130.828 0.039 A 92 THR H H 1 8.989 0.004 A 92 THR HA H 1 5.013 0.007 A 92 THR HB H 1 4.050 0.007 A 92 THR HG2% H 1 1.177 0.003 A 92 THR C C 13 174.082 . A 92 THR CA C 13 62.152 0.05 A 92 THR CB C 13 70.501 0.059 A 92 THR CG2 C 13 21.477 0.009 A 92 THR N N 15 118.049 0.018 A 93 THR H H 1 8.771 0.004 A 93 THR HA H 1 4.985 0.006 A 93 THR HB H 1 4.778 0.006 A 93 THR HG2% H 1 1.440 0.004 A 93 THR C C 13 175.400 . A 93 THR CA C 13 59.649 0.017 A 93 THR CB C 13 72.111 . A 93 THR CG2 C 13 22.340 0.008 A 93 THR N N 15 116.164 0.018 A 94 GLY H H 1 9.012 0.005 A 94 GLY HA3 H 1 3.979 0.006 A 94 GLY C C 13 174.904 . A 94 GLY CA C 13 46.632 0.027 A 94 GLY N N 15 108.788 0.02 A 95 GLU H H 1 8.305 0.005 A 95 GLU HA H 1 4.461 0.006 A 95 GLU HBy H 1 2.193 0.002 A 95 GLU HBx H 1 2.009 0.002 A 95 GLU HGx H 1 2.258 0.005 A 95 GLU HGy H 1 2.261 0.006 A 95 GLU C C 13 175.970 . A 95 GLU CA C 13 56.310 0.01 A 95 GLU CB C 13 30.997 0.026 A 95 GLU CG C 13 36.767 0.007 A 95 GLU N N 15 117.711 0.017 A 96 GLY H H 1 7.538 0.005 A 96 GLY HAx H 1 3.837 0.006 A 96 GLY HAy H 1 4.021 0.003 A 96 GLY C C 13 170.359 . A 96 GLY CA C 13 45.010 0.048 A 96 GLY N N 15 108.131 0.013 A 97 ALA H H 1 7.818 0.002 A 97 ALA HA H 1 5.364 0.005 A 97 ALA HB% H 1 1.172 0.005 A 97 ALA C C 13 176.562 . A 97 ALA CA C 13 50.512 0.044 A 97 ALA CB C 13 21.392 0.034 A 97 ALA N N 15 121.783 0.016 A 98 TYR H H 1 9.032 0.003 A 98 TYR HA H 1 4.905 0.007 A 98 TYR HBx H 1 2.358 0.005 A 98 TYR HBy H 1 2.769 0.005 A 98 TYR HD1 H 1 7.233 0.005 A 98 TYR HD2 H 1 7.233 0.005 A 98 TYR HE1 H 1 6.942 0.004 A 98 TYR HE2 H 1 6.942 0.004 A 98 TYR C C 13 174.293 . A 98 TYR CA C 13 57.415 0.011 A 98 TYR CB C 13 42.860 0.037 A 98 TYR CD1 C 13 134.135 0.007 A 98 TYR CD2 C 13 134.135 0.007 A 98 TYR CE1 C 13 118.203 0.008 A 98 TYR CE2 C 13 118.203 0.008 A 98 TYR N N 15 119.547 0.009 A 99 GLN H H 1 9.157 0.007 A 99 GLN HA H 1 5.220 0.002 A 99 GLN HBx H 1 1.961 0.002 A 99 GLN HBy H 1 2.100 0.004 A 99 GLN HE21 H 1 6.626 0.002 A 99 GLN HE22 H 1 7.454 0.001 A 99 GLN HGx H 1 2.135 0.007 A 99 GLN HGy H 1 2.240 0.005 A 99 GLN C C 13 174.692 . A 99 GLN CA C 13 54.353 0.04 A 99 GLN CB C 13 30.596 0.009 A 99 GLN CG C 13 34.318 0.021 A 99 GLN N N 15 122.699 0.02 A 99 GLN NE2 N 15 110.195 0.013 A 100 LEU H H 1 9.225 0.007 A 100 LEU HA H 1 5.282 0.003 A 100 LEU HBy H 1 1.284 0.003 A 100 LEU HBx H 1 1.056 0.002 A 100 LEU HDx% H 1 0.373 0.005 A 100 LEU HDy% H 1 0.347 0.005 A 100 LEU HG H 1 1.289 0.002 A 100 LEU C C 13 175.139 . A 100 LEU CA C 13 53.710 0.028 A 100 LEU CB C 13 46.803 0.02 A 100 LEU CDy C 13 26.278 0.014 A 100 LEU CDx C 13 25.821 0.02 A 100 LEU CG C 13 27.947 0.023 A 100 LEU N N 15 128.594 0.015 A 101 ARG H H 1 8.908 0.01 A 101 ARG HA H 1 4.786 0.006 A 101 ARG HBy H 1 1.691 0.004 A 101 ARG HBx H 1 1.553 0.005 A 101 ARG HDy H 1 3.054 0.002 A 101 ARG HDx H 1 2.984 0.003 A 101 ARG HGx H 1 1.290 0.004 A 101 ARG HGy H 1 1.489 0.006 A 101 ARG C C 13 174.313 0.044 A 101 ARG CA C 13 55.741 0.032 A 101 ARG CB C 13 34.884 0.011 A 101 ARG CD C 13 43.595 0.062 A 101 ARG CG C 13 27.947 0.017 A 101 ARG N N 15 123.958 0.028 A 102 CYS H H 1 9.068 0.006 A 102 CYS HA H 1 4.471 0.003 A 102 CYS HBx H 1 2.468 0.005 A 102 CYS HBy H 1 3.001 0.005 A 102 CYS C C 13 173.701 0.035 A 102 CYS CA C 13 58.131 0.039 A 102 CYS CB C 13 28.219 0.019 A 102 CYS N N 15 124.261 0.024 A 103 LEU H H 1 8.501 0.004 A 103 LEU HA H 1 4.646 0.005 A 103 LEU HB3 H 1 1.538 0.002 A 103 LEU HDx% H 1 0.698 0.003 A 103 LEU HDy% H 1 0.657 0.006 A 103 LEU HG H 1 1.353 0.004 A 103 LEU C C 13 176.636 . A 103 LEU CA C 13 54.446 0.044 A 103 LEU CB C 13 43.783 0.021 A 103 LEU CDx C 13 24.007 0.011 A 103 LEU CDy C 13 25.491 0.011 A 103 LEU CG C 13 27.732 0.021 A 103 LEU N N 15 124.396 0.014 A 104 GLY H H 1 8.486 0.001 A 104 GLY HAy H 1 4.271 0.004 A 104 GLY HAx H 1 3.868 0.007 A 104 GLY C C 13 173.369 . A 104 GLY CA C 13 44.716 0.039 A 104 GLY N N 15 110.303 0.01 A 105 ALA H H 1 8.521 0.009 A 105 ALA HA H 1 4.297 0.007 A 105 ALA HB% H 1 1.310 0.003 A 105 ALA C C 13 177.991 . A 105 ALA CA C 13 52.436 0.032 A 105 ALA CB C 13 19.466 0.028 A 105 ALA N N 15 123.497 0.01 A 106 VAL H H 1 8.228 0.005 A 106 VAL HA H 1 4.095 0.006 A 106 VAL HB H 1 2.017 0.003 A 106 VAL HGx% H 1 0.901 0.003 A 106 VAL HGy% H 1 0.895 0.006 A 106 VAL C C 13 176.313 . A 106 VAL CA C 13 62.162 0.014 A 106 VAL CB C 13 32.944 0.056 A 106 VAL CGx C 13 20.643 0.014 A 106 VAL CGy C 13 21.196 0.014 A 106 VAL N N 15 119.758 0.03 A 107 SER H H 1 8.388 0.005 A 107 SER HA H 1 4.416 0.006 A 107 SER HB3 H 1 3.799 0.005 A 107 SER C C 13 174.285 . A 107 SER CA C 13 58.078 0.016 A 107 SER CB C 13 63.902 0.028 A 107 SER N N 15 120.104 0.041 A 108 ALA H H 1 8.430 0.006 A 108 ALA HA H 1 4.344 0.007 A 108 ALA HB% H 1 1.352 0.005 A 108 ALA C C 13 177.727 . A 108 ALA CA C 13 52.495 0.019 A 108 ALA CB C 13 19.328 0.026 A 108 ALA N N 15 126.966 0.019 A 109 SER H H 1 8.334 0.002 A 109 SER HA H 1 4.396 0.01 A 109 SER HB3 H 1 3.744 . A 109 SER C C 13 175.147 . A 109 SER CA C 13 58.416 0.09 A 109 SER CB C 13 63.993 . A 109 SER N N 15 115.468 0.012 A 110 GLY H H 1 8.375 0.003 A 110 GLY HA3 H 1 3.947 0.003 A 110 GLY C C 13 174.148 . A 110 GLY CA C 13 45.387 0.006 A 110 GLY N N 15 111.046 0.006 A 111 GLU H H 1 8.237 0.004 A 111 GLU HA H 1 4.290 0.002 A 111 GLU HB2 H 1 1.851 . A 111 GLU HG3 H 1 2.039 . A 111 GLU C C 13 176.158 . A 111 GLU CA C 13 56.395 0.036 A 111 GLU CB C 13 30.333 . A 111 GLU N N 15 120.170 0.02 A 112 ASP H H 1 8.375 0.004 A 112 ASP HA H 1 4.565 0.007 A 112 ASP HBx H 1 2.535 0.004 A 112 ASP HBy H 1 2.689 0.004 A 112 ASP C C 13 175.181 . A 112 ASP CA C 13 54.494 0.035 A 112 ASP CB C 13 41.119 0.008 A 112 ASP N N 15 121.254 0.011 A 113 GLU H H 1 7.821 0.003 A 113 GLU HA H 1 4.058 0.009 A 113 GLU HBx H 1 1.824 0.004 A 113 GLU HBy H 1 1.977 0.001 A 113 GLU HG3 H 1 2.143 0.003 A 113 GLU CA C 13 57.971 0.052 A 113 GLU CB C 13 31.203 0.037 A 113 GLU CG C 13 36.489 . A 113 GLU N N 15 125.680 0.039 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 33 ASN HA A 55 TRP HZ2 1.0 . 4.08 2 2 A 72 PHE HE% A 98 TYR HE% 1.0 . 3.85 3 3 A 61 SER HBx A 70 TRP HZ3 1.0 . 4.50 4 4 A 72 PHE HE% A 70 TRP HBy 1.0 . 4.36 5 5 A 20 LEU HBy A 30 PHE HE% 1.0 . 4.75 6 6 A 30 PHE HE% A 20 LEU HBx 1.0 . 4.66 7 7 A 20 LEU HBy A 30 PHE HD% 1.0 . 3.49 8 8 A 30 PHE HD% A 20 LEU HDy% 1.0 . 4.53 9 9 A 50 PHE HE% A 52 SER HBx 1.0 . 4.79 10 10 A 28 TRP HBx A 28 TRP HE3 1.0 . 4.13 11 11 A 55 TRP HA A 55 TRP HD1 1.0 . 4.67 12 12 A 88 SER HA A 89 TRP HD1 1.0 . 4.09 13 13 A 55 TRP HE3 A 55 TRP HBy 1.0 . 3.99 14 14 A 55 TRP HE3 A 55 TRP HBx 1.0 . 3.99 15 15 A 27 ALA HA A 28 TRP HD1 1.0 . 4.36 16 16 A 59 VAL HB A 70 TRP HE3 1.0 . 3.93 17 17 A 70 TRP HZ3 A 61 SER HBy 1.0 . 4.57 18 18 A 70 TRP HE3 A 61 SER HBy 1.0 . 5.26 19 19 A 28 TRP HD1 A 61 SER HA 1.0 . 3.92 20 20 A 72 PHE HE% A 72 PHE HA 1.0 . 4.74 21 21 A 72 PHE HE% A 93 THR HG2% 1.0 . 3.97 22 22 A 72 PHE HE% A 59 VAL HGy% 1.0 . 4.04 23 23 A 36 LEU HDy% A 74 TYR HD% 1.0 . 3.75 24 24 A 55 TRP HZ2 A 58 ALA HB% 1.0 . 4.56 25 25 A 58 ALA HB% A 55 TRP HZ3 1.0 . 3.85 26 26 A 30 PHE HE% A 17 ALA HB% 1.0 . 4.28 27 27 A 30 PHE HD% A 59 VAL HA 1.0 . 4.33 28 28 A 40 ALA HB% A 50 PHE HD% 1.0 . 4.07 29 29 A 50 PHE HE% A 43 ALA HB% 1.0 . 4.23 30 30 A 72 PHE HA A 72 PHE HD% 1.0 . 3.53 31 31 A 72 PHE HE% A 91 LEU HDy% 1.0 . 4.33 32 32 A 9 TYR HA A 9 TYR HD% 1.0 . 3.44 33 33 A 9 TYR HA A 9 TYR HE% 1.0 . 4.24 34 34 A 9 TYR HE% A 7 GLN HGx 1.0 . 4.04 35 35 A 9 TYR HE% A 7 GLN HGy 1.0 . 4.04 36 36 A 50 PHE HE% A 74 TYR HD% 1.0 . 4.70 37 37 A 74 TYR HD% A 75 ASN HA 1.0 . 3.88 38 38 A 56 VAL HGy% A 74 TYR HE% 1.0 . 3.93 39 39 A 70 TRP HD1 A 98 TYR HD% 1.0 . 4.42 40 40 A 98 TYR HE% A 70 TRP HD1 1.0 . 3.96 41 41 A 98 TYR HD% A 97 ALA HA 1.0 . 4.19 42 42 A 98 TYR HD% A 98 TYR HA 1.0 . 3.70 43 43 A 93 THR HG2% A 98 TYR HD% 1.0 . 3.96 44 44 A 98 TYR HD% A 22 ILE HG2% 1.0 . 4.20 45 45 A 70 TRP HD1 A 70 TRP HA 1.0 . 4.07 46 46 A 70 TRP HD1 A 72 PHE HZ 1.0 . 4.14 47 47 A 70 TRP HH2 A 25 LEU HDy% 1.0 . 4.14 48 48 A 70 TRP HH2 A 25 LEU HDx% 1.0 . 4.14 49 49 A 61 SER HBy A 70 TRP HH2 1.0 . 4.42 50 50 A 61 SER HBx A 70 TRP HH2 1.0 . 4.37 51 51 A 89 TRP HD1 A 101 ARG HA 1.0 . 4.56 52 52 A 89 TRP HZ2 A 8 ARG HBx 1.0 . 4.28 53 53 A 89 TRP HH2 A 8 ARG HBx 1.0 . 4.37 54 54 A 89 TRP HH2 A 8 ARG HBy 1.0 . 4.37 55 55 A 31 GLU HA A 32 LEU HDx% 1.0 . 5.27 56 56 A 22 ILE HG2% A 70 TRP HBx 1.0 . 6.09 57 57 A 91 LEU HA A 92 THR HG2% 1.0 . 5.02 58 58 A 88 SER HA A 101 ARG HBy 1.0 . 4.81 59 59 A 81 GLU HA A 81 GLU HGy 1.0 . 4.11 60 60 A 10 LEU HBy A 10 LEU HDx% 1.0 . 4.08 61 61 A 22 ILE HD1% A 100 LEU HDy% 1.0 . 4.45 62 62 A 99 GLN HGy A 88 SER HBx 1.0 . 4.79 63 63 A 43 ALA HB% A 50 PHE HBy 1.0 . 3.50 64 64 A 11 LEU HA A 14 LEU HDy% 1.0 . 4.84 65 65 A 76 ALA HB% A 72 PHE HBy 1.0 . 4.26 66 66 A 56 VAL HGx% A 77 VAL HGy% 1.0 . 3.41 67 67 A 43 ALA HB% A 48 GLN HBx 1.0 . 3.75 68 68 A 59 VAL HA A 59 VAL HGy% 1.0 . 3.76 69 69 A 93 THR HG2% A 94 GLY HA3 1.0 . 5.81 70 70 A 28 TRP HBx A 61 SER HA 1.0 . 5.49 71 71 A 76 ALA HB% A 72 PHE HBx 1.0 . 4.26 72 72 A 78 MET HA A 77 VAL HGx% 1.0 . 5.79 73 73 A 74 TYR HA A 77 VAL HGx% 1.0 . 4.85 74 74 A 10 LEU HA A 10 LEU HDy% 1.0 . 4.34 75 75 A 71 ARG HGy A 69 GLU HGx 1.0 . 5.16 76 76 A 15 GLU HA A 16 THR HG2% 1.0 . 5.03 77 77 A 100 LEU HA A 100 LEU HDx% 1.0 . 4.11 78 78 A 22 ILE HG2% A 25 LEU HBx 1.0 . 4.82 79 79 A 36 LEU HDy% A 54 ASP HBy 1.0 . 3.60 80 80 A 101 ARG HA A 100 LEU HDx% 1.0 . 5.61 81 81 A 8 ARG HA A 8 ARG HGx 1.0 . 4.07 82 82 A 58 ALA HB% A 69 GLU HGx 1.0 . 5.02 83 83 A 56 VAL HGx% A 73 SER HA 1.0 . 5.22 84 84 A 56 VAL HGy% A 74 TYR HBx 1.0 . 4.85 85 85 A 81 GLU HGy A 82 PRO HDx 1.0 . 4.64 86 86 A 91 LEU HDy% A 89 TRP HBx 1.0 . 4.16 87 87 A 58 ALA HA A 71 ARG HBy 1.0 . 5.26 88 88 A 11 LEU HBx A 11 LEU HDx% 1.0 . 3.22 89 89 A 22 ILE HG2% A 22 ILE HA 1.0 . 3.87 90 90 A 53 GLU HA A 53 GLU HGx 1.0 . 4.01 91 91 A 90 ARG HA A 99 GLN HA 1.0 . 3.66 92 92 A 26 HIS HA A 27 ALA HB% 1.0 . 4.92 93 93 A 55 TRP HA A 57 LEU H 1.0 . 3.98 94 94 A 19 MET HE% A 103 LEU HG 1.0 . 4.21 95 95 A 20 LEU HA A 102 CYS HBx 1.0 . 5.56 96 96 A 80 ALA HB% A 89 TRP HBy 1.0 . 4.33 97 97 A 13 GLU HBx A 102 CYS HBy 1.0 . 5.31 98 98 A 36 LEU HDx% A 54 ASP HBx 1.0 . 3.38 99 99 A 57 LEU HA A 57 LEU HDy% 1.0 . 4.56 100 100 A 99 GLN HGy A 90 ARG HA 1.0 . 5.57 101 101 A 36 LEU HA A 39 GLN HBy 1.0 . 4.49 102 102 A 76 ALA HA A 79 GLU HGy 1.0 . 4.80 103 103 A 56 VAL HGx% A 74 TYR HA 1.0 . 3.50 104 104 A 60 GLU HA A 60 GLU HG2 1.0 . 4.11 105 104 A 60 GLU HA A 60 GLU HG3 1.0 . 4.11 106 105 A 36 LEU HDy% A 52 SER HA 1.0 . 5.16 107 106 A 32 LEU HA A 32 LEU HG 1.0 . 4.22 108 107 A 70 TRP HBy A 22 ILE HD1% 1.0 . 4.38 109 108 A 36 LEU HDy% A 36 LEU HA 1.0 . 3.87 110 109 A 21 GLU HA A 21 GLU HGy 1.0 . 4.12 111 110 A 106 VAL HA A 106 VAL HGy% 1.0 . 3.47 112 111 A 11 LEU HA A 14 LEU HBy 1.0 . 4.33 113 112 A 22 ILE HG2% A 22 ILE HG1y 1.0 . 3.99 114 113 A 59 VAL HA A 30 PHE HBx 1.0 . 5.29 115 114 A 22 ILE HD1% A 100 LEU HG 1.0 . 4.48 116 115 A 91 LEU HDy% A 100 LEU HBy 1.0 . 4.08 117 116 A 68 ARG HA A 68 ARG HGx 1.0 . 4.05 118 117 A 91 LEU HDy% A 89 TRP HBy 1.0 . 4.16 119 118 A 80 ALA HB% A 10 LEU HBx 1.0 . 4.68 120 119 A 71 ARG HGy A 58 ALA HA 1.0 . 4.89 121 120 A 38 ASP HA A 39 GLN HA 1.0 . 5.63 122 121 A 22 ILE HG2% A 22 ILE HD1% 1.0 . 3.08 123 122 A 11 LEU HA A 11 LEU HDy% 1.0 . 3.56 124 123 A 43 ALA HB% A 50 PHE HA 1.0 . 3.94 125 124 A 40 ALA HB% A 39 GLN HBy 1.0 . 5.15 126 125 A 17 ALA HB% A 102 CYS HBy 1.0 . 3.74 127 126 A 62 LEU HBx A 62 LEU HDx% 1.0 . 3.69 128 127 A 102 CYS HA A 20 LEU HDy% 1.0 . 4.56 129 128 A 82 PRO HA A 89 TRP HA 1.0 . 3.84 130 129 A 88 SER HA A 101 ARG HGx 1.0 . 4.78 131 130 A 76 ALA HB% A 56 VAL HGx% 1.0 . 5.23 132 131 A 74 TYR HA A 56 VAL HA 1.0 . 5.56 133 132 A 56 VAL HGx% A 77 VAL HGx% 1.0 . 3.41 134 133 A 92 THR HG2% A 93 THR HB 1.0 . 6.92 135 134 A 42 LEU HA A 42 LEU HG 1.0 . 3.99 136 135 A 98 TYR HA A 22 ILE HG2% 1.0 . 4.39 137 136 A 62 LEU HDy% A 67 ARG HBy 1.0 . 5.61 138 137 A 89 TRP HA A 83 GLN HGy 1.0 . 4.69 139 138 A 65 ARG HA A 62 LEU HDy% 1.0 . 5.06 140 139 A 17 ALA HB% A 14 LEU HA 1.0 . 3.50 141 140 A 16 THR HG2% A 17 ALA HA 1.0 . 5.89 142 141 A 74 TYR HBx A 36 LEU HDx% 1.0 . 4.76 143 142 A 14 LEU HBy A 14 LEU HDx% 1.0 . 3.96 144 143 A 20 LEU HA A 102 CYS HA 1.0 . 3.73 145 144 A 77 VAL HA A 77 VAL HGy% 1.0 . 3.77 146 145 A 14 LEU HBy A 32 LEU HDy% 1.0 . 4.06 147 146 A 103 LEU HG A 103 LEU HA 1.0 . 3.76 148 147 A 102 CYS HA A 103 LEU HDx% 1.0 . 4.84 149 148 A 78 MET HA A 78 MET HE% 1.0 . 3.53 150 149 A 39 GLN HA A 39 GLN HGx 1.0 . 3.82 151 150 A 50 PHE HA A 40 ALA HA 1.0 . 5.20 152 151 A 91 LEU HDy% A 76 ALA HA 1.0 . 6.33 153 152 A 100 LEU HA A 100 LEU HDy% 1.0 . 4.11 154 153 A 16 THR HG2% A 15 GLU HB2 1.0 . 3.55 155 154 A 36 LEU HDx% A 39 GLN HBx 1.0 . 3.94 156 155 A 90 ARG HA A 90 ARG HGy 1.0 . 4.09 157 156 A 40 ALA HB% A 50 PHE HA 1.0 . 5.02 158 157 A 71 ARG HBy A 71 ARG HDy 1.0 . 3.96 159 158 A 84 ALA HB% A 85 ASP HBx 1.0 . 5.75 160 159 A 92 THR HG2% A 92 THR HA 1.0 . 2.92 161 160 A 11 LEU HBx A 11 LEU HDy% 1.0 . 3.22 162 161 A 58 ALA HB% A 69 GLU HGy 1.0 . 5.02 163 162 A 73 SER HA A 55 TRP HBy 1.0 . 4.79 164 163 A 101 ARG HA A 88 SER HBx 1.0 . 5.66 165 164 A 101 ARG HBy A 101 ARG HDx 1.0 . 3.59 166 165 A 10 LEU HA A 13 GLU HGx 1.0 . 6.02 167 166 A 58 ALA HB% A 71 ARG HA 1.0 . 4.08 168 167 A 16 THR HG2% A 12 ASP HA 1.0 . 5.34 169 168 A 98 TYR HA A 22 ILE HD1% 1.0 . 4.88 170 169 A 83 GLN HGx A 88 SER HBy 1.0 . 5.01 171 170 A 80 ALA HB% A 89 TRP HA 1.0 . 4.70 172 171 A 17 ALA HB% A 16 THR H 1.0 . 3.85 173 172 A 100 LEU HA A 22 ILE HB 1.0 . 5.30 174 173 A 36 LEU HDy% A 56 VAL HGy% 1.0 . 3.60 175 174 A 42 LEU HA A 42 LEU HDy% 1.0 . 3.70 176 175 A 103 LEU HG A 19 MET HGy 1.0 . 4.92 177 176 A 71 ARG HGy A 69 GLU HGy 1.0 . 5.16 178 177 A 82 PRO HA A 83 GLN HA 1.0 . 5.06 179 178 A 107 SER HA A 108 ALA HB% 1.0 . 4.55 180 179 A 57 LEU HA A 57 LEU HDx% 1.0 . 4.56 181 180 A 22 ILE HD1% A 100 LEU HA 1.0 . 4.39 182 181 A 44 ALA HB% A 45 GLU HGx 1.0 . 4.56 183 182 A 67 ARG HDy A 62 LEU HDy% 1.0 . 5.27 184 183 A 58 ALA HB% A 71 ARG HDy 1.0 . 4.28 185 184 A 22 ILE HD1% A 59 VAL HGx% 1.0 . 3.71 186 185 A 36 LEU HDx% A 52 SER HA 1.0 . 4.70 187 186 A 10 LEU HA A 13 GLU HBx 1.0 . 5.42 188 187 A 22 ILE HG2% A 100 LEU HA 1.0 . 4.52 189 188 A 88 SER HA A 101 ARG HA 1.0 . 4.05 190 189 A 22 ILE HD1% A 98 TYR HBy 1.0 . 4.35 191 190 A 97 ALA HB% A 96 GLY HAy 1.0 . 4.78 192 191 A 36 LEU HDy% A 74 TYR HBy 1.0 . 3.84 193 192 A 63 ASP HBy A 25 LEU HDx% 1.0 . 4.17 194 193 A 46 ALA HA A 47 ASP HBx 1.0 . 5.46 195 194 A 40 ALA HB% A 39 GLN HBx 1.0 . 5.08 196 195 A 67 ARG HA A 62 LEU HDy% 1.0 . 5.37 197 196 A 101 ARG HDy A 103 LEU HDy% 1.0 . 4.58 198 197 A 77 VAL HA A 91 LEU HG 1.0 . 4.82 199 198 A 102 CYS HA A 103 LEU HDy% 1.0 . 4.84 200 199 A 101 ARG HA A 88 SER HBy 1.0 . 5.66 201 200 A 72 PHE HA A 91 LEU HDx% 1.0 . 4.81 202 201 A 78 MET HE% A 11 LEU HBy 1.0 . 4.37 203 202 A 36 LEU HA A 39 GLN HGx 1.0 . 4.41 204 203 A 91 LEU HDy% A 100 LEU HBx 1.0 . 4.08 205 204 A 16 THR HG2% A 16 THR HA 1.0 . 2.86 206 205 A 25 LEU HA A 25 LEU HDy% 1.0 . 3.85 207 206 A 44 ALA HB% A 45 GLU HA 1.0 . 4.27 208 207 A 44 ALA HB% A 41 ASP HA 1.0 . 3.20 209 208 A 91 LEU HDx% A 72 PHE HBx 1.0 . 5.73 210 209 A 67 ARG HDy A 62 LEU HDx% 1.0 . 5.27 211 210 A 83 GLN HA A 84 ALA HA 1.0 . 5.23 212 211 A 103 LEU HG A 19 MET HGx 1.0 . 4.92 213 212 A 70 TRP HBy A 59 VAL HGy% 1.0 . 5.22 214 213 A 88 SER HA A 101 ARG HBx 1.0 . 4.78 215 214 A 56 VAL HGx% A 72 PHE HBx 1.0 . 5.60 216 215 A 44 ALA HB% A 45 GLU HGy 1.0 . 4.56 217 216 A 62 LEU HBx A 62 LEU HDy% 1.0 . 3.69 218 217 A 59 VAL HB A 30 PHE HA 1.0 . 5.38 219 218 A 67 ARG HBx A 62 LEU HDy% 1.0 . 5.61 220 219 A 27 ALA HB% A 28 TRP HA 1.0 . 5.36 221 220 A 10 LEU HA A 13 GLU HBy 1.0 . 5.42 222 221 A 89 TRP HBx A 100 LEU HBx 1.0 . 5.13 223 222 A 36 LEU HDx% A 54 ASP HBy 1.0 . 3.38 224 223 A 13 GLU HGx A 13 GLU HA 1.0 . 3.59 225 224 A 89 TRP HA A 82 PRO HBy 1.0 . 5.26 226 225 A 74 TYR HBy A 56 VAL HB 1.0 . 5.42 227 226 A 11 LEU HA A 14 LEU HDx% 1.0 . 4.84 228 227 A 81 GLU HBy A 82 PRO HDy 1.0 . 4.97 229 228 A 34 GLU HA A 34 GLU HGx 1.0 . 4.18 230 229 A 97 ALA HA A 96 GLY HAx 1.0 . 5.91 231 230 A 56 VAL HGy% A 33 ASN HBx 1.0 . 4.52 232 231 A 43 ALA HB% A 48 GLN HBy 1.0 . 3.75 233 232 A 56 VAL HGy% A 74 TYR HA 1.0 . 4.00 234 233 A 46 ALA HB% A 48 GLN HBx 1.0 . 3.83 235 234 A 58 ALA HA A 71 ARG HBx 1.0 . 5.30 236 235 A 25 LEU HA A 25 LEU HDx% 1.0 . 3.85 237 236 A 58 ALA HB% A 59 VAL HA 1.0 . 5.71 238 237 A 76 ALA HA A 91 LEU HDx% 1.0 . 5.25 239 238 A 83 GLN HGx A 88 SER HBx 1.0 . 5.01 240 239 A 76 ALA HA A 79 GLU HGx 1.0 . 4.80 241 240 A 97 ALA HA A 92 THR HA 1.0 . 3.26 242 241 A 63 ASP HA A 66 THR HG2% 1.0 . 4.59 243 242 A 74 TYR HBx A 52 SER HBy 1.0 . 5.07 244 243 A 11 LEU HA A 11 LEU HDx% 1.0 . 3.56 245 244 A 40 ALA HB% A 41 ASP HA 1.0 . 4.81 246 245 A 71 ARG HGx A 69 GLU HGy 1.0 . 5.13 247 246 A 32 LEU HBy A 32 LEU HDy% 1.0 . 4.16 248 247 A 12 ASP HA A 15 GLU HGy 1.0 . 5.23 249 248 A 73 SER HA A 55 TRP HBx 1.0 . 4.79 250 249 A 58 ALA HA A 71 ARG HDy 1.0 . 5.09 251 250 A 15 GLU HB2 A 16 THR HA 1.0 . 5.03 252 251 A 59 VAL HA A 30 PHE HA 1.0 . 3.73 253 252 A 29 ARG HA A 29 ARG HD2 1.0 . 4.85 254 253 A 36 LEU HDx% A 52 SER HBx 1.0 . 4.01 255 254 A 56 VAL HA A 36 LEU HBy 1.0 . 5.32 256 255 A 56 VAL HGy% A 33 ASN HBy 1.0 . 4.52 257 256 A 44 ALA HB% A 41 ASP HBy 1.0 . 5.32 258 257 A 4 MET HA A 4 MET HGy 1.0 . 3.98 259 258 A 91 LEU HDy% A 89 TRP HA 1.0 . 5.93 260 259 A 100 LEU HBx A 89 TRP HBy 1.0 . 5.13 261 260 A 13 GLU HBy A 102 CYS HBy 1.0 . 5.31 262 261 A 61 SER HA A 27 ALA HB% 1.0 . 5.12 263 262 A 91 LEU HA A 91 LEU HDx% 1.0 . 4.00 264 263 A 6 THR HG2% A 7 GLN HA 1.0 . 5.09 265 264 A 25 LEU HBy A 25 LEU HDy% 1.0 . 3.98 266 265 A 39 GLN HA A 42 LEU HBx 1.0 . 3.99 267 266 A 84 ALA HB% A 83 GLN HA 1.0 . 4.80 268 267 A 55 TRP HA A 73 SER HA 1.0 . 3.79 269 268 A 89 TRP HA A 82 PRO HBx 1.0 . 5.48 270 269 A 93 THR HG2% A 93 THR HA 1.0 . 3.16 271 270 A 36 LEU HA A 39 GLN HBx 1.0 . 4.23 272 271 A 17 ALA HB% A 16 THR HA 1.0 . 5.34 273 272 A 59 VAL HA A 30 PHE HBy 1.0 . 5.29 274 273 A 103 LEU HDx% A 101 ARG HDy 1.0 . 4.58 275 274 A 80 ALA HB% A 89 TRP HBx 1.0 . 4.33 276 275 A 32 LEU HDx% A 32 LEU HBy 1.0 . 4.16 277 276 A 97 ALA HB% A 96 GLY HAx 1.0 . 4.78 278 277 A 52 SER HA A 51 ALA HB% 1.0 . 4.59 279 278 A 10 LEU HDx% A 10 LEU HBx 1.0 . 4.08 280 279 A 27 ALA HA A 61 SER HBy 1.0 . 4.73 281 280 A 25 LEU HBx A 25 LEU HDx% 1.0 . 4.12 282 281 A 32 LEU HDx% A 32 LEU HBx 1.0 . 4.16 283 282 A 67 ARG HA A 67 ARG HDx 1.0 . 4.76 284 283 A 58 ALA HB% A 57 LEU HA 1.0 . 4.82 285 284 A 59 VAL HB A 22 ILE HD1% 1.0 . 4.00 286 285 A 27 ALA HB% A 21 GLU HA 1.0 . 4.94 287 286 A 71 ARG HBx A 71 ARG HDx 1.0 . 3.87 288 287 A 77 VAL HA A 91 LEU HDx% 1.0 . 3.62 289 288 A 46 ALA HA A 47 ASP HBy 1.0 . 5.46 290 289 A 81 GLU HA A 81 GLU HGx 1.0 . 4.06 291 290 A 101 ARG HDx A 103 LEU HDy% 1.0 . 4.58 292 291 A 6 THR HG2% A 4 MET HE% 1.0 . 5.71 293 292 A 106 VAL HGy% A 105 ALA HA 1.0 . 5.01 294 293 A 101 ARG HA A 100 LEU HDy% 1.0 . 5.61 295 294 A 43 ALA HB% A 48 GLN HA 1.0 . 5.46 296 295 A 80 ALA HB% A 10 LEU HDx% 1.0 . 4.71 297 296 A 58 ALA HB% A 71 ARG HBy 1.0 . 5.33 298 297 A 40 ALA HB% A 44 ALA HB% 1.0 . 5.08 299 298 A 22 ILE HG2% A 27 ALA HB% 1.0 . 4.26 300 299 A 91 LEU HDx% A 72 PHE HBy 1.0 . 5.73 301 300 A 100 LEU HBx A 10 LEU HDy% 1.0 . 6.36 302 301 A 34 GLU HA A 37 LEU HG 1.0 . 4.47 303 302 A 89 TRP HBy A 100 LEU HBy 1.0 . 5.13 304 303 A 70 TRP HBy A 59 VAL HGx% 1.0 . 5.22 305 304 A 76 ALA HB% A 79 GLU HBx 1.0 . 5.58 306 305 A 56 VAL HGx% A 74 TYR HBx 1.0 . 4.70 307 306 A 71 ARG HGy A 71 ARG HA 1.0 . 4.19 308 307 A 43 ALA HB% A 40 ALA HA 1.0 . 3.40 309 308 A 25 LEU HA A 25 LEU HG 1.0 . 3.94 310 309 A 59 VAL HA A 59 VAL HGx% 1.0 . 3.76 311 310 A 13 GLU HA A 13 GLU HGy 1.0 . 3.85 312 311 A 22 ILE HG2% A 22 ILE HG1x 1.0 . 3.99 313 312 A 62 LEU HDx% A 67 ARG HBy 1.0 . 5.61 314 313 A 91 LEU HDy% A 90 ARG HA 1.0 . 4.50 315 314 A 34 GLU HA A 37 LEU HBx 1.0 . 4.43 316 315 A 32 LEU HA A 32 LEU HDx% 1.0 . 4.06 317 316 A 76 ALA HB% A 91 LEU HDx% 1.0 . 3.56 318 317 A 61 SER HBx A 27 ALA HB% 1.0 . 4.78 319 318 A 20 LEU HBy A 102 CYS HA 1.0 . 5.40 320 319 A 36 LEU HDy% A 54 ASP HBx 1.0 . 3.60 321 320 A 36 LEU HDy% A 74 TYR HBx 1.0 . 3.70 322 321 A 4 MET HGy A 3 HIS HA 1.0 . 5.60 323 322 A 71 ARG HA A 71 ARG HDx 1.0 . 4.69 324 323 A 99 GLN HA A 99 GLN HGx 1.0 . 3.84 325 324 A 22 ILE HA A 22 ILE HG1y 1.0 . 4.24 326 325 A 74 TYR HA A 77 VAL HB 1.0 . 4.51 327 326 A 56 VAL HGy% A 56 VAL HA 1.0 . 3.61 328 327 A 21 GLU HA A 21 GLU HGx 1.0 . 4.12 329 328 A 53 GLU HA A 53 GLU HGy 1.0 . 4.01 330 329 A 4 MET HA A 4 MET HGx 1.0 . 3.61 331 330 A 43 ALA HA A 48 GLN HBy 1.0 . 4.35 332 331 A 60 GLU HA A 69 GLU HBx 1.0 . 4.99 333 332 A 10 LEU HBx A 10 LEU HDy% 1.0 . 4.08 334 333 A 11 LEU HA A 10 LEU HG 1.0 . 5.03 335 334 A 91 LEU HDy% A 80 ALA HA 1.0 . 4.51 336 335 A 80 ALA HB% A 10 LEU HBy 1.0 . 4.68 337 336 A 3 HIS HA A 5 THR HG2% 1.0 . 5.20 338 337 A 88 SER HBx A 83 GLN HGy 1.0 . 5.01 339 338 A 89 TRP HBx A 100 LEU HBy 1.0 . 5.13 340 339 A 20 LEU HA A 103 LEU HDy% 1.0 . 4.76 341 340 A 70 TRP HA A 22 ILE HD1% 1.0 . 5.64 342 341 A 42 LEU HBx A 42 LEU HDx% 1.0 . 3.10 343 342 A 71 ARG HGx A 69 GLU HGx 1.0 . 5.13 344 343 A 98 TYR HA A 97 ALA HB% 1.0 . 5.08 345 344 A 71 ARG HA A 71 ARG HGx 1.0 . 4.03 346 345 A 17 ALA HB% A 102 CYS HBx 1.0 . 3.74 347 346 A 25 LEU HBy A 25 LEU HDx% 1.0 . 3.98 348 347 A 89 TRP HA A 83 GLN HA 1.0 . 5.74 349 348 A 36 LEU HDx% A 52 SER HBy 1.0 . 4.01 350 349 A 28 TRP HA A 29 ARG HA 1.0 . 5.08 351 350 A 37 LEU HA A 37 LEU HDy% 1.0 . 3.69 352 351 A 101 ARG HA A 101 ARG HDy 1.0 . 5.02 353 352 A 102 CYS HBx A 13 GLU HBy 1.0 . 5.31 354 353 A 91 LEU HDy% A 91 LEU HA 1.0 . 3.98 355 354 A 58 ALA HB% A 71 ARG HBx 1.0 . 5.26 356 355 A 10 LEU HDx% A 100 LEU HBy 1.0 . 6.36 357 356 A 39 GLN HA A 42 LEU HBy 1.0 . 3.72 358 357 A 58 ALA HA A 71 ARG HA 1.0 . 3.68 359 358 A 11 LEU HDy% A 78 MET HE% 1.0 . 3.91 360 359 A 45 GLU HA A 45 GLU HGy 1.0 . 3.64 361 360 A 84 ALA HB% A 85 ASP HBy 1.0 . 6.01 362 361 A 76 ALA HA A 79 GLU HBx 1.0 . 4.31 363 362 A 78 MET HA A 77 VAL HGy% 1.0 . 5.79 364 363 A 74 TYR HA A 56 VAL HB 1.0 . 4.27 365 364 A 39 GLN HA A 39 GLN HGy 1.0 . 3.82 366 365 A 97 ALA HA A 92 THR HB 1.0 . 4.26 367 366 A 14 LEU HBy A 14 LEU HDy% 1.0 . 3.96 368 367 A 32 LEU HBx A 32 LEU HDy% 1.0 . 4.16 369 368 A 106 VAL HA A 106 VAL HGx% 1.0 . 3.47 370 369 A 22 ILE HD1% A 98 TYR HBx 1.0 . 4.57 371 370 A 80 ALA HB% A 77 VAL HA 1.0 . 3.97 372 371 A 36 LEU HDx% A 36 LEU HBx 1.0 . 4.18 373 372 A 91 LEU HA A 91 LEU HG 1.0 . 3.73 374 373 A 80 ALA HA A 81 GLU HBx 1.0 . 5.30 375 374 A 100 LEU HG A 91 LEU HDx% 1.0 . 5.69 376 375 A 91 LEU HDy% A 76 ALA HB% 1.0 . 4.38 377 376 A 10 LEU HA A 10 LEU HDx% 1.0 . 4.34 378 377 A 45 GLU HA A 45 GLU HGx 1.0 . 3.64 379 378 A 58 ALA HB% A 71 ARG HGx 1.0 . 3.91 380 379 A 93 THR HG2% A 76 ALA HB% 1.0 . 3.39 381 380 A 82 PRO HDy A 81 GLU HGx 1.0 . 4.90 382 381 A 91 LEU HDy% A 77 VAL HA 1.0 . 3.90 383 382 A 10 LEU HA A 80 ALA HB% 1.0 . 5.64 384 383 A 25 LEU HBx A 25 LEU HDy% 1.0 . 4.12 385 384 A 66 THR HG2% A 66 THR HA 1.0 . 3.09 386 385 A 50 PHE HA A 49 PRO HBx 1.0 . 5.49 387 386 A 11 LEU HDx% A 78 MET HE% 1.0 . 3.91 388 387 A 56 VAL HGy% A 37 LEU HA 1.0 . 5.00 389 388 A 101 ARG HA A 101 ARG HDx 1.0 . 5.02 390 389 A 57 LEU HA A 32 LEU HA 1.0 . 3.98 391 390 A 91 LEU HA A 80 ALA HB% 1.0 . 3.80 392 391 A 11 LEU HBx A 78 MET HE% 1.0 . 4.22 393 392 A 22 ILE HD1% A 100 LEU HBy 1.0 . 5.64 394 393 A 46 ALA HB% A 43 ALA HA 1.0 . 3.31 395 394 A 80 ALA HB% A 10 LEU HDy% 1.0 . 4.71 396 395 A 93 THR HG2% A 76 ALA HA 1.0 . 5.00 397 396 A 11 LEU HA A 14 LEU HBx 1.0 . 5.19 398 397 A 56 VAL HGx% A 72 PHE HBy 1.0 . 5.60 399 398 A 10 LEU HG A 14 LEU HG 1.0 . 4.62 400 399 A 36 LEU HDy% A 52 SER HBy 1.0 . 4.20 401 400 A 74 TYR HA A 77 VAL HGy% 1.0 . 4.85 402 401 A 56 VAL HGx% A 57 LEU HA 1.0 . 5.26 403 402 A 74 TYR HBx A 52 SER HBx 1.0 . 5.07 404 403 A 44 ALA HB% A 41 ASP HBx 1.0 . 5.32 405 404 A 27 ALA HA A 61 SER HA 1.0 . 4.11 406 405 A 20 LEU HA A 103 LEU HDx% 1.0 . 4.76 407 406 A 36 LEU HA A 39 GLN HGy 1.0 . 4.41 408 407 A 90 ARG HA A 90 ARG HGx 1.0 . 4.09 409 408 A 67 ARG HA A 62 LEU HDx% 1.0 . 5.37 410 409 A 81 GLU HA A 80 ALA HB% 1.0 . 5.08 411 410 A 10 LEU HA A 13 GLU HGy 1.0 . 5.67 412 411 A 79 GLU HA A 79 GLU HGy 1.0 . 3.71 413 412 A 91 LEU HA A 80 ALA HA 1.0 . 3.48 414 413 A 22 ILE HD1% A 100 LEU HBx 1.0 . 5.64 415 414 A 58 ALA HA A 71 ARG HDx 1.0 . 5.60 416 415 A 99 GLN HGy A 99 GLN HA 1.0 . 3.85 417 416 A 22 ILE HA A 22 ILE HG1x 1.0 . 4.24 418 417 A 63 ASP HBy A 66 THR HG2% 1.0 . 4.34 419 418 A 50 PHE HA A 51 ALA HB% 1.0 . 4.56 420 419 A 36 LEU HDx% A 36 LEU HA 1.0 . 3.14 421 420 A 60 GLU HA A 69 GLU HBy 1.0 . 4.99 422 421 A 58 ALA HB% A 71 ARG HGy 1.0 . 4.19 423 422 A 14 LEU HA A 14 LEU HG 1.0 . 4.22 424 423 A 43 ALA HA A 48 GLN HBx 1.0 . 4.35 425 424 A 62 LEU HDx% A 67 ARG HBx 1.0 . 5.61 426 425 A 37 LEU HA A 37 LEU HDx% 1.0 . 3.69 427 426 A 34 GLU HA A 37 LEU HBy 1.0 . 4.43 428 427 A 42 LEU HDy% A 42 LEU HBx 1.0 . 3.10 429 428 A 91 LEU HDx% A 80 ALA HA 1.0 . 4.52 430 429 A 8 ARG HA A 8 ARG HGy 1.0 . 4.07 431 430 A 4 MET HA A 5 THR HG2% 1.0 . 4.58 432 431 A 6 THR HG2% A 6 THR HA 1.0 . 2.80 433 432 A 19 MET HA A 19 MET HGy 1.0 . 3.95 434 433 A 83 GLN HGy A 88 SER HBy 1.0 . 5.01 435 434 A 81 GLU HA A 82 PRO HDy 1.0 . 3.89 436 435 A 62 LEU HA A 62 LEU HDy% 1.0 . 3.89 437 436 A 43 ALA HB% A 50 PHE HBx 1.0 . 3.50 438 437 A 56 VAL HGx% A 77 VAL HB 1.0 . 4.06 439 438 A 20 LEU HA A 20 LEU HDx% 1.0 . 4.14 440 439 A 70 TRP HBx A 22 ILE HD1% 1.0 . 5.98 441 440 A 99 GLN HGy A 88 SER HBy 1.0 . 4.79 442 441 A 12 ASP HA A 15 GLU HGx 1.0 . 5.23 443 442 A 32 LEU HA A 32 LEU HDy% 1.0 . 4.06 444 443 A 88 SER HA A 87 GLU HA 1.0 . 5.99 445 444 A 22 ILE HA A 100 LEU HG 1.0 . 4.45 446 445 A 17 ALA HA A 102 CYS HBy 1.0 . 5.33 447 446 A 62 LEU HA A 62 LEU HDx% 1.0 . 3.89 448 447 A 89 TRP HA A 83 GLN HGx 1.0 . 4.69 449 448 A 56 VAL HA A 33 ASN HBx 1.0 . 4.12 450 449 A 103 LEU HA A 103 LEU HDy% 1.0 . 3.80 451 450 A 61 SER HA A 28 TRP HBy 1.0 . 5.66 452 451 A 36 LEU HDy% A 52 SER HBx 1.0 . 4.20 453 452 A 102 CYS HA A 20 LEU HDx% 1.0 . 4.56 454 453 A 94 GLY HA3 A 93 THR HB 1.0 . 5.72 455 454 A 10 LEU HDx% A 100 LEU HBx 1.0 . 6.36 456 455 A 14 LEU HA A 14 LEU HDy% 1.0 . 4.44 457 456 A 13 GLU HBx A 102 CYS HBx 1.0 . 5.31 458 457 A 31 GLU HA A 32 LEU HG 1.0 . 4.90 459 458 A 66 THR HG2% A 63 ASP HBx 1.0 . 4.80 460 459 A 60 GLU HA A 69 GLU HA 1.0 . 3.93 461 460 A 5 THR HG2% A 5 THR HA 1.0 . 3.12 462 461 A 91 LEU HDy% A 80 ALA HB% 1.0 . 3.20 463 462 A 14 LEU HA A 14 LEU HDx% 1.0 . 4.44 464 463 A 55 TRP HA A 56 VAL HGx% 1.0 . 4.77 465 464 A 93 THR HG2% A 91 LEU HDx% 1.0 . 3.22 466 465 A 68 ARG HA A 68 ARG HGy 1.0 . 4.05 467 466 A 61 SER HBx A 27 ALA HA 1.0 . 4.47 468 467 A 31 GLU HA A 32 LEU HDy% 1.0 . 5.27 469 468 A 22 ILE HG2% A 98 TYR HBx 1.0 . 4.89 470 469 A 17 ALA HA A 102 CYS HBx 1.0 . 5.33 471 470 A 58 ALA HA A 71 ARG HGx 1.0 . 4.44 472 471 A 63 ASP HA A 64 GLY HAx 1.0 . 5.65 473 472 A 65 ARG HA A 66 THR HG2% 1.0 . 5.48 474 473 A 36 LEU HA A 36 LEU HG 1.0 . 3.55 475 474 A 100 LEU HA A 100 LEU HG 1.0 . 3.63 476 475 A 100 LEU HA A 22 ILE HA 1.0 . 3.69 477 476 A 36 LEU HDy% A 54 ASP HA 1.0 . 4.97 478 477 A 56 VAL HA A 33 ASN HBy 1.0 . 4.12 479 478 A 14 LEU HBy A 32 LEU HDx% 1.0 . 4.06 480 479 A 103 LEU HDx% A 101 ARG HDx 1.0 . 4.58 481 480 A 63 ASP HBy A 25 LEU HDy% 1.0 . 4.17 482 481 A 71 ARG HDy A 71 ARG HBx 1.0 . 4.04 483 482 A 79 GLU HA A 79 GLU HGx 1.0 . 3.71 484 483 A 72 PHE HA A 93 THR HG2% 1.0 . 4.12 485 484 A 82 PRO HDx A 81 GLU HGx 1.0 . 4.70 486 485 A 101 ARG HBy A 101 ARG HDy 1.0 . 3.59 487 486 A 36 LEU HDy% A 56 VAL HA 1.0 . 4.15 488 487 A 94 GLY HA3 A 93 THR HA 1.0 . 5.53 489 488 A 34 GLU HA A 34 GLU HGy 1.0 . 4.18 490 489 A 20 LEU HA A 102 CYS HBy 1.0 . 5.56 491 490 A 22 ILE HD1% A 100 LEU HDx% 1.0 . 4.45 492 491 A 77 VAL HA A 77 VAL HGx% 1.0 . 3.77 493 492 A 33 ASN HA A 56 VAL HA 1.0 . 4.96 494 493 A 81 GLU HGy A 80 ALA HA 1.0 . 5.11 495 494 A 56 VAL HGx% A 74 TYR HBy 1.0 . 4.88 496 495 A 65 ARG HA A 62 LEU HDx% 1.0 . 5.06 497 496 A 10 LEU HBy A 10 LEU HDy% 1.0 . 4.08 498 497 A 97 ALA HA A 96 GLY HAy 1.0 . 5.91 499 498 A 42 LEU HA A 42 LEU HDx% 1.0 . 3.70 500 499 A 43 ALA HB% A 49 PRO HA 1.0 . 4.94 501 500 A 27 ALA HA A 22 ILE HG2% 1.0 . 5.62 502 501 A 72 PHE HA A 76 ALA HB% 1.0 . 4.31 503 502 A 22 ILE HD1% A 22 ILE HA 1.0 . 3.85 504 503 A 71 ARG HBy A 71 ARG HDx 1.0 . 3.81 505 504 A 36 LEU HDx% A 39 GLN HBy 1.0 . 4.07 506 505 A 71 ARG HDy A 71 ARG HA 1.0 . 4.54 507 506 A 58 ALA HB% A 31 GLU HA 1.0 . 5.56 508 507 A 17 ALA HB% A 102 CYS HA 1.0 . 3.93 509 508 A 19 MET HA A 19 MET HGx 1.0 . 3.95 510 509 A 88 SER HA A 101 ARG HGy 1.0 . 4.78 511 510 A 103 LEU HA A 103 LEU HDx% 1.0 . 3.80 512 511 A 22 ILE HD1% A 59 VAL HGy% 1.0 . 3.71 513 512 A 63 ASP HA A 64 GLY HAy 1.0 . 5.65 514 513 A 67 ARG HDy A 67 ARG HA 1.0 . 4.72 515 514 A 20 LEU HA A 20 LEU HDy% 1.0 . 4.14 516 515 A 72 PHE HD% A 57 LEU HBy 1.0 . 4.39 517 516 A 72 PHE HD% A 70 TRP HBx 1.0 . 3.85 518 517 A 50 PHE HE% A 52 SER HBy 1.0 . 4.79 519 518 A 72 PHE HE% A 59 VAL HGx% 1.0 . 4.04 520 519 A 70 TRP HD1 A 22 ILE HD1% 1.0 . 4.69 521 520 A 30 PHE HE% A 14 LEU HBx 1.0 . 4.60 522 521 A 72 PHE HZ A 22 ILE HD1% 1.0 . 3.88 523 522 A 72 PHE HD% A 57 LEU HG 1.0 . 4.10 524 523 A 98 TYR HE% A 97 ALA HA 1.0 . 4.76 525 524 A 98 TYR HD% A 91 LEU HDx% 1.0 . 4.57 526 525 A 70 TRP HE3 A 22 ILE HD1% 1.0 . 4.72 527 526 A 30 PHE HD% A 19 MET HA 1.0 . 4.84 528 527 A 50 PHE HE% A 74 TYR HE% 1.0 . 4.20 529 528 A 58 ALA HB% A 55 TRP HH2 1.0 . 3.71 530 529 A 50 PHE HE% A 36 LEU HDx% 1.0 . 3.61 531 530 A 50 PHE HD% A 43 ALA HB% 1.0 . 3.45 532 531 A 74 TYR HD% A 74 TYR HA 1.0 . 4.33 533 532 A 36 LEU HDx% A 50 PHE HZ 1.0 . 3.50 534 533 A 70 TRP HZ2 A 25 LEU HDx% 1.0 . 4.21 535 534 A 50 PHE HD% A 50 PHE HA 1.0 . 3.56 536 535 A 55 TRP HZ3 A 57 LEU HA 1.0 . 4.63 537 536 A 30 PHE HE% A 20 LEU HDy% 1.0 . 4.86 538 537 A 36 LEU HDy% A 50 PHE HZ 1.0 . 4.55 539 538 A 30 PHE HE% A 19 MET HA 1.0 . 4.15 540 539 A 57 LEU HA A 55 TRP HH2 1.0 . 4.26 541 540 A 72 PHE HZ A 98 TYR HBx 1.0 . 5.18 542 541 A 70 TRP HBy A 72 PHE HZ 1.0 . 5.28 543 542 A 70 TRP HZ3 A 59 VAL HB 1.0 . 4.70 544 543 A 33 ASN HA A 55 TRP HH2 1.0 . 4.08 545 544 A 72 PHE HZ A 91 LEU HDx% 1.0 . 5.22 546 545 A 72 PHE HE% A 70 TRP HD1 1.0 . 4.34 547 546 A 22 ILE HG2% A 70 TRP HZ2 1.0 . 4.74 548 547 A 93 THR HG2% A 72 PHE HD% 1.0 . 3.65 549 548 A 50 PHE HE% A 40 ALA HA 1.0 . 4.63 550 549 A 72 PHE HE% A 98 TYR HD% 1.0 . 3.88 551 550 A 72 PHE HD% A 59 VAL HGx% 1.0 . 4.13 552 551 A 30 PHE HD% A 14 LEU HBx 1.0 . 5.02 553 552 A 17 ALA HB% A 30 PHE HZ 1.0 . 4.03 554 553 A 72 PHE HD% A 91 LEU HDy% 1.0 . 4.26 555 554 A 74 TYR HD% A 50 PHE HD% 1.0 . 4.26 556 555 A 36 LEU HDy% A 74 TYR HE% 1.0 . 4.55 557 556 A 74 TYR HD% A 51 ALA HB% 1.0 . 4.33 558 557 A 89 TRP HZ2 A 87 GLU HA 1.0 . 4.54 559 558 A 32 LEU HA A 55 TRP HH2 1.0 . 4.29 560 559 A 89 TRP HD1 A 89 TRP HA 1.0 . 4.66 561 560 A 74 TYR HD% A 56 VAL HB 1.0 . 4.21 562 561 A 72 PHE HE% A 98 TYR HBx 1.0 . 5.10 563 562 A 93 THR HG2% A 72 PHE HZ 1.0 . 5.08 564 563 A 30 PHE HD% A 20 LEU HDx% 1.0 . 4.53 565 564 A 70 TRP HE3 A 59 VAL HGy% 1.0 . 4.59 566 565 A 89 TRP HZ2 A 8 ARG HBy 1.0 . 4.28 567 566 A 72 PHE HD% A 57 LEU HBx 1.0 . 4.39 568 567 A 30 PHE HE% A 32 LEU HDy% 1.0 . 4.36 569 568 A 30 PHE HE% A 32 LEU HDx% 1.0 . 4.36 570 569 A 50 PHE HE% A 36 LEU HDy% 1.0 . 4.25 571 570 A 72 PHE HD% A 59 VAL HGy% 1.0 . 4.13 572 571 A 72 PHE HE% A 22 ILE HD1% 1.0 . 3.71 573 572 A 50 PHE HE% A 39 GLN HBx 1.0 . 4.91 574 573 A 74 TYR HE% A 51 ALA HB% 1.0 . 4.63 575 574 A 30 PHE HE% A 20 LEU HDx% 1.0 . 4.86 576 575 A 36 LEU HG A 50 PHE HZ 1.0 . 4.39 577 576 A 50 PHE HE% A 50 PHE HA 1.0 . 4.79 578 577 A 72 PHE HD% A 91 LEU HDx% 1.0 . 3.97 579 578 A 74 TYR HE% A 78 MET HE% 1.0 . 4.61 580 579 A 39 GLN HBx A 50 PHE HZ 1.0 . 5.04 581 580 A 22 ILE HG2% A 70 TRP HH2 1.0 . 4.99 582 581 A 74 TYR HD% A 56 VAL HGy% 1.0 . 3.61 583 582 A 28 TRP HE3 A 28 TRP HA 1.0 . 4.25 584 583 A 72 PHE HE% A 100 LEU HG 1.0 . 4.13 585 584 A 70 TRP HD1 A 22 ILE HG2% 1.0 . 5.21 586 585 A 30 PHE HD% A 32 LEU HDx% 1.0 . 3.97 587 586 A 72 PHE HD% A 76 ALA HB% 1.0 . 4.15 588 587 A 98 TYR HE% A 72 PHE HZ 1.0 . 5.36 589 588 A 9 TYR HE% A 78 MET HE% 1.0 . 3.75 590 589 A 70 TRP HE3 A 59 VAL HGx% 1.0 . 4.59 591 590 A 72 PHE HD% A 72 PHE HZ 1.0 . 4.23 592 591 A 74 TYR HE% A 37 LEU HDy% 1.0 . 4.24 593 592 A 70 TRP HE3 A 69 GLU HA 1.0 . 4.28 594 593 A 72 PHE HE% A 91 LEU HDx% 1.0 . 4.42 595 594 A 72 PHE HD% A 100 LEU HG 1.0 . 4.43 596 595 A 98 TYR HD% A 92 THR HA 1.0 . 4.34 597 596 A 50 PHE HD% A 40 ALA HA 1.0 . 3.94 598 597 A 30 PHE HD% A 32 LEU HDy% 1.0 . 3.97 599 598 A 9 TYR HD% A 78 MET HE% 1.0 . 4.84 600 599 A 74 TYR HE% A 37 LEU HDx% 1.0 . 4.24 601 600 A 50 PHE HD% A 74 TYR HE% 1.0 . 3.34 602 601 A 98 TYR HD% A 72 PHE HZ 1.0 . 4.44 603 602 A 70 TRP HZ2 A 25 LEU HDy% 1.0 . 4.21 604 603 A 50 PHE HE% A 36 LEU HG 1.0 . 4.32 605 604 A 72 PHE HD% A 22 ILE HD1% 1.0 . 4.50 606 605 A 30 PHE HD% A 30 PHE HA 1.0 . 4.02 607 606 A 50 PHE HE% A 39 GLN HBy 1.0 . 4.53 608 607 A 98 TYR HE% A 93 THR HG2% 1.0 . 3.64 609 608 A 40 ALA HB% A 74 TYR HE% 1.0 . 3.70 610 609 A 74 TYR HD% A 56 VAL HGx% 1.0 . 3.94 611 610 A 89 TRP HZ2 A 10 LEU HA 1.0 . 4.27 612 611 A 30 PHE HD% A 30 PHE HZ 1.0 . 3.99 613 612 A 60 GLU H A 30 PHE HBy 1.0 . 4.94 614 613 A 92 THR HB A 93 THR H 1.0 . 3.81 615 614 A 76 ALA HB% A 77 VAL H 1.0 . 3.45 616 615 A 83 GLN H A 84 ALA H 1.0 . 4.48 617 616 A 56 VAL HGx% A 72 PHE H 1.0 . 4.92 618 617 A 20 LEU H A 20 LEU HDy% 1.0 . 5.27 619 618 A 82 PRO HDx A 81 GLU H 1.0 . 4.89 620 619 A 36 LEU HDy% A 33 ASN HD22 1.0 . 4.62 621 620 A 53 GLU H A 54 ASP H 1.0 . 3.34 622 621 A 95 GLU HBy A 96 GLY H 1.0 . 3.90 623 622 A 60 GLU H A 29 ARG HGy 1.0 . 4.99 624 623 A 66 THR HG2% A 65 ARG H 1.0 . 5.04 625 624 A 72 PHE HD% A 72 PHE H 1.0 . 3.86 626 625 A 56 VAL HA A 33 ASN H 1.0 . 3.97 627 626 A 75 ASN HA A 75 ASN HD22 1.0 . 4.48 628 627 A 9 TYR HE% A 9 TYR H 1.0 . 4.53 629 628 A 51 ALA HB% A 75 ASN HD21 1.0 . 3.97 630 629 A 49 PRO HA A 50 PHE H 1.0 . 2.69 631 630 A 78 MET H A 78 MET HGy 1.0 . 3.70 632 631 A 18 ASP H A 19 MET H 1.0 . 3.04 633 632 A 55 TRP HH2 A 58 ALA H 1.0 . 3.92 634 633 A 93 THR HG2% A 94 GLY H 1.0 . 3.92 635 634 A 86 GLY H A 87 GLU H 1.0 . 3.35 636 635 A 67 ARG H A 67 ARG HBy 1.0 . 3.63 637 636 A 81 GLU H A 90 ARG H 1.0 . 3.86 638 637 A 26 HIS H A 25 LEU HDx% 1.0 . 5.47 639 638 A 32 LEU H A 32 LEU HDx% 1.0 . 4.08 640 639 A 63 ASP HBy A 64 GLY H 1.0 . 4.29 641 640 A 35 ASN H A 35 ASN HD21 1.0 . 4.80 642 641 A 11 LEU H A 9 TYR HBx 1.0 . 4.65 643 642 A 76 ALA H A 75 ASN HBx 1.0 . 3.94 644 643 A 14 LEU H A 15 GLU H 1.0 . 3.71 645 644 A 5 THR HB A 6 THR H 1.0 . 2.95 646 645 A 36 LEU HBx A 36 LEU H 1.0 . 3.37 647 646 A 14 LEU HG A 13 GLU H 1.0 . 4.55 648 647 A 55 TRP H A 54 ASP HBx 1.0 . 3.69 649 648 A 91 LEU HDy% A 77 VAL H 1.0 . 4.73 650 649 A 89 TRP HA A 83 GLN HE22 1.0 . 4.71 651 650 A 37 LEU H A 38 ASP H 1.0 . 3.48 652 651 A 56 VAL HGy% A 74 TYR H 1.0 . 4.86 653 652 A 36 LEU HA A 39 GLN HE22 1.0 . 4.72 654 653 A 89 TRP HE1 A 102 CYS H 1.0 . 5.70 655 654 A 83 GLN H A 89 TRP HE3 1.0 . 4.16 656 655 A 40 ALA HB% A 44 ALA H 1.0 . 4.52 657 656 A 50 PHE HZ A 40 ALA H 1.0 . 4.58 658 657 A 68 ARG H A 68 ARG HBx 1.0 . 4.13 659 658 A 78 MET H A 77 VAL HGx% 1.0 . 4.02 660 659 A 91 LEU HDx% A 98 TYR H 1.0 . 5.60 661 660 A 20 LEU HA A 101 ARG H 1.0 . 4.46 662 661 A 75 ASN HD22 A 75 ASN HBx 1.0 . 3.99 663 662 A 35 ASN H A 36 LEU H 1.0 . 3.27 664 663 A 70 TRP H A 69 GLU HGy 1.0 . 4.72 665 664 A 53 GLU HA A 75 ASN HD22 1.0 . 5.14 666 665 A 30 PHE HE% A 19 MET H 1.0 . 4.81 667 666 A 98 TYR HE% A 97 ALA H 1.0 . 4.57 668 667 A 84 ALA HB% A 86 GLY H 1.0 . 4.42 669 668 A 20 LEU H A 20 LEU HG 1.0 . 4.56 670 669 A 90 ARG H A 90 ARG HBx 1.0 . 3.99 671 670 A 72 PHE H A 73 SER H 1.0 . 4.78 672 671 A 105 ALA H A 106 VAL H 1.0 . 3.85 673 672 A 40 ALA HB% A 40 ALA H 1.0 . 2.96 674 673 A 15 GLU H A 14 LEU HDy% 1.0 . 4.54 675 674 A 28 TRP HE1 A 62 LEU HDx% 1.0 . 5.40 676 675 A 40 ALA HA A 43 ALA H 1.0 . 3.96 677 676 A 53 GLU H A 52 SER HBy 1.0 . 4.37 678 677 A 40 ALA HA A 50 PHE H 1.0 . 4.97 679 678 A 101 ARG HBx A 21 GLU H 1.0 . 4.58 680 679 A 33 ASN H A 33 ASN HBx 1.0 . 3.88 681 680 A 33 ASN H A 32 LEU H 1.0 . 4.71 682 681 A 74 TYR HE% A 78 MET H 1.0 . 5.18 683 682 A 10 LEU HA A 89 TRP HE1 1.0 . 4.80 684 683 A 74 TYR HD% A 52 SER H 1.0 . 3.38 685 684 A 60 GLU H A 59 VAL HGx% 1.0 . 4.12 686 685 A 52 SER HA A 53 GLU H 1.0 . 3.03 687 686 A 36 LEU H A 35 ASN HBx 1.0 . 3.63 688 687 A 66 THR HG2% A 67 ARG H 1.0 . 3.83 689 688 A 99 GLN HE21 A 88 SER HBy 1.0 . 4.78 690 689 A 44 ALA H A 45 GLU H 1.0 . 3.13 691 690 A 78 MET H A 78 MET HGx 1.0 . 3.70 692 691 A 52 SER HA A 75 ASN HD22 1.0 . 5.08 693 692 A 21 GLU HA A 27 ALA H 1.0 . 4.39 694 693 A 63 ASP HBx A 63 ASP H 1.0 . 3.67 695 694 A 79 GLU HBx A 79 GLU H 1.0 . 3.39 696 695 A 17 ALA HB% A 19 MET H 1.0 . 3.45 697 696 A 30 PHE HA A 60 GLU H 1.0 . 4.20 698 697 A 40 ALA H A 42 LEU H 1.0 . 4.32 699 698 A 24 GLY H A 23 ASP HBx 1.0 . 4.84 700 699 A 22 ILE HA A 23 ASP H 1.0 . 3.53 701 700 A 20 LEU H A 20 LEU HDx% 1.0 . 5.27 702 701 A 68 ARG H A 68 ARG HBy 1.0 . 4.13 703 702 A 37 LEU H A 37 LEU HBy 1.0 . 3.72 704 703 A 80 ALA HB% A 81 GLU H 1.0 . 3.41 705 704 A 25 LEU HBx A 22 ILE H 1.0 . 4.58 706 705 A 85 ASP H A 83 GLN HBy 1.0 . 3.76 707 706 A 46 ALA HA A 47 ASP H 1.0 . 3.46 708 707 A 36 LEU HBy A 37 LEU H 1.0 . 3.58 709 708 A 33 ASN HA A 36 LEU H 1.0 . 4.66 710 709 A 81 GLU H A 83 GLN HE21 1.0 . 5.20 711 710 A 71 ARG HGy A 71 ARG H 1.0 . 4.19 712 711 A 28 TRP HBy A 29 ARG H 1.0 . 5.22 713 712 A 55 TRP H A 54 ASP HBy 1.0 . 3.69 714 713 A 36 LEU HDy% A 55 TRP H 1.0 . 4.72 715 714 A 52 SER H A 51 ALA HA 1.0 . 3.00 716 715 A 19 MET H A 19 MET HBy 1.0 . 3.69 717 716 A 12 ASP H A 12 ASP HBy 1.0 . 3.83 718 717 A 106 VAL HA A 107 SER H 1.0 . 2.65 719 718 A 83 GLN HA A 83 GLN HE22 1.0 . 4.28 720 719 A 52 SER H A 53 GLU HGx 1.0 . 5.35 721 720 A 30 PHE H A 29 ARG HBy 1.0 . 3.65 722 721 A 56 VAL HGx% A 74 TYR H 1.0 . 4.14 723 722 A 55 TRP HZ3 A 57 LEU H 1.0 . 3.89 724 723 A 24 GLY H A 23 ASP HBy 1.0 . 4.84 725 724 A 50 PHE HD% A 40 ALA H 1.0 . 4.60 726 725 A 46 ALA HB% A 47 ASP H 1.0 . 3.48 727 726 A 84 ALA HB% A 84 ALA H 1.0 . 3.04 728 727 A 60 GLU H A 30 PHE H 1.0 . 5.36 729 728 A 78 MET H A 80 ALA H 1.0 . 4.42 730 729 A 11 LEU H A 10 LEU HDy% 1.0 . 5.05 731 730 A 60 GLU H A 59 VAL H 1.0 . 4.36 732 731 A 70 TRP H A 69 GLU HGx 1.0 . 4.72 733 732 A 91 LEU HDx% A 76 ALA H 1.0 . 5.32 734 733 A 87 GLU HBx A 88 SER H 1.0 . 4.81 735 734 A 78 MET HA A 80 ALA H 1.0 . 4.19 736 735 A 14 LEU H A 32 LEU HDx% 1.0 . 4.74 737 736 A 17 ALA HB% A 17 ALA H 1.0 . 3.07 738 737 A 11 LEU HA A 15 GLU H 1.0 . 4.83 739 738 A 93 THR H A 98 TYR H 1.0 . 4.57 740 739 A 85 ASP H A 88 SER H 1.0 . 4.82 741 740 A 39 GLN HBx A 39 GLN H 1.0 . 3.34 742 741 A 28 TRP HE1 A 62 LEU HDy% 1.0 . 5.40 743 742 A 7 GLN HA A 7 GLN H 1.0 . 2.80 744 743 A 25 LEU H A 25 LEU HDx% 1.0 . 4.13 745 744 A 71 ARG HBy A 71 ARG H 1.0 . 3.71 746 745 A 37 LEU HG A 37 LEU H 1.0 . 3.37 747 746 A 76 ALA HB% A 92 THR H 1.0 . 4.46 748 747 A 33 ASN H A 33 ASN HBy 1.0 . 3.88 749 748 A 90 ARG H A 89 TRP HBy 1.0 . 4.49 750 749 A 42 LEU HBy A 42 LEU H 1.0 . 2.96 751 750 A 81 GLU HBx A 81 GLU H 1.0 . 3.26 752 751 A 44 ALA HB% A 45 GLU H 1.0 . 3.15 753 752 A 112 ASP H A 112 ASP HBy 1.0 . 4.18 754 753 A 77 VAL HA A 80 ALA H 1.0 . 4.06 755 754 A 74 TYR HBy A 52 SER H 1.0 . 4.20 756 755 A 60 GLU H A 59 VAL HGy% 1.0 . 4.12 757 756 A 93 THR HA A 95 GLU H 1.0 . 4.02 758 757 A 92 THR HB A 92 THR H 1.0 . 3.43 759 758 A 100 LEU H A 100 LEU HBy 1.0 . 4.02 760 759 A 35 ASN H A 35 ASN HD22 1.0 . 4.80 761 760 A 58 ALA H A 57 LEU HBx 1.0 . 4.59 762 761 A 91 LEU HDy% A 98 TYR H 1.0 . 5.06 763 762 A 51 ALA HB% A 75 ASN HD22 1.0 . 3.77 764 763 A 18 ASP H A 106 VAL HB 1.0 . 4.63 765 764 A 13 GLU H A 13 GLU HBx 1.0 . 3.81 766 765 A 90 ARG H A 83 GLN HE21 1.0 . 4.24 767 766 A 82 PRO HA A 90 ARG H 1.0 . 4.53 768 767 A 16 THR HG2% A 16 THR H 1.0 . 3.46 769 768 A 11 LEU HBx A 12 ASP H 1.0 . 4.50 770 769 A 77 VAL H A 78 MET HBy 1.0 . 4.61 771 770 A 10 LEU H A 10 LEU HDx% 1.0 . 4.53 772 771 A 74 TYR HBx A 74 TYR H 1.0 . 3.70 773 772 A 54 ASP H A 54 ASP HBy 1.0 . 3.36 774 773 A 41 ASP HA A 43 ALA H 1.0 . 4.45 775 774 A 80 ALA HA A 81 GLU H 1.0 . 3.06 776 775 A 34 GLU H A 34 GLU HGx 1.0 . 3.56 777 776 A 35 ASN H A 34 GLU HBy 1.0 . 3.85 778 777 A 30 PHE HD% A 31 GLU H 1.0 . 3.89 779 778 A 68 ARG H A 61 SER H 1.0 . 4.28 780 779 A 96 GLY H A 95 GLU HBx 1.0 . 4.14 781 780 A 92 THR H A 91 LEU H 1.0 . 4.72 782 781 A 60 GLU H A 29 ARG H 1.0 . 4.85 783 782 A 13 GLU H A 12 ASP H 1.0 . 3.64 784 783 A 30 PHE HA A 31 GLU H 1.0 . 3.25 785 784 A 72 PHE HE% A 72 PHE H 1.0 . 5.07 786 785 A 78 MET H A 78 MET HBy 1.0 . 3.47 787 786 A 17 ALA HA A 19 MET H 1.0 . 3.68 788 787 A 72 PHE H A 57 LEU HBx 1.0 . 4.52 789 788 A 55 TRP HZ3 A 58 ALA H 1.0 . 4.58 790 789 A 26 HIS H A 25 LEU HDy% 1.0 . 5.47 791 790 A 50 PHE HE% A 39 GLN H 1.0 . 5.09 792 791 A 68 ARG H A 63 ASP H 1.0 . 4.97 793 792 A 22 ILE HG2% A 23 ASP H 1.0 . 4.50 794 793 A 92 THR HG2% A 92 THR H 1.0 . 3.79 795 794 A 98 TYR HD% A 93 THR H 1.0 . 4.61 796 795 A 11 LEU H A 9 TYR HBy 1.0 . 4.65 797 796 A 80 ALA HA A 90 ARG H 1.0 . 4.76 798 797 A 9 TYR HE% A 8 ARG H 1.0 . 4.55 799 798 A 76 ALA H A 75 ASN HBy 1.0 . 3.94 800 799 A 18 ASP H A 104 GLY H 1.0 . 5.01 801 800 A 15 GLU H A 15 GLU HGx 1.0 . 3.70 802 801 A 20 LEU HA A 21 GLU H 1.0 . 3.25 803 802 A 38 ASP H A 37 LEU HBx 1.0 . 4.23 804 803 A 29 ARG HGy A 28 TRP HE1 1.0 . 5.59 805 804 A 20 LEU H A 19 MET HGy 1.0 . 5.12 806 805 A 40 ALA H A 43 ALA H 1.0 . 5.02 807 806 A 80 ALA HB% A 92 THR H 1.0 . 4.11 808 807 A 81 GLU H A 89 TRP HE3 1.0 . 4.30 809 808 A 44 ALA HB% A 44 ALA H 1.0 . 2.65 810 809 A 78 MET H A 77 VAL HGy% 1.0 . 4.02 811 810 A 15 GLU H A 13 GLU H 1.0 . 4.82 812 811 A 101 ARG H A 22 ILE H 1.0 . 4.86 813 812 A 25 LEU HBy A 22 ILE H 1.0 . 4.62 814 813 A 71 ARG H A 59 VAL H 1.0 . 5.49 815 814 A 36 LEU HA A 39 GLN HE21 1.0 . 4.72 816 815 A 75 ASN HD22 A 52 SER H 1.0 . 4.26 817 816 A 4 MET H A 3 HIS HBx 1.0 . 4.36 818 817 A 84 ALA H A 85 ASP H 1.0 . 3.50 819 818 A 8 ARG H A 8 ARG HGx 1.0 . 3.40 820 819 A 86 GLY H A 83 GLN HBx 1.0 . 4.69 821 820 A 13 GLU HGx A 14 LEU H 1.0 . 4.51 822 821 A 13 GLU H A 14 LEU HDx% 1.0 . 5.15 823 822 A 59 VAL HA A 60 GLU H 1.0 . 3.47 824 823 A 14 LEU HA A 16 THR H 1.0 . 4.74 825 824 A 26 HIS H A 25 LEU H 1.0 . 5.66 826 825 A 77 VAL H A 77 VAL HGx% 1.0 . 3.63 827 826 A 27 ALA HB% A 20 LEU H 1.0 . 4.31 828 827 A 98 TYR HD% A 70 TRP HE1 1.0 . 4.22 829 828 A 53 GLU H A 75 ASN HD22 1.0 . 5.03 830 829 A 73 SER HA A 56 VAL H 1.0 . 4.20 831 830 A 25 LEU H A 23 ASP HA 1.0 . 4.97 832 831 A 37 LEU H A 39 GLN H 1.0 . 4.40 833 832 A 89 TRP HE1 A 13 GLU HBy 1.0 . 5.29 834 833 A 66 THR HA A 65 ARG H 1.0 . 4.52 835 834 A 13 GLU H A 14 LEU HDy% 1.0 . 5.15 836 835 A 75 ASN HA A 75 ASN HD21 1.0 . 4.44 837 836 A 75 ASN HD21 A 52 SER H 1.0 . 4.03 838 837 A 29 ARG H A 28 TRP H 1.0 . 4.19 839 838 A 35 ASN H A 35 ASN HBx 1.0 . 3.23 840 839 A 101 ARG HBx A 99 GLN HE22 1.0 . 4.89 841 840 A 44 ALA H A 43 ALA H 1.0 . 3.17 842 841 A 30 PHE H A 31 GLU H 1.0 . 4.53 843 842 A 58 ALA HB% A 72 PHE H 1.0 . 4.35 844 843 A 93 THR H A 97 ALA H 1.0 . 4.78 845 844 A 83 GLN HA A 83 GLN HE21 1.0 . 4.28 846 845 A 68 ARG H A 62 LEU HDy% 1.0 . 5.66 847 846 A 87 GLU H A 88 SER H 1.0 . 3.23 848 847 A 91 LEU HDy% A 91 LEU H 1.0 . 4.28 849 848 A 81 GLU H A 90 ARG HBy 1.0 . 4.40 850 849 A 10 LEU H A 10 LEU HBy 1.0 . 3.97 851 850 A 85 ASP HBx A 85 ASP H 1.0 . 3.31 852 851 A 54 ASP H A 74 TYR H 1.0 . 4.99 853 852 A 5 THR H A 4 MET HBy 1.0 . 4.24 854 853 A 55 TRP HZ3 A 56 VAL H 1.0 . 4.60 855 854 A 9 TYR HD% A 9 TYR H 1.0 . 4.19 856 855 A 72 PHE HA A 73 SER H 1.0 . 3.17 857 856 A 84 ALA H A 83 GLN HE22 1.0 . 5.44 858 857 A 15 GLU H A 15 GLU HGy 1.0 . 3.70 859 858 A 80 ALA H A 77 VAL HGx% 1.0 . 4.87 860 859 A 82 PRO HA A 83 GLN H 1.0 . 3.17 861 860 A 19 MET H A 19 MET HGx 1.0 . 4.33 862 861 A 11 LEU H A 10 LEU HDx% 1.0 . 5.05 863 862 A 50 PHE H A 50 PHE HBx 1.0 . 3.33 864 863 A 28 TRP HE1 A 29 ARG HGx 1.0 . 5.34 865 864 A 20 LEU H A 19 MET HGx 1.0 . 5.12 866 865 A 12 ASP HA A 15 GLU H 1.0 . 4.26 867 866 A 61 SER HBx A 28 TRP H 1.0 . 4.97 868 867 A 22 ILE H A 25 LEU H 1.0 . 3.89 869 868 A 82 PRO HA A 83 GLN HE21 1.0 . 5.05 870 869 A 64 GLY H A 63 ASP H 1.0 . 4.01 871 870 A 63 ASP H A 66 THR HB 1.0 . 4.53 872 871 A 98 TYR HD% A 97 ALA H 1.0 . 4.64 873 872 A 71 ARG HA A 59 VAL H 1.0 . 4.18 874 873 A 11 LEU H A 12 ASP H 1.0 . 4.23 875 874 A 76 ALA H A 73 SER H 1.0 . 4.70 876 875 A 14 LEU H A 32 LEU HDy% 1.0 . 4.74 877 876 A 98 TYR H A 99 GLN H 1.0 . 4.34 878 877 A 15 GLU HB2 A 17 ALA H 1.0 . 4.58 879 878 A 39 GLN H A 39 GLN HGx 1.0 . 3.54 880 879 A 58 ALA H A 57 LEU HDx% 1.0 . 4.63 881 880 A 61 SER HA A 28 TRP H 1.0 . 4.04 882 881 A 36 LEU HDx% A 54 ASP H 1.0 . 4.39 883 882 A 56 VAL HGy% A 56 VAL H 1.0 . 4.63 884 883 A 106 VAL H A 107 SER H 1.0 . 3.37 885 884 A 80 ALA H A 78 MET HBy 1.0 . 4.72 886 885 A 50 PHE HD% A 51 ALA H 1.0 . 3.61 887 886 A 53 GLU HA A 75 ASN HD21 1.0 . 5.00 888 887 A 19 MET HE% A 104 GLY H 1.0 . 4.76 889 888 A 89 TRP H A 89 TRP HBx 1.0 . 4.05 890 889 A 70 TRP H A 69 GLU H 1.0 . 4.96 891 890 A 46 ALA HB% A 46 ALA H 1.0 . 2.85 892 891 A 52 SER H A 52 SER HBx 1.0 . 4.03 893 892 A 5 THR HG2% A 5 THR H 1.0 . 3.47 894 893 A 93 THR H A 96 GLY H 1.0 . 3.67 895 894 A 74 TYR H A 56 VAL H 1.0 . 4.68 896 895 A 90 ARG H A 90 ARG HBy 1.0 . 3.99 897 896 A 36 LEU HBx A 33 ASN HD22 1.0 . 4.55 898 897 A 36 LEU H A 35 ASN HBy 1.0 . 3.63 899 898 A 52 SER H A 52 SER HBy 1.0 . 4.03 900 899 A 98 TYR H A 91 LEU H 1.0 . 3.90 901 900 A 54 ASP H A 55 TRP H 1.0 . 4.40 902 901 A 6 THR H A 5 THR H 1.0 . 3.36 903 902 A 89 TRP H A 88 SER HBy 1.0 . 3.82 904 903 A 14 LEU H A 12 ASP H 1.0 . 4.75 905 904 A 63 ASP H A 66 THR H 1.0 . 4.04 906 905 A 10 LEU H A 10 LEU HDy% 1.0 . 4.53 907 906 A 91 LEU HDy% A 92 THR H 1.0 . 4.91 908 907 A 50 PHE HD% A 43 ALA H 1.0 . 4.81 909 908 A 99 GLN HE21 A 99 GLN HBx 1.0 . 4.62 910 909 A 38 ASP H A 39 GLN H 1.0 . 3.31 911 910 A 80 ALA HB% A 10 LEU H 1.0 . 4.66 912 911 A 77 VAL H A 78 MET H 1.0 . 3.28 913 912 A 37 LEU HG A 36 LEU H 1.0 . 4.16 914 913 A 80 ALA H A 79 GLU HGy 1.0 . 4.42 915 914 A 36 LEU HDx% A 39 GLN HE21 1.0 . 4.31 916 915 A 27 ALA HB% A 28 TRP H 1.0 . 3.90 917 916 A 18 ASP H A 104 GLY HAx 1.0 . 3.84 918 917 A 15 GLU HB2 A 15 GLU H 1.0 . 3.12 919 918 A 93 THR HG2% A 98 TYR H 1.0 . 4.49 920 919 A 31 GLU H A 30 PHE HBx 1.0 . 3.80 921 920 A 69 GLU HA A 61 SER H 1.0 . 4.84 922 921 A 58 ALA H A 59 VAL H 1.0 . 4.65 923 922 A 61 SER H A 60 GLU HBx 1.0 . 4.57 924 923 A 44 ALA H A 46 ALA H 1.0 . 4.45 925 924 A 24 GLY H A 25 LEU H 1.0 . 3.74 926 925 A 86 GLY H A 88 SER H 1.0 . 4.10 927 926 A 89 TRP HD1 A 89 TRP H 1.0 . 4.12 928 927 A 55 TRP H A 56 VAL H 1.0 . 4.52 929 928 A 100 LEU H A 89 TRP HBy 1.0 . 4.90 930 929 A 91 LEU HDx% A 77 VAL H 1.0 . 4.33 931 930 A 93 THR H A 95 GLU H 1.0 . 4.48 932 931 A 74 TYR HA A 76 ALA H 1.0 . 5.14 933 932 A 14 LEU H A 14 LEU HDy% 1.0 . 3.74 934 933 A 6 THR HA A 7 GLN H 1.0 . 2.80 935 934 A 38 ASP H A 37 LEU HBy 1.0 . 4.23 936 935 A 30 PHE H A 29 ARG HGx 1.0 . 4.01 937 936 A 70 TRP HE3 A 70 TRP H 1.0 . 4.05 938 937 A 36 LEU HDy% A 54 ASP H 1.0 . 4.42 939 938 A 32 LEU H A 31 GLU H 1.0 . 4.40 940 939 A 65 ARG H A 66 THR H 1.0 . 3.20 941 940 A 28 TRP HBy A 28 TRP H 1.0 . 4.12 942 941 A 50 PHE HE% A 51 ALA H 1.0 . 4.60 943 942 A 28 TRP HBx A 29 ARG H 1.0 . 5.22 944 943 A 25 LEU H A 25 LEU HDy% 1.0 . 4.13 945 944 A 22 ILE HA A 24 GLY H 1.0 . 4.70 946 945 A 77 VAL H A 77 VAL HGy% 1.0 . 3.63 947 946 A 57 LEU H A 55 TRP HBy 1.0 . 4.70 948 947 A 40 ALA HA A 44 ALA H 1.0 . 4.33 949 948 A 24 GLY H A 23 ASP H 1.0 . 3.98 950 949 A 68 ARG H A 67 ARG HBy 1.0 . 4.45 951 950 A 56 VAL HGx% A 78 MET H 1.0 . 4.59 952 951 A 102 CYS H A 101 ARG H 1.0 . 4.64 953 952 A 80 ALA HB% A 90 ARG H 1.0 . 4.19 954 953 A 70 TRP HE3 A 59 VAL H 1.0 . 4.81 955 954 A 76 ALA HB% A 76 ALA H 1.0 . 3.03 956 955 A 18 ASP H A 103 LEU H 1.0 . 3.94 957 956 A 72 PHE H A 57 LEU HBy 1.0 . 4.52 958 957 A 8 ARG H A 8 ARG HGy 1.0 . 3.40 959 958 A 85 ASP HBx A 86 GLY H 1.0 . 4.57 960 959 A 36 LEU HBy A 36 LEU H 1.0 . 3.23 961 960 A 65 ARG H A 63 ASP H 1.0 . 5.05 962 961 A 105 ALA HA A 106 VAL H 1.0 . 2.66 963 962 A 46 ALA HA A 48 GLN H 1.0 . 4.23 964 963 A 10 LEU H A 89 TRP HZ3 1.0 . 4.91 965 964 A 91 LEU HDx% A 92 THR H 1.0 . 4.74 966 965 A 90 ARG H A 91 LEU H 1.0 . 4.42 967 966 A 31 GLU H A 31 GLU HBy 1.0 . 4.04 968 967 A 63 ASP H A 62 LEU HDy% 1.0 . 4.75 969 968 A 57 LEU H A 56 VAL H 1.0 . 3.25 970 969 A 101 ARG HBx A 89 TRP H 1.0 . 4.78 971 970 A 9 TYR H A 8 ARG H 1.0 . 4.12 972 971 A 76 ALA HA A 80 ALA H 1.0 . 4.85 973 972 A 34 GLU H A 34 GLU HGy 1.0 . 3.56 974 973 A 9 TYR H A 10 LEU H 1.0 . 4.59 975 974 A 43 ALA H A 45 GLU H 1.0 . 4.30 976 975 A 17 ALA HA A 18 ASP H 1.0 . 3.03 977 976 A 14 LEU HBy A 15 GLU H 1.0 . 3.92 978 977 A 24 GLY H A 99 GLN HBx 1.0 . 5.01 979 978 A 4 MET HGy A 4 MET H 1.0 . 4.41 980 979 A 35 ASN H A 35 ASN HBy 1.0 . 3.23 981 980 A 99 GLN HA A 100 LEU H 1.0 . 3.20 982 981 A 13 GLU H A 12 ASP HBx 1.0 . 3.95 983 982 A 36 LEU HDy% A 33 ASN HD21 1.0 . 4.62 984 983 A 30 PHE HE% A 30 PHE H 1.0 . 4.80 985 984 A 50 PHE HA A 51 ALA H 1.0 . 2.80 986 985 A 79 GLU H A 79 GLU HGx 1.0 . 3.46 987 986 A 105 ALA H A 104 GLY HAy 1.0 . 3.17 988 987 A 80 ALA HB% A 77 VAL H 1.0 . 4.66 989 988 A 21 GLU HA A 22 ILE H 1.0 . 3.22 990 989 A 72 PHE HD% A 73 SER H 1.0 . 4.30 991 990 A 48 GLN H A 47 ASP HBx 1.0 . 4.22 992 991 A 89 TRP HA A 83 GLN H 1.0 . 3.79 993 992 A 100 LEU H A 89 TRP HBx 1.0 . 4.90 994 993 A 43 ALA HB% A 50 PHE H 1.0 . 4.10 995 994 A 60 GLU H A 60 GLU HBx 1.0 . 3.93 996 995 A 100 LEU HA A 21 GLU H 1.0 . 4.88 997 996 A 45 GLU HA A 47 ASP H 1.0 . 4.16 998 997 A 55 TRP HA A 73 SER H 1.0 . 4.69 999 998 A 85 ASP HBy A 85 ASP H 1.0 . 3.46 1000 999 A 62 LEU HBx A 63 ASP H 1.0 . 4.27 1001 1000 A 37 LEU H A 37 LEU HBx 1.0 . 3.72 1002 1001 A 81 GLU H A 83 GLN HE22 1.0 . 5.20 1003 1002 A 30 PHE HE% A 20 LEU H 1.0 . 5.07 1004 1003 A 70 TRP HBx A 71 ARG H 1.0 . 3.87 1005 1004 A 74 TYR HD% A 75 ASN H 1.0 . 3.70 1006 1005 A 91 LEU H A 90 ARG HBx 1.0 . 4.56 1007 1006 A 19 MET H A 19 MET HGy 1.0 . 4.33 1008 1007 A 67 ARG HDy A 68 ARG H 1.0 . 5.44 1009 1008 A 11 LEU HBx A 11 LEU H 1.0 . 3.65 1010 1009 A 30 PHE HD% A 32 LEU H 1.0 . 4.63 1011 1010 A 70 TRP HD1 A 70 TRP H 1.0 . 5.65 1012 1011 A 36 LEU HDx% A 36 LEU H 1.0 . 3.98 1013 1012 A 52 SER H A 51 ALA H 1.0 . 4.33 1014 1013 A 83 GLN H A 83 GLN HE22 1.0 . 4.48 1015 1014 A 67 ARG H A 66 THR HB 1.0 . 3.90 1016 1015 A 10 LEU HG A 11 LEU H 1.0 . 4.70 1017 1016 A 83 GLN HA A 84 ALA H 1.0 . 3.16 1018 1017 A 65 ARG H A 65 ARG HBx 1.0 . 3.92 1019 1018 A 76 ALA H A 75 ASN H 1.0 . 3.55 1020 1019 A 24 GLY H A 22 ILE H 1.0 . 4.62 1021 1020 A 39 GLN HBy A 40 ALA H 1.0 . 3.79 1022 1021 A 74 TYR H A 73 SER H 1.0 . 4.94 1023 1022 A 101 ARG HBx A 101 ARG H 1.0 . 3.99 1024 1023 A 58 ALA HA A 59 VAL H 1.0 . 3.27 1025 1024 A 96 GLY H A 95 GLU H 1.0 . 2.96 1026 1025 A 67 ARG H A 67 ARG HGx 1.0 . 4.57 1027 1026 A 31 GLU H A 31 GLU HBx 1.0 . 4.04 1028 1027 A 36 LEU HBx A 33 ASN HD21 1.0 . 4.55 1029 1028 A 14 LEU HBx A 14 LEU H 1.0 . 3.73 1030 1029 A 66 THR H A 64 GLY HAy 1.0 . 4.62 1031 1030 A 101 ARG H A 100 LEU H 1.0 . 4.89 1032 1031 A 101 ARG HBx A 99 GLN HE21 1.0 . 4.84 1033 1032 A 14 LEU HA A 17 ALA H 1.0 . 4.29 1034 1033 A 66 THR H A 65 ARG HBy 1.0 . 4.24 1035 1034 A 39 GLN H A 38 ASP HBx 1.0 . 3.63 1036 1035 A 59 VAL HA A 31 GLU H 1.0 . 4.17 1037 1036 A 28 TRP HD1 A 28 TRP H 1.0 . 4.51 1038 1037 A 25 LEU HBy A 25 LEU H 1.0 . 3.67 1039 1038 A 23 ASP HA A 99 GLN H 1.0 . 4.44 1040 1039 A 50 PHE HE% A 40 ALA H 1.0 . 4.61 1041 1040 A 5 THR HB A 5 THR H 1.0 . 3.57 1042 1041 A 89 TRP H A 89 TRP HBy 1.0 . 4.05 1043 1042 A 42 LEU H A 41 ASP HBx 1.0 . 3.69 1044 1043 A 18 ASP H A 104 GLY HAy 1.0 . 4.23 1045 1044 A 14 LEU HG A 15 GLU H 1.0 . 4.37 1046 1045 A 5 THR H A 4 MET HBx 1.0 . 4.24 1047 1046 A 4 MET HGx A 4 MET H 1.0 . 4.40 1048 1047 A 43 ALA H A 41 ASP H 1.0 . 4.33 1049 1048 A 98 TYR HA A 99 GLN H 1.0 . 3.12 1050 1049 A 91 LEU HDy% A 81 GLU H 1.0 . 5.04 1051 1050 A 74 TYR HA A 77 VAL H 1.0 . 4.35 1052 1051 A 27 ALA HB% A 27 ALA H 1.0 . 3.85 1053 1052 A 4 MET HGx A 5 THR H 1.0 . 5.40 1054 1053 A 89 TRP H A 88 SER HBx 1.0 . 3.82 1055 1054 A 47 ASP H A 47 ASP HBx 1.0 . 3.70 1056 1055 A 98 TYR HE% A 70 TRP HE1 1.0 . 3.80 1057 1056 A 97 ALA HA A 98 TYR H 1.0 . 3.21 1058 1057 A 15 GLU HB2 A 16 THR H 1.0 . 3.67 1059 1058 A 51 ALA HB% A 53 GLU H 1.0 . 4.98 1060 1059 A 23 ASP H A 99 GLN HBy 1.0 . 4.51 1061 1060 A 30 PHE HE% A 31 GLU H 1.0 . 5.07 1062 1061 A 59 VAL HA A 30 PHE H 1.0 . 4.65 1063 1062 A 67 ARG H A 67 ARG HGy 1.0 . 4.57 1064 1063 A 102 CYS HA A 21 GLU H 1.0 . 4.53 1065 1064 A 75 ASN HD21 A 76 ALA H 1.0 . 5.06 1066 1065 A 13 GLU H A 13 GLU HBy 1.0 . 3.81 1067 1066 A 70 TRP H A 59 VAL HGx% 1.0 . 5.13 1068 1067 A 46 ALA HB% A 48 GLN HE21 1.0 . 3.91 1069 1068 A 98 TYR HE% A 98 TYR H 1.0 . 4.70 1070 1069 A 69 GLU HA A 59 VAL H 1.0 . 4.70 1071 1070 A 93 THR HG2% A 97 ALA H 1.0 . 4.93 1072 1071 A 36 LEU HDy% A 52 SER H 1.0 . 5.04 1073 1072 A 91 LEU H A 90 ARG HBy 1.0 . 4.56 1074 1073 A 103 LEU HA A 104 GLY H 1.0 . 3.11 1075 1074 A 22 ILE HD1% A 23 ASP H 1.0 . 5.68 1076 1075 A 31 GLU H A 30 PHE HBy 1.0 . 3.80 1077 1076 A 90 ARG HA A 83 GLN HE22 1.0 . 5.47 1078 1077 A 50 PHE H A 51 ALA H 1.0 . 4.10 1079 1078 A 46 ALA H A 48 GLN H 1.0 . 3.90 1080 1079 A 57 LEU H A 58 ALA H 1.0 . 4.53 1081 1080 A 78 MET H A 79 GLU H 1.0 . 3.43 1082 1081 A 57 LEU H A 57 LEU HBy 1.0 . 3.99 1083 1082 A 50 PHE HD% A 44 ALA H 1.0 . 5.03 1084 1083 A 101 ARG HA A 89 TRP H 1.0 . 4.79 1085 1084 A 72 PHE H A 72 PHE HBy 1.0 . 4.10 1086 1085 A 59 VAL HB A 59 VAL H 1.0 . 3.83 1087 1086 A 60 GLU H A 61 SER H 1.0 . 5.41 1088 1087 A 98 TYR H A 97 ALA H 1.0 . 4.15 1089 1088 A 21 GLU H A 20 LEU HDx% 1.0 . 4.45 1090 1089 A 9 TYR HA A 11 LEU H 1.0 . 4.80 1091 1090 A 40 ALA H A 39 GLN H 1.0 . 3.31 1092 1091 A 14 LEU H A 14 LEU HDx% 1.0 . 3.74 1093 1092 A 79 GLU H A 79 GLU HGy 1.0 . 3.46 1094 1093 A 71 ARG HA A 72 PHE H 1.0 . 3.16 1095 1094 A 84 ALA H A 86 GLY H 1.0 . 4.88 1096 1095 A 38 ASP H A 38 ASP HBy 1.0 . 3.48 1097 1096 A 102 CYS H A 101 ARG HGy 1.0 . 4.47 1098 1097 A 4 MET H A 5 THR H 1.0 . 4.03 1099 1098 A 42 LEU H A 39 GLN H 1.0 . 4.90 1100 1099 A 39 GLN H A 41 ASP H 1.0 . 4.48 1101 1100 A 16 THR H A 15 GLU H 1.0 . 3.46 1102 1101 A 9 TYR HD% A 10 LEU H 1.0 . 4.66 1103 1102 A 48 GLN H A 47 ASP HBy 1.0 . 4.22 1104 1103 A 29 ARG HD2 A 30 PHE H 1.0 . 4.60 1105 1104 A 14 LEU HBx A 15 GLU H 1.0 . 4.04 1106 1105 A 68 ARG H A 67 ARG HBx 1.0 . 4.45 1107 1106 A 75 ASN HD22 A 75 ASN HBy 1.0 . 3.99 1108 1107 A 76 ALA HB% A 78 MET H 1.0 . 4.66 1109 1108 A 4 MET H A 4 MET HBy 1.0 . 3.93 1110 1109 A 91 LEU HDy% A 100 LEU H 1.0 . 4.57 1111 1110 A 56 VAL HA A 33 ASN HD21 1.0 . 4.76 1112 1111 A 51 ALA HB% A 51 ALA H 1.0 . 3.22 1113 1112 A 18 ASP H A 17 ALA H 1.0 . 4.25 1114 1113 A 98 TYR HD% A 98 TYR H 1.0 . 3.67 1115 1114 A 48 GLN H A 44 ALA HA 1.0 . 3.59 1116 1115 A 85 ASP HBy A 86 GLY H 1.0 . 4.42 1117 1116 A 41 ASP H A 41 ASP HBy 1.0 . 3.34 1118 1117 A 10 LEU HA A 14 LEU H 1.0 . 4.69 1119 1118 A 22 ILE HG2% A 70 TRP HE1 1.0 . 4.56 1120 1119 A 42 LEU H A 41 ASP HBy 1.0 . 3.69 1121 1120 A 17 ALA HA A 16 THR H 1.0 . 4.64 1122 1121 A 67 ARG H A 66 THR H 1.0 . 4.38 1123 1122 A 56 VAL HGx% A 77 VAL H 1.0 . 3.85 1124 1123 A 23 ASP H A 99 GLN HBx 1.0 . 4.65 1125 1124 A 89 TRP HZ2 A 10 LEU H 1.0 . 4.96 1126 1125 A 58 ALA H A 31 GLU H 1.0 . 3.89 1127 1126 A 39 GLN HA A 43 ALA H 1.0 . 4.56 1128 1127 A 99 GLN HGx A 100 LEU H 1.0 . 4.08 1129 1128 A 62 LEU HA A 63 ASP H 1.0 . 3.29 1130 1129 A 47 ASP H A 44 ALA HA 1.0 . 3.69 1131 1130 A 4 MET H A 3 HIS HBy 1.0 . 4.36 1132 1131 A 35 ASN H A 34 GLU HBx 1.0 . 3.85 1133 1132 A 42 LEU H A 41 ASP H 1.0 . 3.30 1134 1133 A 47 ASP H A 47 ASP HBy 1.0 . 3.70 1135 1134 A 45 GLU H A 42 LEU H 1.0 . 4.80 1136 1135 A 53 GLU H A 52 SER H 1.0 . 4.30 1137 1136 A 74 TYR H A 75 ASN H 1.0 . 3.87 1138 1137 A 97 ALA HA A 92 THR H 1.0 . 4.87 1139 1138 A 93 THR HG2% A 93 THR H 1.0 . 3.58 1140 1139 A 66 THR HB A 66 THR H 1.0 . 3.27 1141 1140 A 13 GLU H A 12 ASP HBy 1.0 . 3.95 1142 1141 A 31 GLU HA A 32 LEU H 1.0 . 3.29 1143 1142 A 30 PHE HD% A 30 PHE H 1.0 . 3.75 1144 1143 A 50 PHE H A 49 PRO HBy 1.0 . 3.51 1145 1144 A 19 MET H A 103 LEU H 1.0 . 3.62 1146 1145 A 92 THR HA A 98 TYR H 1.0 . 3.93 1147 1146 A 88 SER HA A 87 GLU H 1.0 . 5.30 1148 1147 A 65 ARG HA A 64 GLY H 1.0 . 4.98 1149 1148 A 36 LEU HDx% A 39 GLN HE22 1.0 . 4.31 1150 1149 A 105 ALA HA A 105 ALA H 1.0 . 2.88 1151 1150 A 84 ALA HA A 86 GLY H 1.0 . 3.88 1152 1151 A 83 GLN H A 90 ARG H 1.0 . 4.36 1153 1152 A 112 ASP H A 111 GLU H 1.0 . 3.93 1154 1153 A 72 PHE H A 72 PHE HBx 1.0 . 4.10 1155 1154 A 60 GLU H A 60 GLU HBy 1.0 . 3.93 1156 1155 A 108 ALA HB% A 109 SER H 1.0 . 4.01 1157 1156 A 98 TYR HD% A 96 GLY H 1.0 . 4.91 1158 1157 A 60 GLU HA A 70 TRP H 1.0 . 4.72 1159 1158 A 70 TRP HBy A 71 ARG H 1.0 . 4.05 1160 1159 A 91 LEU HDy% A 80 ALA H 1.0 . 4.55 1161 1160 A 87 GLU HA A 86 GLY H 1.0 . 4.85 1162 1161 A 36 LEU HA A 40 ALA H 1.0 . 4.58 1163 1162 A 93 THR HB A 96 GLY H 1.0 . 4.67 1164 1163 A 33 ASN HA A 35 ASN H 1.0 . 4.13 1165 1164 A 103 LEU HG A 103 LEU H 1.0 . 3.34 1166 1165 A 11 LEU HBy A 11 LEU H 1.0 . 3.60 1167 1166 A 48 GLN H A 47 ASP HA 1.0 . 3.15 1168 1167 A 90 ARG H A 83 GLN HE22 1.0 . 4.24 1169 1168 A 98 TYR HD% A 99 GLN H 1.0 . 4.26 1170 1169 A 29 ARG HGy A 30 PHE H 1.0 . 4.01 1171 1170 A 74 TYR HBy A 74 TYR H 1.0 . 3.78 1172 1171 A 16 THR H A 14 LEU H 1.0 . 4.80 1173 1172 A 57 LEU H A 57 LEU HBx 1.0 . 3.99 1174 1173 A 89 TRP HH2 A 10 LEU H 1.0 . 4.46 1175 1174 A 76 ALA HB% A 73 SER H 1.0 . 3.74 1176 1175 A 16 THR HG2% A 15 GLU H 1.0 . 4.39 1177 1176 A 39 GLN HBx A 40 ALA H 1.0 . 3.62 1178 1177 A 4 MET H A 4 MET HBx 1.0 . 3.93 1179 1178 A 101 ARG HBy A 101 ARG H 1.0 . 3.61 1180 1179 A 82 PRO HBy A 83 GLN H 1.0 . 4.06 1181 1180 A 57 LEU HA A 59 VAL H 1.0 . 5.19 1182 1181 A 19 MET H A 104 GLY HAy 1.0 . 5.07 1183 1182 A 10 LEU H A 9 TYR HBx 1.0 . 4.62 1184 1183 A 100 LEU HA A 23 ASP H 1.0 . 4.73 1185 1184 A 36 LEU HBy A 33 ASN HD21 1.0 . 4.57 1186 1185 A 14 LEU HG A 14 LEU H 1.0 . 3.45 1187 1186 A 33 ASN HD22 A 55 TRP HE1 1.0 . 4.30 1188 1187 A 57 LEU H A 72 PHE H 1.0 . 4.20 1189 1188 A 15 GLU HA A 17 ALA H 1.0 . 4.45 1190 1189 A 39 GLN H A 38 ASP HBy 1.0 . 3.63 1191 1190 A 22 ILE HB A 23 ASP H 1.0 . 4.90 1192 1191 A 9 TYR H A 9 TYR HBx 1.0 . 4.02 1193 1192 A 72 PHE H A 56 VAL H 1.0 . 4.82 1194 1193 A 99 GLN HE22 A 99 GLN HBx 1.0 . 4.99 1195 1194 A 43 ALA HB% A 43 ALA H 1.0 . 2.80 1196 1195 A 100 LEU H A 99 GLN HBx 1.0 . 4.44 1197 1196 A 36 LEU H A 34 GLU H 1.0 . 4.46 1198 1197 A 50 PHE H A 50 PHE HBy 1.0 . 3.33 1199 1198 A 20 LEU HBy A 21 GLU H 1.0 . 4.10 1200 1199 A 89 TRP HE1 A 13 GLU HBx 1.0 . 5.29 1201 1200 A 35 ASN H A 34 GLU HGy 1.0 . 4.38 1202 1201 A 15 GLU H A 14 LEU HDx% 1.0 . 4.54 1203 1202 A 72 PHE H A 71 ARG H 1.0 . 4.02 1204 1203 A 52 SER H A 53 GLU HGy 1.0 . 5.35 1205 1204 A 70 TRP H A 59 VAL HGy% 1.0 . 5.13 1206 1205 A 40 ALA H A 41 ASP H 1.0 . 3.30 1207 1206 A 19 MET H A 19 MET HBx 1.0 . 3.69 1208 1207 A 42 LEU HBy A 41 ASP H 1.0 . 4.28 1209 1208 A 37 LEU H A 35 ASN HA 1.0 . 4.68 1210 1209 A 100 LEU HA A 101 ARG H 1.0 . 3.24 1211 1210 A 76 ALA HB% A 75 ASN H 1.0 . 4.18 1212 1211 A 42 LEU HA A 44 ALA H 1.0 . 4.53 1213 1212 A 74 TYR HBx A 52 SER H 1.0 . 4.41 1214 1213 A 21 GLU H A 20 LEU HDy% 1.0 . 4.45 1215 1214 A 70 TRP H A 71 ARG H 1.0 . 5.15 1216 1215 A 79 GLU H A 79 GLU HBy 1.0 . 3.12 1217 1216 A 80 ALA HA A 92 THR H 1.0 . 4.50 1218 1217 A 63 ASP HA A 64 GLY H 1.0 . 3.20 1219 1218 A 14 LEU H A 13 GLU H 1.0 . 3.44 1220 1219 A 27 ALA HB% A 60 GLU H 1.0 . 4.15 1221 1220 A 16 THR H A 15 GLU HGy 1.0 . 4.77 1222 1221 A 13 GLU HGy A 13 GLU H 1.0 . 3.68 1223 1222 A 10 LEU HG A 10 LEU H 1.0 . 4.61 1224 1223 A 46 ALA HB% A 48 GLN HE22 1.0 . 4.14 1225 1224 A 90 ARG HA A 91 LEU H 1.0 . 3.26 1226 1225 A 58 ALA H A 57 LEU HBy 1.0 . 4.59 1227 1226 A 86 GLY H A 85 ASP H 1.0 . 3.21 1228 1227 A 102 CYS H A 101 ARG HGx 1.0 . 4.47 1229 1228 A 90 ARG HA A 83 GLN HE21 1.0 . 5.47 1230 1229 A 92 THR HA A 97 ALA H 1.0 . 4.37 1231 1230 A 105 ALA H A 18 ASP HA 1.0 . 5.27 1232 1231 A 102 CYS HA A 103 LEU H 1.0 . 3.14 1233 1232 A 34 GLU HA A 36 LEU H 1.0 . 4.37 1234 1233 A 61 SER H A 60 GLU HG2 1.0 . 4.36 1235 1233 A 60 GLU HG3 A 61 SER H 1.0 . 4.36 1236 1234 A 22 ILE HG2% A 22 ILE H 1.0 . 3.82 1237 1235 A 74 TYR HA A 78 MET H 1.0 . 4.93 1238 1236 A 88 SER HA A 89 TRP H 1.0 . 3.39 1239 1237 A 70 TRP HZ3 A 61 SER H 1.0 . 4.67 1240 1238 A 15 GLU H A 17 ALA H 1.0 . 4.49 1241 1239 A 57 LEU H A 71 ARG HA 1.0 . 5.06 1242 1240 A 56 VAL HB A 56 VAL H 1.0 . 4.20 1243 1241 A 93 THR HG2% A 73 SER H 1.0 . 4.74 1244 1242 A 15 GLU H A 32 LEU HDy% 1.0 . 4.91 1245 1243 A 90 ARG H A 89 TRP HE3 1.0 . 4.06 1246 1244 A 46 ALA HB% A 48 GLN H 1.0 . 3.38 1247 1245 A 79 GLU H A 80 ALA H 1.0 . 3.16 1248 1246 A 22 ILE HB A 22 ILE H 1.0 . 3.98 1249 1247 A 70 TRP HBy A 59 VAL H 1.0 . 4.62 1250 1248 A 56 VAL HA A 33 ASN HD22 1.0 . 4.76 1251 1249 A 11 LEU H A 10 LEU H 1.0 . 3.99 1252 1250 A 53 GLU H A 75 ASN HD21 1.0 . 5.47 1253 1251 A 10 LEU HG A 14 LEU H 1.0 . 4.42 1254 1252 A 58 ALA HA A 72 PHE H 1.0 . 4.15 1255 1253 A 83 GLN H A 85 ASP H 1.0 . 4.87 1256 1254 A 98 TYR HE% A 93 THR H 1.0 . 4.47 1257 1255 A 67 ARG H A 67 ARG HBx 1.0 . 3.63 1258 1256 A 101 ARG HBy A 102 CYS H 1.0 . 4.43 1259 1257 A 6 THR HG2% A 8 ARG H 1.0 . 5.04 1260 1258 A 80 ALA HB% A 80 ALA H 1.0 . 2.88 1261 1259 A 63 ASP HBy A 63 ASP H 1.0 . 3.66 1262 1260 A 63 ASP H A 62 LEU HDx% 1.0 . 4.75 1263 1261 A 68 ARG HA A 69 GLU H 1.0 . 2.95 1264 1262 A 93 THR H A 94 GLY H 1.0 . 4.43 1265 1263 A 74 TYR HD% A 78 MET H 1.0 . 5.28 1266 1264 A 27 ALA H A 28 TRP H 1.0 . 5.20 1267 1265 A 74 TYR HD% A 74 TYR H 1.0 . 4.31 1268 1266 A 80 ALA HB% A 79 GLU H 1.0 . 4.04 1269 1267 A 68 ARG H A 69 GLU H 1.0 . 4.64 1270 1268 A 94 GLY H A 95 GLU H 1.0 . 3.44 1271 1269 A 17 ALA HB% A 18 ASP H 1.0 . 3.40 1272 1270 A 51 ALA HB% A 52 SER H 1.0 . 3.19 1273 1271 A 41 ASP H A 41 ASP HBx 1.0 . 3.34 1274 1272 A 11 LEU HA A 14 LEU H 1.0 . 4.18 1275 1273 A 60 GLU H A 30 PHE HBx 1.0 . 4.94 1276 1274 A 16 THR H A 16 THR HB 1.0 . 3.85 1277 1275 A 13 GLU HGx A 13 GLU H 1.0 . 3.89 1278 1276 A 34 GLU H A 34 GLU HBy 1.0 . 3.57 1279 1277 A 22 ILE HD1% A 70 TRP HE1 1.0 . 5.34 1280 1278 A 91 LEU HA A 80 ALA H 1.0 . 4.87 1281 1279 A 34 GLU H A 34 GLU HBx 1.0 . 3.57 1282 1280 A 71 ARG HBx A 72 PHE H 1.0 . 3.97 1283 1281 A 82 PRO HA A 83 GLN HE22 1.0 . 5.05 1284 1282 A 40 ALA HB% A 41 ASP H 1.0 . 3.30 1285 1283 A 36 LEU H A 38 ASP H 1.0 . 4.52 1286 1284 A 99 GLN HGy A 100 LEU H 1.0 . 4.41 1287 1285 A 66 THR H A 65 ARG HBx 1.0 . 4.24 1288 1286 A 93 THR HG2% A 96 GLY H 1.0 . 4.38 1289 1287 A 93 THR H A 92 THR H 1.0 . 4.34 1290 1288 A 5 THR HA A 7 GLN H 1.0 . 4.36 1291 1289 A 29 ARG HA A 30 PHE H 1.0 . 2.98 1292 1290 A 77 VAL HA A 79 GLU H 1.0 . 4.67 1293 1291 A 98 TYR HBy A 99 GLN H 1.0 . 3.84 1294 1292 A 57 LEU HA A 58 ALA H 1.0 . 3.44 1295 1293 A 97 ALA HA A 93 THR H 1.0 . 3.81 1296 1294 A 15 GLU H A 32 LEU HDx% 1.0 . 4.91 1297 1295 A 98 TYR HBy A 98 TYR H 1.0 . 4.10 1298 1296 A 81 GLU HGy A 81 GLU H 1.0 . 3.99 1299 1297 A 91 LEU HDy% A 89 TRP H 1.0 . 5.30 1300 1298 A 36 LEU HBy A 33 ASN HD22 1.0 . 4.57 1301 1299 A 98 TYR HE% A 96 GLY H 1.0 . 4.18 1302 1300 A 79 GLU HBx A 80 ALA H 1.0 . 4.18 1303 1301 A 16 THR HG2% A 17 ALA H 1.0 . 4.29 1304 1302 A 72 PHE HZ A 70 TRP HE1 1.0 . 5.61 1305 1303 A 60 GLU HA A 68 ARG H 1.0 . 5.38 1306 1304 A 33 ASN HD21 A 55 TRP HE1 1.0 . 4.30 1307 1305 A 70 TRP HA A 71 ARG H 1.0 . 3.04 1308 1306 A 80 ALA H A 77 VAL HGy% 1.0 . 4.87 1309 1307 A 66 THR HA A 67 ARG H 1.0 . 3.05 1310 1308 A 33 ASN HA A 34 GLU H 1.0 . 3.13 1311 1309 A 73 SER H A 56 VAL H 1.0 . 5.32 1312 1310 A 4 MET HA A 5 THR H 1.0 . 2.87 1313 1311 A 51 ALA HB% A 50 PHE H 1.0 . 4.80 1314 1312 A 36 LEU H A 34 GLU HBy 1.0 . 4.88 1315 1313 A 49 PRO HBx A 50 PHE H 1.0 . 3.58 1316 1314 A 83 GLN H A 83 GLN HE21 1.0 . 4.48 1317 1315 A 93 THR HA A 94 GLY H 1.0 . 3.37 1318 1316 A 23 ASP H A 22 ILE H 1.0 . 4.95 1319 1317 A 76 ALA HA A 79 GLU H 1.0 . 3.90 1320 1318 A 39 GLN HBx A 41 ASP H 1.0 . 4.83 1321 1319 A 22 ILE HA A 101 ARG H 1.0 . 4.31 1322 1320 A 72 PHE HE% A 59 VAL H 1.0 . 5.52 1323 1321 A 77 VAL H A 75 ASN H 1.0 . 4.68 1324 1322 A 19 MET H A 104 GLY HAx 1.0 . 4.47 1325 1323 A 36 LEU HDx% A 52 SER H 1.0 . 4.72 1326 1324 A 96 GLY H A 97 ALA H 1.0 . 3.80 1327 1325 A 14 LEU HBy A 14 LEU H 1.0 . 3.55 1328 1326 A 30 PHE HD% A 20 LEU H 1.0 . 5.31 1329 1327 A 101 ARG H A 21 GLU H 1.0 . 3.85 1330 1328 A 39 GLN H A 39 GLN HGy 1.0 . 3.54 1331 1329 A 73 SER HA A 55 TRP H 1.0 . 4.55 1332 1330 A 9 TYR H A 9 TYR HBy 1.0 . 4.02 1333 1331 A 99 GLN HGx A 99 GLN HE22 1.0 . 3.90 1334 1332 A 42 LEU HBy A 43 ALA H 1.0 . 3.47 1335 1333 A 112 ASP H A 113 GLU H 1.0 . 4.57 1336 1334 A 25 LEU HBx A 25 LEU H 1.0 . 3.55 1337 1335 A 80 ALA H A 79 GLU HGx 1.0 . 4.42 1338 1336 A 22 ILE HG2% A 99 GLN H 1.0 . 4.72 1339 1337 A 35 ASN H A 34 GLU HGx 1.0 . 4.38 1340 1338 A 54 ASP H A 54 ASP HBx 1.0 . 3.36 1341 1339 A 39 GLN HA A 42 LEU H 1.0 . 3.91 1342 1340 A 82 PRO HA A 89 TRP HE1 1.0 . 5.76 1343 1341 A 74 TYR HE% A 52 SER H 1.0 . 3.41 1344 1342 A 53 GLU H A 52 SER HBx 1.0 . 4.37 1345 1343 A 28 TRP HBx A 28 TRP H 1.0 . 4.02 1346 1344 A 99 GLN HE21 A 88 SER HBx 1.0 . 4.78 1347 1345 A 86 GLY H A 83 GLN HBy 1.0 . 4.69 1348 1346 A 10 LEU H A 9 TYR HBy 1.0 . 4.62 1349 1347 A 35 ASN H A 34 GLU H 1.0 . 3.30 1350 1348 A 79 GLU H A 78 MET HBy 1.0 . 3.85 1351 1349 A 98 TYR HBx A 99 GLN H 1.0 . 4.14 1352 1350 A 55 TRP HE1 A 54 ASP HBy 1.0 . 5.82 1353 1351 A 80 ALA H A 79 GLU HBy 1.0 . 3.86 1354 1352 A 45 GLU H A 46 ALA H 1.0 . 3.16 1355 1353 A 57 LEU HG A 58 ALA H 1.0 . 4.48 1356 1354 A 16 THR H A 15 GLU HGx 1.0 . 4.77 1357 1355 A 52 SER H A 75 ASN H 1.0 . 3.91 1358 1356 A 78 MET H A 76 ALA H 1.0 . 4.13 1359 1357 A 10 LEU H A 10 LEU HBx 1.0 . 3.97 1360 1358 A 91 LEU HDx% A 91 LEU H 1.0 . 4.82 1361 1359 A 89 TRP HA A 90 ARG H 1.0 . 3.53 1362 1360 A 21 GLU H A 27 ALA H 1.0 . 4.96 1363 1361 A 36 LEU H A 37 LEU H 1.0 . 3.40 1364 1362 A 91 LEU HA A 92 THR H 1.0 . 3.01 1365 1363 A 85 ASP H A 83 GLN HBx 1.0 . 3.76 1366 1364 A 56 VAL HGy% A 37 LEU H 1.0 . 4.28 1367 1365 A 84 ALA H A 83 GLN HE21 1.0 . 5.44 1368 1366 A 71 ARG HGx A 71 ARG H 1.0 . 4.59 1369 1367 A 19 MET H A 105 ALA H 1.0 . 4.83 1370 1368 A 36 LEU HA A 39 GLN H 1.0 . 3.96 1371 1369 A 81 GLU H A 90 ARG HBx 1.0 . 4.40 1372 1370 A 12 ASP H A 12 ASP HBx 1.0 . 3.83 1373 1371 A 8 ARG HA A 9 TYR H 1.0 . 3.23 1374 1372 A 32 LEU HA A 33 ASN H 1.0 . 3.40 1375 1373 A 76 ALA HA A 78 MET H 1.0 . 4.89 1376 1374 A 92 THR HA A 93 THR H 1.0 . 2.90 1377 1375 A 36 LEU HDy% A 74 TYR H 1.0 . 4.28 1378 1376 A 89 TRP HA A 83 GLN HE21 1.0 . 4.71 1379 1377 A 93 THR HB A 94 GLY H 1.0 . 3.44 1380 1378 A 111 GLU H A 110 GLY H 1.0 . 3.79 1381 1379 A 11 LEU HBy A 12 ASP H 1.0 . 4.22 1382 1380 A 68 ARG H A 62 LEU HDx% 1.0 . 5.66 1383 1381 A 32 LEU H A 32 LEU HDy% 1.0 . 4.08 1384 1382 A 64 GLY H A 66 THR H 1.0 . 4.91 1385 1383 A 96 GLY H A 94 GLY H 1.0 . 4.23 1386 1384 A 108 ALA HB% A 108 ALA H 1.0 . 3.25 1387 1385 A 77 VAL H A 76 ALA H 1.0 . 3.44 1388 1386 A 23 ASP H A 99 GLN H 1.0 . 4.33 1389 1387 A 87 GLU H A 85 ASP H 1.0 . 4.31 1390 1388 A 39 GLN HBy A 39 GLN H 1.0 . 3.55 1391 1389 A 99 GLN H A 99 GLN HBx 1.0 . 3.62 1392 1390 A 47 ASP H A 46 ALA H 1.0 . 3.12 1393 1391 A 102 CYS H A 103 LEU H 1.0 . 4.84 1394 1392 A 63 ASP HBx A 64 GLY H 1.0 . 4.19 1395 1393 A 56 VAL HGx% A 56 VAL H 1.0 . 3.82 1396 1394 A 22 ILE HG2% A 25 LEU H 1.0 . 4.94 1397 1395 A 76 ALA HB% A 80 ALA H 1.0 . 4.87 1398 1396 A 90 ARG H A 89 TRP HBx 1.0 . 4.49 1399 1397 A 89 TRP HE1 A 89 TRP H 1.0 . 5.67 1400 1398 A 42 LEU HBx A 42 LEU H 1.0 . 3.25 1401 1399 A 38 ASP H A 38 ASP HBx 1.0 . 3.48 1402 1400 A 44 ALA H A 42 LEU H 1.0 . 4.04 1403 1401 A 66 THR HG2% A 66 THR H 1.0 . 3.80 1404 1402 A 67 ARG HA A 68 ARG H 1.0 . 3.52 1405 1403 A 76 ALA HB% A 79 GLU H 1.0 . 4.52 1406 1404 A 98 TYR HE% A 95 GLU H 1.0 . 4.95 1407 1405 A 100 LEU H A 100 LEU HBx 1.0 . 4.02 1408 1406 A 43 ALA H A 42 LEU H 1.0 . 3.25 1409 1407 A 58 ALA H A 57 LEU HDy% 1.0 . 4.63 1410 1408 A 59 VAL HB A 70 TRP H 1.0 . 4.34 1411 1409 A 91 LEU HA A 81 GLU H 1.0 . 4.35 1412 1410 A 23 ASP H A 25 LEU H 1.0 . 5.22 1413 1411 A 61 SER H A 60 GLU HBy 1.0 . 4.57 1414 1412 A 6 THR HG2% A 6 THR H 1.0 . 3.31 1415 1413 A 99 GLN H A 99 GLN HBy 1.0 . 3.60 1416 1414 A 57 LEU HA A 56 VAL H 1.0 . 5.29 1417 1415 A 65 ARG H A 65 ARG HBy 1.0 . 3.92 1418 1416 A 4 MET H A 3 HIS HBy 1.0 . 3.81 1419 1416 A 4 MET H A 3 HIS HBx 1.0 . 3.81 1420 1417 A 4 MET H A 4 MET HBx 1.0 . 3.24 1421 1417 A 4 MET H A 4 MET HBy 1.0 . 3.24 1422 1418 A 5 THR H A 4 MET HBx 1.0 . 3.60 1423 1418 A 5 THR H A 4 MET HBy 1.0 . 3.60 1424 1419 A 5 THR HA A 4 MET HBx 1.0 . 5.19 1425 1419 A 5 THR HA A 4 MET HBy 1.0 . 5.19 1426 1420 A 6 THR H A 4 MET HBx 1.0 . 4.22 1427 1420 A 6 THR H A 4 MET HBy 1.0 . 4.22 1428 1421 A 6 THR HA A 8 ARG HGx 1.0 . 4.89 1429 1421 A 6 THR HA A 8 ARG HGy 1.0 . 4.89 1430 1422 A 6 THR HG2% A 7 GLN HBx 1.0 . 5.01 1431 1422 A 6 THR HG2% A 7 GLN HB3 1.0 . 5.01 1432 1423 A 6 THR HG2% A 7 GLN HGx 1.0 . 5.42 1433 1423 A 6 THR HG2% A 7 GLN HGy 1.0 . 5.42 1434 1424 A 7 GLN H A 7 GLN HBx 1.0 . 2.93 1435 1424 A 7 GLN H A 7 GLN HB3 1.0 . 2.93 1436 1425 A 7 GLN H A 7 GLN HGx 1.0 . 3.77 1437 1425 A 7 GLN H A 7 GLN HGy 1.0 . 3.77 1438 1426 A 7 GLN HA A 7 GLN HGx 1.0 . 3.56 1439 1426 A 7 GLN HA A 7 GLN HGy 1.0 . 3.56 1440 1427 A 7 GLN HA A 8 ARG HGx 1.0 . 4.55 1441 1427 A 7 GLN HA A 8 ARG HGy 1.0 . 4.55 1442 1428 A 7 GLN HB3 A 7 GLN HGx 1.0 . 2.37 1443 1428 A 7 GLN HGy A 7 GLN HBx 1.0 . 2.37 1444 1428 A 7 GLN HB3 A 7 GLN HGy 1.0 . 2.37 1445 1428 A 7 GLN HBx A 7 GLN HGx 1.0 . 2.37 1446 1429 A 9 TYR HE% A 7 GLN HBx 1.0 . 4.22 1447 1429 A 9 TYR HE% A 7 GLN HB3 1.0 . 4.22 1448 1430 A 8 ARG H A 8 ARG HBx 1.0 . 2.96 1449 1430 A 8 ARG H A 8 ARG HBy 1.0 . 2.96 1450 1431 A 8 ARG H A 8 ARG HGx 1.0 . 2.84 1451 1431 A 8 ARG H A 8 ARG HGy 1.0 . 2.84 1452 1432 A 8 ARG H A 9 TYR HBy 1.0 . 4.39 1453 1432 A 8 ARG H A 9 TYR HBx 1.0 . 4.39 1454 1433 A 8 ARG H A 12 ASP HBy 1.0 . 4.48 1455 1433 A 8 ARG H A 12 ASP HBx 1.0 . 4.48 1456 1434 A 8 ARG HA A 8 ARG HGx 1.0 . 3.44 1457 1434 A 8 ARG HA A 8 ARG HGy 1.0 . 3.44 1458 1435 A 9 TYR H A 8 ARG HBx 1.0 . 3.93 1459 1435 A 9 TYR H A 8 ARG HBy 1.0 . 3.93 1460 1436 A 8 ARG HBx A 12 ASP HBy 1.0 . 4.30 1461 1436 A 8 ARG HBy A 12 ASP HBy 1.0 . 4.30 1462 1436 A 12 ASP HBx A 8 ARG HBx 1.0 . 4.30 1463 1436 A 8 ARG HBy A 12 ASP HBx 1.0 . 4.30 1464 1437 A 89 TRP HZ2 A 8 ARG HBx 1.0 . 3.69 1465 1437 A 89 TRP HZ2 A 8 ARG HBy 1.0 . 3.69 1466 1438 A 9 TYR H A 8 ARG HGx 1.0 . 4.35 1467 1438 A 9 TYR H A 8 ARG HGy 1.0 . 4.35 1468 1439 A 9 TYR H A 9 TYR HBy 1.0 . 3.49 1469 1439 A 9 TYR H A 9 TYR HBx 1.0 . 3.49 1470 1440 A 9 TYR H A 12 ASP HBy 1.0 . 4.51 1471 1440 A 9 TYR H A 12 ASP HBx 1.0 . 4.51 1472 1441 A 10 LEU H A 9 TYR HBy 1.0 . 4.03 1473 1441 A 10 LEU H A 9 TYR HBx 1.0 . 4.03 1474 1442 A 11 LEU H A 9 TYR HBy 1.0 . 4.03 1475 1442 A 11 LEU H A 9 TYR HBx 1.0 . 4.03 1476 1443 A 12 ASP H A 9 TYR HBy 1.0 . 4.45 1477 1443 A 12 ASP H A 9 TYR HBx 1.0 . 4.45 1478 1444 A 10 LEU H A 10 LEU HBx 1.0 . 3.49 1479 1444 A 10 LEU H A 10 LEU HBy 1.0 . 3.49 1480 1445 A 10 LEU H A 77 VAL HGy% 1.0 . 4.85 1481 1445 A 10 LEU H A 77 VAL HGx% 1.0 . 4.85 1482 1446 A 10 LEU HA A 10 LEU HDy% 1.0 . 3.35 1483 1446 A 10 LEU HA A 10 LEU HDx% 1.0 . 3.35 1484 1447 A 10 LEU HA A 13 GLU HBy 1.0 . 4.60 1485 1447 A 10 LEU HA A 13 GLU HBx 1.0 . 4.60 1486 1448 A 10 LEU HA A 14 LEU HDy% 1.0 . 5.06 1487 1448 A 10 LEU HA A 14 LEU HDx% 1.0 . 5.06 1488 1449 A 10 LEU HBx A 77 VAL HGy% 1.0 . 4.26 1489 1449 A 10 LEU HBy A 77 VAL HGy% 1.0 . 4.26 1490 1449 A 77 VAL HGx% A 10 LEU HBx 1.0 . 4.26 1491 1449 A 10 LEU HBy A 77 VAL HGx% 1.0 . 4.26 1492 1450 A 78 MET HE% A 10 LEU HBx 1.0 . 6.35 1493 1450 A 78 MET HE% A 10 LEU HBy 1.0 . 6.35 1494 1451 A 80 ALA HB% A 10 LEU HBx 1.0 . 4.11 1495 1451 A 80 ALA HB% A 10 LEU HBy 1.0 . 4.11 1496 1452 A 10 LEU HG A 100 LEU HDy% 1.0 . 3.99 1497 1452 A 10 LEU HG A 100 LEU HDx% 1.0 . 3.99 1498 1453 A 11 LEU HA A 10 LEU HDy% 1.0 . 5.26 1499 1453 A 11 LEU HA A 10 LEU HDx% 1.0 . 5.26 1500 1454 A 13 GLU H A 10 LEU HDy% 1.0 . 4.54 1501 1454 A 13 GLU H A 10 LEU HDx% 1.0 . 4.54 1502 1455 A 13 GLU HA A 10 LEU HDy% 1.0 . 5.20 1503 1455 A 13 GLU HA A 10 LEU HDx% 1.0 . 5.20 1504 1456 A 10 LEU HDx% A 13 GLU HBy 1.0 . 3.96 1505 1456 A 13 GLU HBx A 10 LEU HDy% 1.0 . 3.96 1506 1456 A 10 LEU HDx% A 13 GLU HBx 1.0 . 3.96 1507 1456 A 10 LEU HDy% A 13 GLU HBy 1.0 . 3.96 1508 1457 A 13 GLU HGx A 10 LEU HDy% 1.0 . 5.52 1509 1457 A 13 GLU HGx A 10 LEU HDx% 1.0 . 5.52 1510 1458 A 13 GLU HGy A 10 LEU HDy% 1.0 . 5.26 1511 1458 A 13 GLU HGy A 10 LEU HDx% 1.0 . 5.26 1512 1459 A 14 LEU H A 10 LEU HDy% 1.0 . 4.14 1513 1459 A 14 LEU H A 10 LEU HDx% 1.0 . 4.14 1514 1460 A 14 LEU HA A 10 LEU HDy% 1.0 . 5.40 1515 1460 A 14 LEU HA A 10 LEU HDx% 1.0 . 5.40 1516 1461 A 14 LEU HBy A 10 LEU HDy% 1.0 . 4.71 1517 1461 A 14 LEU HBy A 10 LEU HDx% 1.0 . 4.71 1518 1462 A 14 LEU HG A 10 LEU HDy% 1.0 . 3.76 1519 1462 A 14 LEU HG A 10 LEU HDx% 1.0 . 3.76 1520 1463 A 10 LEU HDy% A 14 LEU HDy% 1.0 . 2.88 1521 1463 A 10 LEU HDx% A 14 LEU HDy% 1.0 . 2.88 1522 1463 A 14 LEU HDx% A 10 LEU HDy% 1.0 . 2.88 1523 1463 A 10 LEU HDx% A 14 LEU HDx% 1.0 . 2.88 1524 1464 A 77 VAL HA A 10 LEU HDy% 1.0 . 4.21 1525 1464 A 77 VAL HA A 10 LEU HDx% 1.0 . 4.21 1526 1465 A 77 VAL HB A 10 LEU HDy% 1.0 . 4.65 1527 1465 A 77 VAL HB A 10 LEU HDx% 1.0 . 4.65 1528 1466 A 10 LEU HDy% A 77 VAL HGy% 1.0 . 3.45 1529 1466 A 10 LEU HDx% A 77 VAL HGy% 1.0 . 3.45 1530 1466 A 77 VAL HGx% A 10 LEU HDy% 1.0 . 3.45 1531 1466 A 77 VAL HGx% A 10 LEU HDx% 1.0 . 3.45 1532 1467 A 80 ALA H A 10 LEU HDy% 1.0 . 4.06 1533 1467 A 80 ALA H A 10 LEU HDx% 1.0 . 4.06 1534 1468 A 80 ALA HA A 10 LEU HDy% 1.0 . 5.31 1535 1468 A 80 ALA HA A 10 LEU HDx% 1.0 . 5.31 1536 1469 A 80 ALA HB% A 10 LEU HDy% 1.0 . 3.19 1537 1469 A 80 ALA HB% A 10 LEU HDx% 1.0 . 3.19 1538 1470 A 81 GLU H A 10 LEU HDy% 1.0 . 4.89 1539 1470 A 81 GLU H A 10 LEU HDx% 1.0 . 4.89 1540 1471 A 89 TRP H A 10 LEU HDy% 1.0 . 5.61 1541 1471 A 89 TRP H A 10 LEU HDx% 1.0 . 5.61 1542 1472 A 89 TRP HA A 10 LEU HDy% 1.0 . 6.84 1543 1472 A 89 TRP HA A 10 LEU HDx% 1.0 . 6.84 1544 1473 A 10 LEU HDy% A 89 TRP HBy 1.0 . 4.30 1545 1473 A 10 LEU HDx% A 89 TRP HBy 1.0 . 4.30 1546 1473 A 89 TRP HBx A 10 LEU HDy% 1.0 . 4.30 1547 1473 A 10 LEU HDx% A 89 TRP HBx 1.0 . 4.30 1548 1474 A 89 TRP HD1 A 10 LEU HDy% 1.0 . 4.03 1549 1474 A 89 TRP HD1 A 10 LEU HDx% 1.0 . 4.03 1550 1475 A 89 TRP HE1 A 10 LEU HDy% 1.0 . 4.07 1551 1475 A 89 TRP HE1 A 10 LEU HDx% 1.0 . 4.07 1552 1476 A 89 TRP HZ2 A 10 LEU HDy% 1.0 . 3.94 1553 1476 A 89 TRP HZ2 A 10 LEU HDx% 1.0 . 3.94 1554 1477 A 91 LEU HDy% A 10 LEU HDy% 1.0 . 5.11 1555 1477 A 91 LEU HDy% A 10 LEU HDx% 1.0 . 5.11 1556 1478 A 10 LEU HDx% A 100 LEU HBy 1.0 . 4.27 1557 1478 A 10 LEU HDy% A 100 LEU HBy 1.0 . 4.27 1558 1478 A 100 LEU HBx A 10 LEU HDy% 1.0 . 4.27 1559 1478 A 10 LEU HDx% A 100 LEU HBx 1.0 . 4.27 1560 1479 A 10 LEU HDy% A 100 LEU HBy 1.0 . 6.36 1561 1480 A 100 LEU HG A 10 LEU HDy% 1.0 . 7.00 1562 1480 A 100 LEU HG A 10 LEU HDx% 1.0 . 7.00 1563 1481 A 10 LEU HDy% A 100 LEU HDy% 1.0 . 3.04 1564 1481 A 10 LEU HDx% A 100 LEU HDy% 1.0 . 3.04 1565 1481 A 100 LEU HDx% A 10 LEU HDy% 1.0 . 3.04 1566 1481 A 10 LEU HDx% A 100 LEU HDx% 1.0 . 3.04 1567 1482 A 10 LEU HDy% A 102 CYS HBy 1.0 . 5.91 1568 1482 A 10 LEU HDx% A 102 CYS HBy 1.0 . 5.91 1569 1482 A 102 CYS HBx A 10 LEU HDy% 1.0 . 5.91 1570 1482 A 10 LEU HDx% A 102 CYS HBx 1.0 . 5.91 1571 1483 A 11 LEU H A 14 LEU HDy% 1.0 . 4.68 1572 1483 A 11 LEU H A 14 LEU HDx% 1.0 . 4.68 1573 1484 A 11 LEU H A 77 VAL HGy% 1.0 . 4.18 1574 1484 A 11 LEU H A 77 VAL HGx% 1.0 . 4.18 1575 1485 A 11 LEU HA A 14 LEU HDy% 1.0 . 3.68 1576 1485 A 11 LEU HA A 14 LEU HDx% 1.0 . 3.68 1577 1486 A 11 LEU HA A 77 VAL HGy% 1.0 . 4.20 1578 1486 A 11 LEU HA A 77 VAL HGx% 1.0 . 4.20 1579 1487 A 11 LEU HBx A 14 LEU HDy% 1.0 . 4.32 1580 1487 A 11 LEU HBx A 14 LEU HDx% 1.0 . 4.32 1581 1488 A 11 LEU HBx A 77 VAL HGy% 1.0 . 3.92 1582 1488 A 11 LEU HBx A 77 VAL HGx% 1.0 . 3.92 1583 1489 A 11 LEU HBy A 14 LEU HDy% 1.0 . 4.58 1584 1489 A 11 LEU HBy A 14 LEU HDx% 1.0 . 4.58 1585 1490 A 11 LEU HG A 14 LEU HDy% 1.0 . 4.16 1586 1490 A 14 LEU HDx% A 11 LEU HG 1.0 . 4.16 1587 1491 A 12 ASP HA A 15 GLU HGx 1.0 . 4.61 1588 1491 A 12 ASP HA A 15 GLU HGy 1.0 . 4.61 1589 1492 A 13 GLU H A 12 ASP HBy 1.0 . 3.46 1590 1492 A 13 GLU H A 12 ASP HBx 1.0 . 3.46 1591 1493 A 13 GLU H A 13 GLU HBy 1.0 . 3.33 1592 1493 A 13 GLU H A 13 GLU HBx 1.0 . 3.33 1593 1494 A 13 GLU H A 14 LEU HDy% 1.0 . 4.52 1594 1494 A 13 GLU H A 14 LEU HDx% 1.0 . 4.52 1595 1495 A 13 GLU HA A 102 CYS HBy 1.0 . 5.44 1596 1495 A 13 GLU HA A 102 CYS HBx 1.0 . 5.44 1597 1496 A 14 LEU H A 13 GLU HBy 1.0 . 3.81 1598 1496 A 14 LEU H A 13 GLU HBx 1.0 . 3.81 1599 1497 A 89 TRP HE1 A 13 GLU HBy 1.0 . 4.61 1600 1497 A 89 TRP HE1 A 13 GLU HBx 1.0 . 4.61 1601 1498 A 13 GLU HBy A 102 CYS HBy 1.0 . 4.02 1602 1498 A 13 GLU HBx A 102 CYS HBy 1.0 . 4.02 1603 1498 A 102 CYS HBx A 13 GLU HBy 1.0 . 4.02 1604 1498 A 13 GLU HBx A 102 CYS HBx 1.0 . 4.02 1605 1499 A 14 LEU H A 15 GLU HGx 1.0 . 4.31 1606 1499 A 14 LEU H A 15 GLU HGy 1.0 . 4.31 1607 1500 A 14 LEU HA A 14 LEU HDy% 1.0 . 3.31 1608 1500 A 14 LEU HA A 14 LEU HDx% 1.0 . 3.31 1609 1501 A 14 LEU HA A 20 LEU HDy% 1.0 . 5.17 1610 1501 A 14 LEU HA A 20 LEU HDx% 1.0 . 5.17 1611 1502 A 14 LEU HBy A 32 LEU HDy% 1.0 . 3.53 1612 1502 A 14 LEU HBy A 32 LEU HDx% 1.0 . 3.53 1613 1503 A 14 LEU HG A 32 LEU HDy% 1.0 . 4.63 1614 1503 A 14 LEU HG A 32 LEU HDx% 1.0 . 4.63 1615 1504 A 17 ALA HB% A 14 LEU HDy% 1.0 . 4.39 1616 1504 A 17 ALA HB% A 14 LEU HDx% 1.0 . 4.39 1617 1505 A 14 LEU HDy% A 20 LEU HDy% 1.0 . 3.29 1618 1505 A 14 LEU HDx% A 20 LEU HDy% 1.0 . 3.29 1619 1505 A 20 LEU HDx% A 14 LEU HDy% 1.0 . 3.29 1620 1505 A 14 LEU HDx% A 20 LEU HDx% 1.0 . 3.29 1621 1506 A 32 LEU HG A 14 LEU HDy% 1.0 . 5.12 1622 1506 A 32 LEU HG A 14 LEU HDx% 1.0 . 5.12 1623 1507 A 14 LEU HDy% A 32 LEU HDy% 1.0 . 3.32 1624 1507 A 14 LEU HDx% A 32 LEU HDy% 1.0 . 3.32 1625 1507 A 32 LEU HDx% A 14 LEU HDy% 1.0 . 3.32 1626 1507 A 14 LEU HDx% A 32 LEU HDx% 1.0 . 3.32 1627 1508 A 14 LEU HDy% A 102 CYS HBy 1.0 . 5.39 1628 1508 A 14 LEU HDx% A 102 CYS HBy 1.0 . 5.39 1629 1508 A 102 CYS HBx A 14 LEU HDy% 1.0 . 5.39 1630 1508 A 14 LEU HDx% A 102 CYS HBx 1.0 . 5.39 1631 1509 A 15 GLU H A 15 GLU HGx 1.0 . 3.22 1632 1509 A 15 GLU H A 15 GLU HGy 1.0 . 3.22 1633 1510 A 15 GLU H A 32 LEU HDy% 1.0 . 4.00 1634 1510 A 15 GLU H A 32 LEU HDx% 1.0 . 4.00 1635 1511 A 15 GLU HA A 15 GLU HGx 1.0 . 3.59 1636 1511 A 15 GLU HA A 15 GLU HGy 1.0 . 3.59 1637 1512 A 15 GLU HA A 32 LEU HDy% 1.0 . 3.58 1638 1512 A 15 GLU HA A 32 LEU HDx% 1.0 . 3.58 1639 1513 A 15 GLU HB2 A 32 LEU HDy% 1.0 . 4.84 1640 1513 A 15 GLU HB2 A 32 LEU HDx% 1.0 . 4.84 1641 1514 A 16 THR H A 15 GLU HGx 1.0 . 4.17 1642 1514 A 16 THR H A 15 GLU HGy 1.0 . 4.17 1643 1515 A 15 GLU HGy A 32 LEU HDy% 1.0 . 3.32 1644 1515 A 15 GLU HGx A 32 LEU HDy% 1.0 . 3.32 1645 1515 A 32 LEU HDx% A 15 GLU HGx 1.0 . 3.32 1646 1515 A 15 GLU HGy A 32 LEU HDx% 1.0 . 3.32 1647 1516 A 17 ALA HA A 20 LEU HDy% 1.0 . 5.46 1648 1516 A 17 ALA HA A 20 LEU HDx% 1.0 . 5.46 1649 1517 A 17 ALA HA A 102 CYS HBy 1.0 . 4.55 1650 1517 A 17 ALA HA A 102 CYS HBx 1.0 . 4.55 1651 1518 A 17 ALA HB% A 20 LEU HDy% 1.0 . 3.28 1652 1518 A 17 ALA HB% A 20 LEU HDx% 1.0 . 3.28 1653 1519 A 17 ALA HB% A 102 CYS HBy 1.0 . 3.23 1654 1519 A 17 ALA HB% A 102 CYS HBx 1.0 . 3.23 1655 1520 A 18 ASP H A 19 MET HBx 1.0 . 4.65 1656 1520 A 18 ASP H A 19 MET HBy 1.0 . 4.65 1657 1521 A 18 ASP H A 103 LEU HBx 1.0 . 4.63 1658 1521 A 18 ASP H A 103 LEU HB3 1.0 . 4.63 1659 1522 A 19 MET H A 103 LEU HBx 1.0 . 3.84 1660 1522 A 19 MET H A 103 LEU HB3 1.0 . 3.84 1661 1523 A 19 MET H A 103 LEU HDy% 1.0 . 4.68 1662 1523 A 19 MET H A 103 LEU HDx% 1.0 . 4.68 1663 1524 A 19 MET HA A 19 MET HGy 1.0 . 3.44 1664 1524 A 19 MET HA A 19 MET HGx 1.0 . 3.44 1665 1525 A 19 MET HA A 103 LEU HDy% 1.0 . 4.70 1666 1525 A 19 MET HA A 103 LEU HDx% 1.0 . 4.70 1667 1526 A 20 LEU H A 19 MET HBx 1.0 . 3.92 1668 1526 A 20 LEU H A 19 MET HBy 1.0 . 3.92 1669 1527 A 103 LEU HA A 19 MET HBx 1.0 . 5.22 1670 1527 A 103 LEU HA A 19 MET HBy 1.0 . 5.22 1671 1528 A 19 MET HBy A 103 LEU HBx 1.0 . 3.75 1672 1528 A 19 MET HBx A 103 LEU HBx 1.0 . 3.75 1673 1528 A 103 LEU HB3 A 19 MET HBx 1.0 . 3.75 1674 1528 A 19 MET HBy A 103 LEU HB3 1.0 . 3.75 1675 1529 A 103 LEU HG A 19 MET HBx 1.0 . 4.80 1676 1529 A 103 LEU HG A 19 MET HBy 1.0 . 4.80 1677 1530 A 19 MET HBx A 103 LEU HDy% 1.0 . 4.18 1678 1530 A 19 MET HBy A 103 LEU HDy% 1.0 . 4.18 1679 1530 A 103 LEU HDx% A 19 MET HBx 1.0 . 4.18 1680 1530 A 19 MET HBy A 103 LEU HDx% 1.0 . 4.18 1681 1531 A 20 LEU H A 19 MET HGy 1.0 . 4.49 1682 1531 A 20 LEU H A 19 MET HGx 1.0 . 4.49 1683 1532 A 103 LEU HA A 19 MET HGy 1.0 . 5.09 1684 1532 A 103 LEU HA A 19 MET HGx 1.0 . 5.09 1685 1533 A 19 MET HGy A 103 LEU HBx 1.0 . 3.83 1686 1533 A 19 MET HGx A 103 LEU HBx 1.0 . 3.83 1687 1533 A 103 LEU HB3 A 19 MET HGy 1.0 . 3.83 1688 1533 A 103 LEU HB3 A 19 MET HGx 1.0 . 3.83 1689 1534 A 19 MET HGx A 103 LEU HDy% 1.0 . 3.81 1690 1534 A 19 MET HGy A 103 LEU HDy% 1.0 . 3.81 1691 1534 A 103 LEU HDx% A 19 MET HGy 1.0 . 3.81 1692 1534 A 103 LEU HDx% A 19 MET HGx 1.0 . 3.81 1693 1535 A 19 MET HE% A 20 LEU HDy% 1.0 . 5.81 1694 1535 A 19 MET HE% A 20 LEU HDx% 1.0 . 5.81 1695 1536 A 19 MET HE% A 103 LEU HBx 1.0 . 3.83 1696 1536 A 19 MET HE% A 103 LEU HB3 1.0 . 3.83 1697 1537 A 20 LEU H A 20 LEU HDy% 1.0 . 4.63 1698 1537 A 20 LEU H A 20 LEU HDx% 1.0 . 4.63 1699 1538 A 20 LEU H A 103 LEU HDy% 1.0 . 5.06 1700 1538 A 20 LEU H A 103 LEU HDx% 1.0 . 5.06 1701 1539 A 20 LEU HA A 20 LEU HDy% 1.0 . 3.25 1702 1539 A 20 LEU HA A 20 LEU HDx% 1.0 . 3.25 1703 1540 A 20 LEU HA A 100 LEU HDy% 1.0 . 4.67 1704 1540 A 20 LEU HA A 100 LEU HDx% 1.0 . 4.67 1705 1541 A 20 LEU HA A 102 CYS HBy 1.0 . 4.88 1706 1541 A 20 LEU HA A 102 CYS HBx 1.0 . 4.88 1707 1542 A 20 LEU HA A 103 LEU HDy% 1.0 . 3.88 1708 1542 A 20 LEU HA A 103 LEU HDx% 1.0 . 3.88 1709 1543 A 20 LEU HG A 59 VAL HGy% 1.0 . 4.23 1710 1543 A 20 LEU HG A 59 VAL HGx% 1.0 . 4.23 1711 1544 A 30 PHE HA A 20 LEU HDy% 1.0 . 5.15 1712 1544 A 30 PHE HA A 20 LEU HDx% 1.0 . 5.15 1713 1545 A 20 LEU HDx% A 30 PHE HBy 1.0 . 3.80 1714 1545 A 20 LEU HDy% A 30 PHE HBy 1.0 . 3.80 1715 1545 A 30 PHE HBx A 20 LEU HDy% 1.0 . 3.80 1716 1545 A 20 LEU HDx% A 30 PHE HBx 1.0 . 3.80 1717 1546 A 30 PHE HD% A 20 LEU HDy% 1.0 . 3.75 1718 1546 A 30 PHE HD% A 20 LEU HDx% 1.0 . 3.75 1719 1547 A 31 GLU H A 20 LEU HDy% 1.0 . 5.28 1720 1547 A 31 GLU H A 20 LEU HDx% 1.0 . 5.28 1721 1548 A 59 VAL HA A 20 LEU HDy% 1.0 . 5.10 1722 1548 A 59 VAL HA A 20 LEU HDx% 1.0 . 5.10 1723 1549 A 20 LEU HDy% A 59 VAL HGy% 1.0 . 4.06 1724 1549 A 20 LEU HDx% A 59 VAL HGy% 1.0 . 4.06 1725 1549 A 59 VAL HGx% A 20 LEU HDy% 1.0 . 4.06 1726 1549 A 20 LEU HDx% A 59 VAL HGx% 1.0 . 4.06 1727 1550 A 101 ARG HA A 20 LEU HDy% 1.0 . 4.87 1728 1550 A 101 ARG HA A 20 LEU HDx% 1.0 . 4.87 1729 1551 A 102 CYS HA A 20 LEU HDy% 1.0 . 3.38 1730 1551 A 102 CYS HA A 20 LEU HDx% 1.0 . 3.38 1731 1552 A 20 LEU HDy% A 102 CYS HBy 1.0 . 3.90 1732 1552 A 20 LEU HDx% A 102 CYS HBy 1.0 . 3.90 1733 1552 A 102 CYS HBx A 20 LEU HDy% 1.0 . 3.90 1734 1552 A 102 CYS HBx A 20 LEU HDx% 1.0 . 3.90 1735 1553 A 103 LEU H A 20 LEU HDy% 1.0 . 4.10 1736 1553 A 103 LEU H A 20 LEU HDx% 1.0 . 4.10 1737 1554 A 21 GLU H A 21 GLU HGx 1.0 . 4.38 1738 1554 A 21 GLU H A 21 GLU HGy 1.0 . 4.38 1739 1555 A 21 GLU H A 100 LEU HDy% 1.0 . 4.67 1740 1555 A 21 GLU H A 100 LEU HDx% 1.0 . 4.67 1741 1556 A 21 GLU H A 101 ARG HGx 1.0 . 4.26 1742 1556 A 21 GLU H A 101 ARG HGy 1.0 . 4.26 1743 1557 A 21 GLU H A 103 LEU HDy% 1.0 . 4.62 1744 1557 A 21 GLU H A 103 LEU HDx% 1.0 . 4.62 1745 1558 A 21 GLU HA A 100 LEU HDy% 1.0 . 5.11 1746 1558 A 21 GLU HA A 100 LEU HDx% 1.0 . 5.11 1747 1559 A 21 GLU HA A 103 LEU HDy% 1.0 . 5.11 1748 1559 A 21 GLU HA A 103 LEU HDx% 1.0 . 5.11 1749 1560 A 22 ILE H A 21 GLU HGx 1.0 . 4.31 1750 1560 A 22 ILE H A 21 GLU HGy 1.0 . 4.31 1751 1561 A 21 GLU HGy A 103 LEU HDy% 1.0 . 4.03 1752 1561 A 21 GLU HGx A 103 LEU HDy% 1.0 . 4.03 1753 1561 A 103 LEU HDx% A 21 GLU HGx 1.0 . 4.03 1754 1561 A 103 LEU HDx% A 21 GLU HGy 1.0 . 4.03 1755 1562 A 22 ILE H A 22 ILE HG1y 1.0 . 4.40 1756 1562 A 22 ILE H A 22 ILE HG1x 1.0 . 4.40 1757 1563 A 22 ILE H A 25 LEU HDy% 1.0 . 4.65 1758 1563 A 22 ILE H A 25 LEU HDx% 1.0 . 4.65 1759 1564 A 22 ILE HA A 100 LEU HDy% 1.0 . 4.04 1760 1564 A 22 ILE HA A 100 LEU HDx% 1.0 . 4.04 1761 1565 A 22 ILE HB A 59 VAL HGy% 1.0 . 4.76 1762 1565 A 22 ILE HB A 59 VAL HGx% 1.0 . 4.76 1763 1566 A 22 ILE HG2% A 23 ASP HBx 1.0 . 5.22 1764 1566 A 22 ILE HG2% A 23 ASP HBy 1.0 . 5.22 1765 1567 A 22 ILE HG2% A 25 LEU HDy% 1.0 . 4.45 1766 1567 A 22 ILE HG2% A 25 LEU HDx% 1.0 . 4.45 1767 1568 A 23 ASP H A 22 ILE HG1y 1.0 . 4.62 1768 1568 A 23 ASP H A 22 ILE HG1x 1.0 . 4.62 1769 1569 A 22 ILE HG1y A 23 ASP HBx 1.0 . 5.07 1770 1569 A 22 ILE HG1x A 23 ASP HBx 1.0 . 5.07 1771 1569 A 23 ASP HBy A 22 ILE HG1y 1.0 . 5.07 1772 1569 A 22 ILE HG1x A 23 ASP HBy 1.0 . 5.07 1773 1570 A 22 ILE HG1y A 59 VAL HGy% 1.0 . 3.99 1774 1570 A 22 ILE HG1x A 59 VAL HGy% 1.0 . 3.99 1775 1570 A 59 VAL HGx% A 22 ILE HG1y 1.0 . 3.99 1776 1570 A 59 VAL HGx% A 22 ILE HG1x 1.0 . 3.99 1777 1571 A 98 TYR HA A 22 ILE HG1y 1.0 . 4.53 1778 1571 A 98 TYR HA A 22 ILE HG1x 1.0 . 4.53 1779 1572 A 98 TYR HD% A 22 ILE HG1y 1.0 . 4.57 1780 1572 A 98 TYR HD% A 22 ILE HG1x 1.0 . 4.57 1781 1573 A 100 LEU HA A 22 ILE HG1y 1.0 . 5.14 1782 1573 A 100 LEU HA A 22 ILE HG1x 1.0 . 5.14 1783 1574 A 22 ILE HG1x A 100 LEU HDy% 1.0 . 3.65 1784 1574 A 22 ILE HG1y A 100 LEU HDy% 1.0 . 3.65 1785 1574 A 100 LEU HDx% A 22 ILE HG1y 1.0 . 3.65 1786 1574 A 100 LEU HDx% A 22 ILE HG1x 1.0 . 3.65 1787 1575 A 22 ILE HD1% A 57 LEU HDy% 1.0 . 4.12 1788 1575 A 22 ILE HD1% A 57 LEU HDx% 1.0 . 4.12 1789 1576 A 22 ILE HD1% A 59 VAL HGy% 1.0 . 3.02 1790 1576 A 22 ILE HD1% A 59 VAL HGx% 1.0 . 3.02 1791 1577 A 22 ILE HD1% A 100 LEU HBy 1.0 . 4.85 1792 1577 A 22 ILE HD1% A 100 LEU HBx 1.0 . 4.85 1793 1578 A 22 ILE HD1% A 100 LEU HDy% 1.0 . 3.40 1794 1578 A 22 ILE HD1% A 100 LEU HDx% 1.0 . 3.40 1795 1579 A 24 GLY H A 23 ASP HBx 1.0 . 4.14 1796 1579 A 24 GLY H A 23 ASP HBy 1.0 . 4.14 1797 1580 A 25 LEU H A 23 ASP HBx 1.0 . 4.79 1798 1580 A 25 LEU H A 23 ASP HBy 1.0 . 4.79 1799 1581 A 23 ASP HBy A 25 LEU HDy% 1.0 . 4.42 1800 1581 A 23 ASP HBx A 25 LEU HDy% 1.0 . 4.42 1801 1581 A 25 LEU HDx% A 23 ASP HBx 1.0 . 4.42 1802 1581 A 25 LEU HDx% A 23 ASP HBy 1.0 . 4.42 1803 1582 A 25 LEU HA A 25 LEU HDy% 1.0 . 2.88 1804 1582 A 25 LEU HA A 25 LEU HDx% 1.0 . 2.88 1805 1583 A 26 HIS H A 25 LEU HDy% 1.0 . 4.51 1806 1583 A 26 HIS H A 25 LEU HDx% 1.0 . 4.51 1807 1584 A 61 SER HBy A 25 LEU HDy% 1.0 . 4.63 1808 1584 A 61 SER HBy A 25 LEU HDx% 1.0 . 4.63 1809 1585 A 61 SER HBx A 25 LEU HDy% 1.0 . 4.70 1810 1585 A 61 SER HBx A 25 LEU HDx% 1.0 . 4.70 1811 1586 A 63 ASP HA A 25 LEU HDy% 1.0 . 4.34 1812 1586 A 63 ASP HA A 25 LEU HDx% 1.0 . 4.34 1813 1587 A 63 ASP HBx A 25 LEU HDy% 1.0 . 4.46 1814 1587 A 63 ASP HBx A 25 LEU HDx% 1.0 . 4.46 1815 1588 A 63 ASP HBy A 25 LEU HDy% 1.0 . 3.62 1816 1588 A 63 ASP HBy A 25 LEU HDx% 1.0 . 3.62 1817 1589 A 70 TRP HZ2 A 25 LEU HDy% 1.0 . 3.49 1818 1589 A 70 TRP HZ2 A 25 LEU HDx% 1.0 . 3.49 1819 1590 A 70 TRP HH2 A 25 LEU HDy% 1.0 . 3.60 1820 1590 A 70 TRP HH2 A 25 LEU HDx% 1.0 . 3.60 1821 1591 A 26 HIS HA A 103 LEU HDy% 1.0 . 5.34 1822 1591 A 26 HIS HA A 103 LEU HDx% 1.0 . 5.34 1823 1592 A 27 ALA HA A 59 VAL HGy% 1.0 . 4.43 1824 1592 A 27 ALA HA A 59 VAL HGx% 1.0 . 4.43 1825 1593 A 28 TRP H A 59 VAL HGy% 1.0 . 4.97 1826 1593 A 28 TRP H A 59 VAL HGx% 1.0 . 4.97 1827 1594 A 28 TRP HD1 A 29 ARG HBy 1.0 . 4.05 1828 1594 A 28 TRP HD1 A 29 ARG HBx 1.0 . 4.05 1829 1595 A 28 TRP HE1 A 29 ARG HBy 1.0 . 5.79 1830 1595 A 28 TRP HE1 A 29 ARG HBx 1.0 . 5.79 1831 1596 A 30 PHE H A 59 VAL HGy% 1.0 . 4.90 1832 1596 A 30 PHE H A 59 VAL HGx% 1.0 . 4.90 1833 1597 A 30 PHE HA A 57 LEU HDy% 1.0 . 4.43 1834 1597 A 30 PHE HA A 57 LEU HDx% 1.0 . 4.43 1835 1598 A 59 VAL HA A 30 PHE HBy 1.0 . 4.66 1836 1598 A 59 VAL HA A 30 PHE HBx 1.0 . 4.66 1837 1599 A 30 PHE HBy A 59 VAL HGy% 1.0 . 3.78 1838 1599 A 30 PHE HBx A 59 VAL HGy% 1.0 . 3.78 1839 1599 A 59 VAL HGx% A 30 PHE HBy 1.0 . 3.78 1840 1599 A 59 VAL HGx% A 30 PHE HBx 1.0 . 3.78 1841 1600 A 60 GLU H A 30 PHE HBy 1.0 . 4.31 1842 1600 A 60 GLU H A 30 PHE HBx 1.0 . 4.31 1843 1601 A 30 PHE HD% A 32 LEU HBx 1.0 . 4.57 1844 1601 A 30 PHE HD% A 32 LEU HBy 1.0 . 4.57 1845 1602 A 30 PHE HD% A 32 LEU HDy% 1.0 . 3.16 1846 1602 A 30 PHE HD% A 32 LEU HDx% 1.0 . 3.16 1847 1603 A 30 PHE HE% A 32 LEU HBx 1.0 . 4.50 1848 1603 A 30 PHE HE% A 32 LEU HBy 1.0 . 4.50 1849 1604 A 30 PHE HE% A 32 LEU HDy% 1.0 . 3.65 1850 1604 A 30 PHE HE% A 32 LEU HDx% 1.0 . 3.65 1851 1605 A 31 GLU H A 57 LEU HDy% 1.0 . 3.39 1852 1605 A 31 GLU H A 57 LEU HDx% 1.0 . 3.39 1853 1606 A 31 GLU HA A 32 LEU HDy% 1.0 . 4.35 1854 1606 A 31 GLU HA A 32 LEU HDx% 1.0 . 4.35 1855 1607 A 32 LEU H A 31 GLU HBy 1.0 . 3.75 1856 1607 A 32 LEU H A 31 GLU HBx 1.0 . 3.75 1857 1608 A 55 TRP HH2 A 31 GLU HBy 1.0 . 4.55 1858 1608 A 55 TRP HH2 A 31 GLU HBx 1.0 . 4.55 1859 1609 A 58 ALA H A 31 GLU HBy 1.0 . 5.16 1860 1609 A 58 ALA H A 31 GLU HBx 1.0 . 5.16 1861 1610 A 32 LEU H A 32 LEU HBx 1.0 . 3.60 1862 1610 A 32 LEU H A 32 LEU HBy 1.0 . 3.60 1863 1611 A 32 LEU H A 37 LEU HDy% 1.0 . 4.92 1864 1611 A 32 LEU H A 37 LEU HDx% 1.0 . 4.92 1865 1612 A 32 LEU HA A 32 LEU HDy% 1.0 . 3.11 1866 1612 A 32 LEU HA A 32 LEU HDx% 1.0 . 3.11 1867 1613 A 32 LEU HA A 37 LEU HDy% 1.0 . 4.68 1868 1613 A 32 LEU HA A 37 LEU HDx% 1.0 . 4.68 1869 1614 A 32 LEU HBx A 32 LEU HDy% 1.0 . 2.74 1870 1614 A 32 LEU HBy A 32 LEU HDy% 1.0 . 2.74 1871 1614 A 32 LEU HDx% A 32 LEU HBx 1.0 . 2.74 1872 1614 A 32 LEU HDx% A 32 LEU HBy 1.0 . 2.74 1873 1615 A 32 LEU HBx A 37 LEU HDy% 1.0 . 4.24 1874 1615 A 32 LEU HBy A 37 LEU HDy% 1.0 . 4.24 1875 1615 A 37 LEU HDx% A 32 LEU HBx 1.0 . 4.24 1876 1615 A 32 LEU HBy A 37 LEU HDx% 1.0 . 4.24 1877 1616 A 33 ASN H A 32 LEU HDy% 1.0 . 3.85 1878 1616 A 33 ASN H A 32 LEU HDx% 1.0 . 3.85 1879 1617 A 37 LEU HG A 32 LEU HDy% 1.0 . 4.75 1880 1617 A 37 LEU HG A 32 LEU HDx% 1.0 . 4.75 1881 1618 A 32 LEU HDx% A 37 LEU HDy% 1.0 . 3.07 1882 1618 A 37 LEU HDx% A 32 LEU HDy% 1.0 . 3.07 1883 1618 A 32 LEU HDx% A 37 LEU HDx% 1.0 . 3.07 1884 1618 A 32 LEU HDy% A 37 LEU HDy% 1.0 . 3.07 1885 1619 A 57 LEU HA A 32 LEU HDy% 1.0 . 3.66 1886 1619 A 57 LEU HA A 32 LEU HDx% 1.0 . 3.66 1887 1620 A 33 ASN H A 33 ASN HD21 1.0 . 4.97 1888 1620 A 33 ASN HD22 A 33 ASN H 1.0 . 4.97 1889 1621 A 33 ASN H A 37 LEU HDy% 1.0 . 4.32 1890 1621 A 33 ASN H A 37 LEU HDx% 1.0 . 4.32 1891 1622 A 36 LEU H A 33 ASN HBx 1.0 . 4.83 1892 1622 A 36 LEU H A 33 ASN HBy 1.0 . 4.83 1893 1623 A 36 LEU HBx A 33 ASN HBx 1.0 . 5.77 1894 1623 A 36 LEU HBx A 33 ASN HBy 1.0 . 5.77 1895 1624 A 36 LEU HBy A 33 ASN HBx 1.0 . 5.42 1896 1624 A 36 LEU HBy A 33 ASN HBy 1.0 . 5.42 1897 1625 A 36 LEU HDy% A 33 ASN HBx 1.0 . 4.98 1898 1625 A 36 LEU HDy% A 33 ASN HBy 1.0 . 4.98 1899 1626 A 55 TRP HE1 A 33 ASN HBx 1.0 . 5.88 1900 1626 A 55 TRP HE1 A 33 ASN HBy 1.0 . 5.88 1901 1627 A 56 VAL HGy% A 33 ASN HBx 1.0 . 3.86 1902 1627 A 56 VAL HGy% A 33 ASN HBy 1.0 . 3.86 1903 1628 A 57 LEU H A 33 ASN HBx 1.0 . 5.13 1904 1628 A 57 LEU H A 33 ASN HBy 1.0 . 5.13 1905 1629 A 36 LEU HBx A 33 ASN HD21 1.0 . 3.88 1906 1629 A 36 LEU HBx A 33 ASN HD22 1.0 . 3.88 1907 1630 A 36 LEU HBy A 33 ASN HD21 1.0 . 3.94 1908 1630 A 36 LEU HBy A 33 ASN HD22 1.0 . 3.94 1909 1631 A 36 LEU HDx% A 33 ASN HD21 1.0 . 4.72 1910 1631 A 36 LEU HDx% A 33 ASN HD22 1.0 . 4.72 1911 1632 A 36 LEU HDy% A 33 ASN HD21 1.0 . 4.03 1912 1632 A 36 LEU HDy% A 33 ASN HD22 1.0 . 4.03 1913 1633 A 33 ASN HD21 A 55 TRP HE1 1.0 . 3.74 1914 1633 A 33 ASN HD22 A 55 TRP HE1 1.0 . 3.74 1915 1634 A 56 VAL HA A 33 ASN HD21 1.0 . 4.19 1916 1634 A 56 VAL HA A 33 ASN HD22 1.0 . 4.19 1917 1635 A 34 GLU H A 34 GLU HBx 1.0 . 3.09 1918 1635 A 34 GLU H A 34 GLU HBy 1.0 . 3.09 1919 1636 A 34 GLU H A 37 LEU HDy% 1.0 . 4.69 1920 1636 A 34 GLU H A 37 LEU HDx% 1.0 . 4.69 1921 1637 A 34 GLU HA A 34 GLU HGx 1.0 . 3.67 1922 1637 A 34 GLU HA A 34 GLU HGy 1.0 . 3.67 1923 1638 A 34 GLU HA A 37 LEU HBx 1.0 . 3.67 1924 1638 A 34 GLU HA A 37 LEU HBy 1.0 . 3.67 1925 1639 A 34 GLU HA A 37 LEU HDy% 1.0 . 3.74 1926 1639 A 34 GLU HA A 37 LEU HDx% 1.0 . 3.74 1927 1640 A 35 ASN H A 34 GLU HBx 1.0 . 3.36 1928 1640 A 35 ASN H A 34 GLU HBy 1.0 . 3.36 1929 1641 A 37 LEU H A 34 GLU HBx 1.0 . 4.79 1930 1641 A 37 LEU H A 34 GLU HBy 1.0 . 4.79 1931 1642 A 34 GLU HGx A 37 LEU HDy% 1.0 . 4.38 1932 1642 A 34 GLU HGy A 37 LEU HDy% 1.0 . 4.38 1933 1642 A 37 LEU HDx% A 34 GLU HGx 1.0 . 4.38 1934 1642 A 37 LEU HDx% A 34 GLU HGy 1.0 . 4.38 1935 1643 A 35 ASN H A 35 ASN HBx 1.0 . 2.81 1936 1643 A 35 ASN H A 35 ASN HBy 1.0 . 2.81 1937 1644 A 35 ASN H A 35 ASN HD21 1.0 . 4.07 1938 1644 A 35 ASN H A 35 ASN HD22 1.0 . 4.07 1939 1645 A 35 ASN HD22 A 35 ASN HA 1.0 . 4.58 1940 1645 A 35 ASN HD21 A 35 ASN HA 1.0 . 4.58 1941 1646 A 35 ASN HA A 38 ASP HBy 1.0 . 3.88 1942 1646 A 35 ASN HA A 38 ASP HBx 1.0 . 3.88 1943 1647 A 35 ASN HD22 A 35 ASN HBy 1.0 . 3.11 1944 1647 A 35 ASN HD21 A 35 ASN HBy 1.0 . 3.11 1945 1647 A 35 ASN HD22 A 35 ASN HBx 1.0 . 3.11 1946 1647 A 35 ASN HD21 A 35 ASN HBx 1.0 . 3.11 1947 1648 A 36 LEU HA A 35 ASN HBx 1.0 . 5.37 1948 1648 A 36 LEU HA A 35 ASN HBy 1.0 . 5.37 1949 1649 A 36 LEU HDx% A 35 ASN HBx 1.0 . 4.74 1950 1649 A 36 LEU HDx% A 35 ASN HBy 1.0 . 4.74 1951 1650 A 39 GLN HE21 A 35 ASN HBy 1.0 . 4.62 1952 1650 A 39 GLN HE22 A 35 ASN HBy 1.0 . 4.62 1953 1650 A 39 GLN HE22 A 35 ASN HBx 1.0 . 4.62 1954 1650 A 39 GLN HE21 A 35 ASN HBx 1.0 . 4.62 1955 1651 A 35 ASN HD22 A 39 GLN HE21 1.0 . 5.20 1956 1651 A 35 ASN HD21 A 39 GLN HE22 1.0 . 5.20 1957 1651 A 35 ASN HD21 A 39 GLN HE21 1.0 . 5.20 1958 1651 A 39 GLN HE22 A 35 ASN HD22 1.0 . 5.20 1959 1652 A 36 LEU H A 37 LEU HBx 1.0 . 4.33 1960 1652 A 36 LEU H A 37 LEU HBy 1.0 . 4.33 1961 1653 A 36 LEU H A 37 LEU HDy% 1.0 . 4.56 1962 1653 A 36 LEU H A 37 LEU HDx% 1.0 . 4.56 1963 1654 A 36 LEU HA A 39 GLN HE21 1.0 . 4.07 1964 1654 A 36 LEU HA A 39 GLN HE22 1.0 . 4.07 1965 1655 A 36 LEU HDx% A 39 GLN HGy 1.0 . 4.37 1966 1655 A 36 LEU HDx% A 39 GLN HGx 1.0 . 4.37 1967 1656 A 36 LEU HDy% A 54 ASP HBy 1.0 . 3.15 1968 1656 A 36 LEU HDy% A 54 ASP HBx 1.0 . 3.15 1969 1657 A 37 LEU H A 37 LEU HBx 1.0 . 3.22 1970 1657 A 37 LEU H A 37 LEU HBy 1.0 . 3.22 1971 1658 A 37 LEU H A 37 LEU HDy% 1.0 . 3.58 1972 1658 A 37 LEU H A 37 LEU HDx% 1.0 . 3.58 1973 1659 A 37 LEU HA A 37 LEU HDy% 1.0 . 3.00 1974 1659 A 37 LEU HA A 37 LEU HDx% 1.0 . 3.00 1975 1660 A 38 ASP H A 37 LEU HBx 1.0 . 3.59 1976 1660 A 38 ASP H A 37 LEU HBy 1.0 . 3.59 1977 1661 A 56 VAL HGy% A 37 LEU HDy% 1.0 . 3.71 1978 1661 A 56 VAL HGy% A 37 LEU HDx% 1.0 . 3.71 1979 1662 A 74 TYR HE% A 37 LEU HDy% 1.0 . 3.52 1980 1662 A 74 TYR HE% A 37 LEU HDx% 1.0 . 3.52 1981 1663 A 38 ASP H A 38 ASP HBy 1.0 . 3.01 1982 1663 A 38 ASP H A 38 ASP HBx 1.0 . 3.01 1983 1664 A 39 GLN HA A 38 ASP HBy 1.0 . 4.66 1984 1664 A 39 GLN HA A 38 ASP HBx 1.0 . 4.66 1985 1665 A 38 ASP HBy A 39 GLN HGy 1.0 . 5.38 1986 1665 A 38 ASP HBx A 39 GLN HGy 1.0 . 5.38 1987 1665 A 39 GLN HGx A 38 ASP HBy 1.0 . 5.38 1988 1665 A 38 ASP HBx A 39 GLN HGx 1.0 . 5.38 1989 1666 A 39 GLN HE21 A 38 ASP HBy 1.0 . 4.34 1990 1666 A 39 GLN HE21 A 38 ASP HBx 1.0 . 4.34 1991 1666 A 39 GLN HE22 A 38 ASP HBy 1.0 . 4.34 1992 1666 A 39 GLN HE22 A 38 ASP HBx 1.0 . 4.34 1993 1667 A 39 GLN H A 39 GLN HGy 1.0 . 3.09 1994 1667 A 39 GLN H A 39 GLN HGx 1.0 . 3.09 1995 1668 A 39 GLN HA A 39 GLN HGy 1.0 . 3.34 1996 1668 A 39 GLN HA A 39 GLN HGx 1.0 . 3.34 1997 1669 A 39 GLN HA A 39 GLN HE21 1.0 . 4.67 1998 1669 A 39 GLN HA A 39 GLN HE22 1.0 . 4.67 1999 1670 A 39 GLN HBx A 39 GLN HE21 1.0 . 4.81 2000 1670 A 39 GLN HBx A 39 GLN HE22 1.0 . 4.81 2001 1671 A 39 GLN HBy A 39 GLN HE21 1.0 . 4.82 2002 1671 A 39 GLN HBy A 39 GLN HE22 1.0 . 4.82 2003 1672 A 39 GLN HE21 A 39 GLN HGx 1.0 . 3.12 2004 1672 A 39 GLN HE21 A 39 GLN HGy 1.0 . 3.12 2005 1672 A 39 GLN HE22 A 39 GLN HGx 1.0 . 3.12 2006 1672 A 39 GLN HE22 A 39 GLN HGy 1.0 . 3.12 2007 1673 A 40 ALA H A 39 GLN HGy 1.0 . 4.22 2008 1673 A 40 ALA H A 39 GLN HGx 1.0 . 4.22 2009 1674 A 40 ALA H A 41 ASP HBy 1.0 . 4.33 2010 1674 A 40 ALA H A 41 ASP HBx 1.0 . 4.33 2011 1675 A 40 ALA HB% A 50 PHE HBx 1.0 . 5.06 2012 1675 A 40 ALA HB% A 50 PHE HBy 1.0 . 5.06 2013 1676 A 41 ASP H A 41 ASP HBy 1.0 . 2.91 2014 1676 A 41 ASP H A 41 ASP HBx 1.0 . 2.91 2015 1677 A 44 ALA HB% A 41 ASP HBy 1.0 . 4.62 2016 1677 A 44 ALA HB% A 41 ASP HBx 1.0 . 4.62 2017 1678 A 42 LEU HA A 45 GLU HGx 1.0 . 4.57 2018 1678 A 42 LEU HA A 45 GLU HGy 1.0 . 4.57 2019 1679 A 43 ALA HA A 48 GLN HBx 1.0 . 3.70 2020 1679 A 43 ALA HA A 48 GLN HBy 1.0 . 3.70 2021 1680 A 43 ALA HA A 48 GLN HGx 1.0 . 4.05 2022 1680 A 43 ALA HA A 48 GLN HG3 1.0 . 4.05 2023 1681 A 43 ALA HA A 50 PHE HBx 1.0 . 5.15 2024 1681 A 43 ALA HA A 50 PHE HBy 1.0 . 5.15 2025 1682 A 43 ALA HB% A 48 GLN HBx 1.0 . 3.24 2026 1682 A 43 ALA HB% A 48 GLN HBy 1.0 . 3.24 2027 1683 A 43 ALA HB% A 48 GLN HGx 1.0 . 3.89 2028 1683 A 43 ALA HB% A 48 GLN HG3 1.0 . 3.89 2029 1684 A 44 ALA H A 50 PHE HBx 1.0 . 4.45 2030 1684 A 44 ALA H A 50 PHE HBy 1.0 . 4.45 2031 1685 A 45 GLU H A 45 GLU HGx 1.0 . 3.68 2032 1685 A 45 GLU H A 45 GLU HGy 1.0 . 3.68 2033 1686 A 45 GLU HA A 45 GLU HGx 1.0 . 3.17 2034 1686 A 45 GLU HA A 45 GLU HGy 1.0 . 3.17 2035 1687 A 46 ALA H A 47 ASP HBy 1.0 . 4.72 2036 1687 A 46 ALA H A 47 ASP HBx 1.0 . 4.72 2037 1688 A 46 ALA HA A 47 ASP HBy 1.0 . 4.66 2038 1688 A 46 ALA HA A 47 ASP HBx 1.0 . 4.66 2039 1689 A 46 ALA HA A 48 GLN HGx 1.0 . 4.44 2040 1689 A 46 ALA HA A 48 GLN HG3 1.0 . 4.44 2041 1690 A 46 ALA HB% A 47 ASP HBy 1.0 . 4.72 2042 1690 A 46 ALA HB% A 47 ASP HBx 1.0 . 4.72 2043 1691 A 46 ALA HB% A 48 GLN HGx 1.0 . 3.07 2044 1691 A 46 ALA HB% A 48 GLN HG3 1.0 . 3.07 2045 1692 A 47 ASP H A 47 ASP HBy 1.0 . 3.22 2046 1692 A 47 ASP H A 47 ASP HBx 1.0 . 3.22 2047 1693 A 47 ASP HA A 48 GLN HGx 1.0 . 5.05 2048 1693 A 47 ASP HA A 48 GLN HG3 1.0 . 5.05 2049 1694 A 47 ASP HBy A 48 GLN HGx 1.0 . 5.00 2050 1694 A 47 ASP HBx A 48 GLN HGx 1.0 . 5.00 2051 1694 A 48 GLN HG3 A 47 ASP HBy 1.0 . 5.00 2052 1694 A 48 GLN HG3 A 47 ASP HBx 1.0 . 5.00 2053 1695 A 48 GLN HE21 A 47 ASP HBy 1.0 . 5.10 2054 1695 A 48 GLN HE21 A 47 ASP HBx 1.0 . 5.10 2055 1696 A 48 GLN H A 48 GLN HBx 1.0 . 3.23 2056 1696 A 48 GLN H A 48 GLN HBy 1.0 . 3.23 2057 1697 A 48 GLN H A 48 GLN HGx 1.0 . 3.33 2058 1697 A 48 GLN H A 48 GLN HG3 1.0 . 3.33 2059 1698 A 48 GLN H A 49 PRO HDx 1.0 . 4.33 2060 1698 A 48 GLN H A 49 PRO HDy 1.0 . 4.33 2061 1699 A 48 GLN HA A 48 GLN HGx 1.0 . 3.38 2062 1699 A 48 GLN HA A 48 GLN HG3 1.0 . 3.38 2063 1700 A 48 GLN HE22 A 48 GLN HGx 1.0 . 3.41 2064 1700 A 48 GLN HE22 A 48 GLN HG3 1.0 . 3.41 2065 1701 A 48 GLN HG3 A 49 PRO HDx 1.0 . 3.65 2066 1701 A 48 GLN HGx A 49 PRO HDx 1.0 . 3.65 2067 1701 A 49 PRO HDy A 48 GLN HGx 1.0 . 3.65 2068 1701 A 48 GLN HG3 A 49 PRO HDy 1.0 . 3.65 2069 1702 A 50 PHE H A 49 PRO HDx 1.0 . 4.98 2070 1702 A 50 PHE H A 49 PRO HDy 1.0 . 4.98 2071 1703 A 51 ALA H A 50 PHE HBx 1.0 . 3.70 2072 1703 A 51 ALA H A 50 PHE HBy 1.0 . 3.70 2073 1704 A 50 PHE HE% A 52 SER HBy 1.0 . 4.19 2074 1704 A 50 PHE HE% A 52 SER HBx 1.0 . 4.19 2075 1705 A 50 PHE HZ A 52 SER HBy 1.0 . 4.60 2076 1705 A 50 PHE HZ A 52 SER HBx 1.0 . 4.60 2077 1706 A 52 SER H A 53 GLU HGx 1.0 . 4.68 2078 1706 A 52 SER H A 53 GLU HGy 1.0 . 4.68 2079 1707 A 52 SER H A 75 ASN HBx 1.0 . 4.61 2080 1707 A 52 SER H A 75 ASN HBy 1.0 . 4.61 2081 1708 A 52 SER HA A 53 GLU HGx 1.0 . 4.57 2082 1708 A 52 SER HA A 53 GLU HGy 1.0 . 4.57 2083 1709 A 53 GLU H A 52 SER HBy 1.0 . 3.82 2084 1709 A 53 GLU H A 52 SER HBx 1.0 . 3.82 2085 1710 A 54 ASP H A 52 SER HBy 1.0 . 4.17 2086 1710 A 54 ASP H A 52 SER HBx 1.0 . 4.17 2087 1711 A 74 TYR H A 52 SER HBy 1.0 . 4.55 2088 1711 A 74 TYR H A 52 SER HBx 1.0 . 4.55 2089 1712 A 53 GLU H A 53 GLU HBy 1.0 . 3.34 2090 1712 A 53 GLU H A 53 GLU HBx 1.0 . 3.34 2091 1713 A 53 GLU H A 53 GLU HGx 1.0 . 3.86 2092 1713 A 53 GLU H A 53 GLU HGy 1.0 . 3.86 2093 1714 A 53 GLU H A 54 ASP HBy 1.0 . 4.35 2094 1714 A 53 GLU H A 54 ASP HBx 1.0 . 4.35 2095 1715 A 53 GLU HA A 73 SER HBx 1.0 . 3.48 2096 1715 A 53 GLU HA A 73 SER HB3 1.0 . 3.48 2097 1716 A 53 GLU HBx A 73 SER HBx 1.0 . 5.16 2098 1716 A 53 GLU HBy A 73 SER HBx 1.0 . 5.16 2099 1716 A 73 SER HB3 A 53 GLU HBy 1.0 . 5.16 2100 1716 A 53 GLU HBx A 73 SER HB3 1.0 . 5.16 2101 1717 A 54 ASP H A 53 GLU HGx 1.0 . 4.89 2102 1717 A 54 ASP H A 53 GLU HGy 1.0 . 4.89 2103 1718 A 75 ASN HD21 A 53 GLU HGx 1.0 . 4.01 2104 1718 A 75 ASN HD21 A 53 GLU HGy 1.0 . 4.01 2105 1719 A 75 ASN HD22 A 53 GLU HGx 1.0 . 4.11 2106 1719 A 75 ASN HD22 A 53 GLU HGy 1.0 . 4.11 2107 1720 A 54 ASP H A 54 ASP HBy 1.0 . 2.93 2108 1720 A 54 ASP H A 54 ASP HBx 1.0 . 2.93 2109 1721 A 55 TRP H A 54 ASP HBy 1.0 . 3.21 2110 1721 A 55 TRP H A 54 ASP HBx 1.0 . 3.21 2111 1722 A 55 TRP HD1 A 54 ASP HBy 1.0 . 3.99 2112 1722 A 55 TRP HD1 A 54 ASP HBx 1.0 . 3.99 2113 1723 A 55 TRP HE1 A 54 ASP HBy 1.0 . 5.09 2114 1723 A 55 TRP HE1 A 54 ASP HBx 1.0 . 5.09 2115 1724 A 55 TRP HA A 73 SER HBx 1.0 . 3.97 2116 1724 A 55 TRP HA A 73 SER HB3 1.0 . 3.97 2117 1725 A 55 TRP HE3 A 55 TRP HBx 1.0 . 3.48 2118 1725 A 55 TRP HE3 A 55 TRP HBy 1.0 . 3.48 2119 1726 A 56 VAL H A 55 TRP HBx 1.0 . 4.25 2120 1726 A 56 VAL H A 55 TRP HBy 1.0 . 4.25 2121 1727 A 57 LEU H A 55 TRP HBx 1.0 . 4.02 2122 1727 A 57 LEU H A 55 TRP HBy 1.0 . 4.02 2123 1728 A 71 ARG HBx A 55 TRP HBx 1.0 . 4.91 2124 1728 A 71 ARG HBx A 55 TRP HBy 1.0 . 4.91 2125 1729 A 71 ARG HDy A 55 TRP HBx 1.0 . 5.55 2126 1729 A 71 ARG HDy A 55 TRP HBy 1.0 . 5.55 2127 1730 A 72 PHE H A 55 TRP HBx 1.0 . 4.82 2128 1730 A 72 PHE H A 55 TRP HBy 1.0 . 4.82 2129 1731 A 56 VAL H A 57 LEU HBx 1.0 . 4.72 2130 1731 A 56 VAL H A 57 LEU HBy 1.0 . 4.72 2131 1732 A 56 VAL H A 57 LEU HDy% 1.0 . 5.10 2132 1732 A 56 VAL H A 57 LEU HDx% 1.0 . 5.10 2133 1733 A 56 VAL H A 72 PHE HBx 1.0 . 5.08 2134 1733 A 56 VAL H A 72 PHE HBy 1.0 . 5.08 2135 1734 A 56 VAL H A 77 VAL HGy% 1.0 . 4.91 2136 1734 A 56 VAL H A 77 VAL HGx% 1.0 . 4.91 2137 1735 A 56 VAL HGx% A 72 PHE HBx 1.0 . 4.75 2138 1735 A 56 VAL HGx% A 72 PHE HBy 1.0 . 4.75 2139 1736 A 57 LEU H A 57 LEU HBx 1.0 . 3.44 2140 1736 A 57 LEU H A 57 LEU HBy 1.0 . 3.44 2141 1737 A 57 LEU H A 57 LEU HDy% 1.0 . 4.11 2142 1737 A 57 LEU H A 57 LEU HDx% 1.0 . 4.11 2143 1738 A 57 LEU H A 72 PHE HBx 1.0 . 4.73 2144 1738 A 57 LEU H A 72 PHE HBy 1.0 . 4.73 2145 1739 A 57 LEU H A 77 VAL HGy% 1.0 . 4.50 2146 1739 A 57 LEU H A 77 VAL HGx% 1.0 . 4.50 2147 1740 A 57 LEU HA A 57 LEU HDy% 1.0 . 3.43 2148 1740 A 57 LEU HA A 57 LEU HDx% 1.0 . 3.43 2149 1741 A 58 ALA H A 57 LEU HBx 1.0 . 3.98 2150 1741 A 58 ALA H A 57 LEU HBy 1.0 . 3.98 2151 1742 A 59 VAL H A 57 LEU HBx 1.0 . 4.65 2152 1742 A 59 VAL H A 57 LEU HBy 1.0 . 4.65 2153 1743 A 72 PHE H A 57 LEU HBx 1.0 . 3.86 2154 1743 A 72 PHE H A 57 LEU HBy 1.0 . 3.86 2155 1744 A 72 PHE HA A 57 LEU HBx 1.0 . 5.29 2156 1744 A 72 PHE HA A 57 LEU HBy 1.0 . 5.29 2157 1745 A 57 LEU HBy A 72 PHE HBx 1.0 . 4.76 2158 1745 A 72 PHE HBy A 57 LEU HBx 1.0 . 4.76 2159 1745 A 57 LEU HBy A 72 PHE HBy 1.0 . 4.76 2160 1745 A 57 LEU HBx A 72 PHE HBx 1.0 . 4.76 2161 1746 A 57 LEU HG A 59 VAL HGy% 1.0 . 3.64 2162 1746 A 57 LEU HG A 59 VAL HGx% 1.0 . 3.64 2163 1747 A 58 ALA H A 57 LEU HDy% 1.0 . 3.17 2164 1747 A 58 ALA H A 57 LEU HDx% 1.0 . 3.17 2165 1748 A 59 VAL H A 57 LEU HDy% 1.0 . 3.49 2166 1748 A 59 VAL H A 57 LEU HDx% 1.0 . 3.49 2167 1749 A 59 VAL HA A 57 LEU HDy% 1.0 . 4.84 2168 1749 A 59 VAL HA A 57 LEU HDx% 1.0 . 4.84 2169 1750 A 57 LEU HDx% A 59 VAL HGy% 1.0 . 3.19 2170 1750 A 57 LEU HDy% A 59 VAL HGy% 1.0 . 3.19 2171 1750 A 59 VAL HGx% A 57 LEU HDy% 1.0 . 3.19 2172 1750 A 59 VAL HGx% A 57 LEU HDx% 1.0 . 3.19 2173 1751 A 72 PHE H A 57 LEU HDy% 1.0 . 4.65 2174 1751 A 72 PHE H A 57 LEU HDx% 1.0 . 4.65 2175 1752 A 57 LEU HDx% A 72 PHE HBx 1.0 . 4.00 2176 1752 A 57 LEU HDy% A 72 PHE HBx 1.0 . 4.00 2177 1752 A 72 PHE HBy A 57 LEU HDy% 1.0 . 4.00 2178 1752 A 57 LEU HDx% A 72 PHE HBy 1.0 . 4.00 2179 1753 A 72 PHE HD% A 57 LEU HDy% 1.0 . 3.52 2180 1753 A 72 PHE HD% A 57 LEU HDx% 1.0 . 3.52 2181 1754 A 72 PHE HE% A 57 LEU HDy% 1.0 . 4.24 2182 1754 A 72 PHE HE% A 57 LEU HDx% 1.0 . 4.24 2183 1755 A 77 VAL HB A 57 LEU HDy% 1.0 . 4.76 2184 1755 A 77 VAL HB A 57 LEU HDx% 1.0 . 4.76 2185 1756 A 58 ALA H A 59 VAL HGy% 1.0 . 4.42 2186 1756 A 58 ALA H A 59 VAL HGx% 1.0 . 4.42 2187 1757 A 58 ALA HA A 59 VAL HGy% 1.0 . 4.82 2188 1757 A 58 ALA HA A 59 VAL HGx% 1.0 . 4.82 2189 1758 A 59 VAL H A 59 VAL HGy% 1.0 . 3.75 2190 1758 A 59 VAL H A 59 VAL HGx% 1.0 . 3.75 2191 1759 A 59 VAL H A 69 GLU HBy 1.0 . 5.02 2192 1759 A 59 VAL H A 69 GLU HBx 1.0 . 5.02 2193 1760 A 59 VAL H A 69 GLU HGy 1.0 . 4.83 2194 1760 A 59 VAL H A 69 GLU HGx 1.0 . 4.83 2195 1761 A 59 VAL HB A 100 LEU HDy% 1.0 . 5.66 2196 1761 A 59 VAL HB A 100 LEU HDx% 1.0 . 5.66 2197 1762 A 60 GLU H A 59 VAL HGy% 1.0 . 3.30 2198 1762 A 60 GLU H A 59 VAL HGx% 1.0 . 3.30 2199 1763 A 60 GLU HA A 59 VAL HGy% 1.0 . 5.27 2200 1763 A 60 GLU HA A 59 VAL HGx% 1.0 . 5.27 2201 1764 A 70 TRP H A 59 VAL HGy% 1.0 . 4.32 2202 1764 A 70 TRP H A 59 VAL HGx% 1.0 . 4.32 2203 1765 A 70 TRP HA A 59 VAL HGy% 1.0 . 5.48 2204 1765 A 70 TRP HA A 59 VAL HGx% 1.0 . 5.48 2205 1766 A 70 TRP HBx A 59 VAL HGy% 1.0 . 5.31 2206 1766 A 70 TRP HBx A 59 VAL HGx% 1.0 . 5.31 2207 1767 A 70 TRP HBy A 59 VAL HGy% 1.0 . 4.57 2208 1767 A 70 TRP HBy A 59 VAL HGx% 1.0 . 4.57 2209 1768 A 70 TRP HE3 A 59 VAL HGy% 1.0 . 3.71 2210 1768 A 70 TRP HE3 A 59 VAL HGx% 1.0 . 3.71 2211 1769 A 70 TRP HZ3 A 59 VAL HGy% 1.0 . 4.26 2212 1769 A 70 TRP HZ3 A 59 VAL HGx% 1.0 . 4.26 2213 1770 A 72 PHE H A 59 VAL HGy% 1.0 . 4.81 2214 1770 A 72 PHE H A 59 VAL HGx% 1.0 . 4.81 2215 1771 A 72 PHE HD% A 59 VAL HGy% 1.0 . 3.61 2216 1771 A 72 PHE HD% A 59 VAL HGx% 1.0 . 3.61 2217 1772 A 59 VAL HGx% A 100 LEU HDy% 1.0 . 3.44 2218 1772 A 59 VAL HGy% A 100 LEU HDy% 1.0 . 3.44 2219 1772 A 100 LEU HDx% A 59 VAL HGy% 1.0 . 3.44 2220 1772 A 100 LEU HDx% A 59 VAL HGx% 1.0 . 3.44 2221 1773 A 60 GLU H A 60 GLU HBy 1.0 . 3.37 2222 1773 A 60 GLU H A 60 GLU HBx 1.0 . 3.37 2223 1774 A 61 SER H A 60 GLU HBy 1.0 . 4.02 2224 1774 A 61 SER H A 60 GLU HBx 1.0 . 4.02 2225 1775 A 69 GLU HA A 60 GLU HBy 1.0 . 5.24 2226 1775 A 69 GLU HA A 60 GLU HBx 1.0 . 5.24 2227 1776 A 60 GLU HG2 A 62 LEU HDy% 1.0 . 4.63 2228 1776 A 60 GLU HG3 A 62 LEU HDy% 1.0 . 4.63 2229 1776 A 62 LEU HDx% A 60 GLU HG2 1.0 . 4.63 2230 1776 A 60 GLU HG3 A 62 LEU HDx% 1.0 . 4.63 2231 1777 A 61 SER H A 68 ARG HBx 1.0 . 4.71 2232 1777 A 61 SER H A 68 ARG HBy 1.0 . 4.71 2233 1778 A 62 LEU HA A 62 LEU HDy% 1.0 . 3.20 2234 1778 A 62 LEU HA A 62 LEU HDx% 1.0 . 3.20 2235 1779 A 63 ASP H A 62 LEU HDy% 1.0 . 4.15 2236 1779 A 63 ASP H A 62 LEU HDx% 1.0 . 4.15 2237 1780 A 63 ASP HA A 62 LEU HDy% 1.0 . 5.23 2238 1780 A 63 ASP HA A 62 LEU HDx% 1.0 . 5.23 2239 1781 A 65 ARG HA A 62 LEU HDy% 1.0 . 4.28 2240 1781 A 65 ARG HA A 62 LEU HDx% 1.0 . 4.28 2241 1782 A 62 LEU HDy% A 65 ARG HBy 1.0 . 4.90 2242 1782 A 62 LEU HDx% A 65 ARG HBy 1.0 . 4.90 2243 1782 A 65 ARG HBx A 62 LEU HDy% 1.0 . 4.90 2244 1782 A 62 LEU HDx% A 65 ARG HBx 1.0 . 4.90 2245 1783 A 66 THR H A 62 LEU HDy% 1.0 . 5.30 2246 1783 A 66 THR H A 62 LEU HDx% 1.0 . 5.30 2247 1784 A 67 ARG H A 62 LEU HDy% 1.0 . 4.91 2248 1784 A 67 ARG H A 62 LEU HDx% 1.0 . 4.91 2249 1785 A 67 ARG HA A 62 LEU HDy% 1.0 . 4.28 2250 1785 A 67 ARG HA A 62 LEU HDx% 1.0 . 4.28 2251 1786 A 62 LEU HDy% A 67 ARG HBy 1.0 . 3.82 2252 1786 A 62 LEU HDx% A 67 ARG HBy 1.0 . 3.82 2253 1786 A 67 ARG HBx A 62 LEU HDy% 1.0 . 3.82 2254 1786 A 62 LEU HDx% A 67 ARG HBx 1.0 . 3.82 2255 1787 A 62 LEU HDx% A 67 ARG HGx 1.0 . 5.15 2256 1787 A 62 LEU HDy% A 67 ARG HGx 1.0 . 5.15 2257 1787 A 67 ARG HGy A 62 LEU HDy% 1.0 . 5.15 2258 1787 A 62 LEU HDx% A 67 ARG HGy 1.0 . 5.15 2259 1788 A 67 ARG HDy A 62 LEU HDy% 1.0 . 4.13 2260 1788 A 67 ARG HDy A 62 LEU HDx% 1.0 . 4.13 2261 1789 A 68 ARG H A 62 LEU HDy% 1.0 . 4.65 2262 1789 A 68 ARG H A 62 LEU HDx% 1.0 . 4.65 2263 1790 A 63 ASP HA A 64 GLY HAy 1.0 . 4.88 2264 1790 A 63 ASP HA A 64 GLY HAx 1.0 . 4.88 2265 1791 A 64 GLY H A 65 ARG HGx 1.0 . 5.02 2266 1791 A 64 GLY H A 65 ARG HG3 1.0 . 5.02 2267 1792 A 65 ARG H A 64 GLY HAy 1.0 . 3.09 2268 1792 A 65 ARG H A 64 GLY HAx 1.0 . 3.09 2269 1793 A 64 GLY HAy A 65 ARG HGx 1.0 . 4.44 2270 1793 A 64 GLY HAx A 65 ARG HGx 1.0 . 4.44 2271 1793 A 65 ARG HG3 A 64 GLY HAy 1.0 . 4.44 2272 1793 A 64 GLY HAx A 65 ARG HG3 1.0 . 4.44 2273 1794 A 66 THR H A 64 GLY HAy 1.0 . 3.84 2274 1794 A 66 THR H A 64 GLY HAx 1.0 . 3.84 2275 1795 A 66 THR HG2% A 64 GLY HAy 1.0 . 4.62 2276 1795 A 66 THR HG2% A 64 GLY HAx 1.0 . 4.62 2277 1796 A 65 ARG H A 65 ARG HBy 1.0 . 3.38 2278 1796 A 65 ARG H A 65 ARG HBx 1.0 . 3.38 2279 1797 A 65 ARG H A 65 ARG HD2 1.0 . 4.70 2280 1797 A 65 ARG H A 65 ARG HDy 1.0 . 4.70 2281 1798 A 65 ARG HA A 65 ARG HGx 1.0 . 3.27 2282 1798 A 65 ARG HA A 65 ARG HG3 1.0 . 3.27 2283 1799 A 65 ARG HA A 65 ARG HD2 1.0 . 3.52 2284 1799 A 65 ARG HA A 65 ARG HDy 1.0 . 3.52 2285 1800 A 65 ARG HBy A 65 ARG HD2 1.0 . 2.83 2286 1800 A 65 ARG HDy A 65 ARG HBy 1.0 . 2.83 2287 1800 A 65 ARG HBx A 65 ARG HDy 1.0 . 2.83 2288 1800 A 65 ARG HBx A 65 ARG HD2 1.0 . 2.83 2289 1801 A 66 THR H A 65 ARG HBy 1.0 . 3.71 2290 1801 A 66 THR H A 65 ARG HBx 1.0 . 3.71 2291 1802 A 66 THR HA A 65 ARG HBy 1.0 . 5.07 2292 1802 A 66 THR HA A 65 ARG HBx 1.0 . 5.07 2293 1803 A 66 THR HA A 67 ARG HBy 1.0 . 4.47 2294 1803 A 66 THR HA A 67 ARG HBx 1.0 . 4.47 2295 1804 A 67 ARG H A 67 ARG HGx 1.0 . 3.99 2296 1804 A 67 ARG H A 67 ARG HGy 1.0 . 3.99 2297 1805 A 68 ARG H A 67 ARG HGx 1.0 . 4.35 2298 1805 A 68 ARG H A 67 ARG HGy 1.0 . 4.35 2299 1806 A 68 ARG H A 68 ARG HBx 1.0 . 3.53 2300 1806 A 68 ARG H A 68 ARG HBy 1.0 . 3.53 2301 1807 A 68 ARG H A 68 ARG HGx 1.0 . 4.43 2302 1807 A 68 ARG H A 68 ARG HGy 1.0 . 4.43 2303 1808 A 68 ARG HA A 69 GLU HBy 1.0 . 5.01 2304 1808 A 68 ARG HA A 69 GLU HBx 1.0 . 5.01 2305 1809 A 69 GLU H A 68 ARG HBx 1.0 . 4.06 2306 1809 A 69 GLU H A 68 ARG HBy 1.0 . 4.06 2307 1810 A 69 GLU H A 68 ARG HGx 1.0 . 3.62 2308 1810 A 69 GLU H A 68 ARG HGy 1.0 . 3.62 2309 1811 A 70 TRP HE1 A 68 ARG HGx 1.0 . 5.19 2310 1811 A 70 TRP HE1 A 68 ARG HGy 1.0 . 5.19 2311 1812 A 69 GLU H A 69 GLU HGy 1.0 . 4.21 2312 1812 A 69 GLU H A 69 GLU HGx 1.0 . 4.21 2313 1813 A 70 TRP H A 69 GLU HBy 1.0 . 4.10 2314 1813 A 70 TRP H A 69 GLU HBx 1.0 . 4.10 2315 1814 A 70 TRP H A 69 GLU HGy 1.0 . 4.13 2316 1814 A 70 TRP H A 69 GLU HGx 1.0 . 4.13 2317 1815 A 72 PHE H A 72 PHE HBx 1.0 . 3.52 2318 1815 A 72 PHE H A 72 PHE HBy 1.0 . 3.52 2319 1816 A 72 PHE H A 77 VAL HGy% 1.0 . 4.88 2320 1816 A 72 PHE H A 77 VAL HGx% 1.0 . 4.88 2321 1817 A 72 PHE HA A 77 VAL HGy% 1.0 . 4.82 2322 1817 A 72 PHE HA A 77 VAL HGx% 1.0 . 4.82 2323 1818 A 73 SER H A 72 PHE HBx 1.0 . 4.39 2324 1818 A 73 SER H A 72 PHE HBy 1.0 . 4.39 2325 1819 A 76 ALA HB% A 72 PHE HBx 1.0 . 3.69 2326 1819 A 76 ALA HB% A 72 PHE HBy 1.0 . 3.69 2327 1820 A 72 PHE HBx A 77 VAL HGy% 1.0 . 3.70 2328 1820 A 72 PHE HBy A 77 VAL HGy% 1.0 . 3.70 2329 1820 A 77 VAL HGx% A 72 PHE HBx 1.0 . 3.70 2330 1820 A 77 VAL HGx% A 72 PHE HBy 1.0 . 3.70 2331 1821 A 91 LEU HDx% A 72 PHE HBx 1.0 . 4.98 2332 1821 A 91 LEU HDx% A 72 PHE HBy 1.0 . 4.98 2333 1822 A 72 PHE HD% A 77 VAL HGy% 1.0 . 4.44 2334 1822 A 72 PHE HD% A 77 VAL HGx% 1.0 . 4.44 2335 1823 A 72 PHE HD% A 100 LEU HDy% 1.0 . 4.73 2336 1823 A 72 PHE HD% A 100 LEU HDx% 1.0 . 4.73 2337 1824 A 72 PHE HE% A 100 LEU HDy% 1.0 . 4.29 2338 1824 A 72 PHE HE% A 100 LEU HDx% 1.0 . 4.29 2339 1825 A 73 SER H A 73 SER HBx 1.0 . 3.39 2340 1825 A 73 SER H A 73 SER HB3 1.0 . 3.39 2341 1826 A 73 SER H A 77 VAL HGy% 1.0 . 5.03 2342 1826 A 73 SER H A 77 VAL HGx% 1.0 . 5.03 2343 1827 A 74 TYR H A 73 SER HBx 1.0 . 3.44 2344 1827 A 74 TYR H A 73 SER HB3 1.0 . 3.44 2345 1828 A 74 TYR HA A 77 VAL HGy% 1.0 . 4.19 2346 1828 A 74 TYR HA A 77 VAL HGx% 1.0 . 4.19 2347 1829 A 74 TYR HE% A 78 MET HGy 1.0 . 4.10 2348 1829 A 74 TYR HE% A 78 MET HGx 1.0 . 4.10 2349 1830 A 76 ALA H A 75 ASN HBx 1.0 . 3.46 2350 1830 A 76 ALA H A 75 ASN HBy 1.0 . 3.46 2351 1831 A 79 GLU H A 75 ASN HBx 1.0 . 4.93 2352 1831 A 79 GLU H A 75 ASN HBy 1.0 . 4.93 2353 1832 A 75 ASN HD21 A 78 MET HGy 1.0 . 4.29 2354 1832 A 75 ASN HD21 A 78 MET HGx 1.0 . 4.29 2355 1833 A 75 ASN HD22 A 78 MET HGy 1.0 . 4.39 2356 1833 A 75 ASN HD22 A 78 MET HGx 1.0 . 4.39 2357 1834 A 76 ALA H A 77 VAL HGy% 1.0 . 4.41 2358 1834 A 76 ALA H A 77 VAL HGx% 1.0 . 4.41 2359 1835 A 76 ALA HA A 77 VAL HGy% 1.0 . 6.24 2360 1835 A 76 ALA HA A 77 VAL HGx% 1.0 . 6.24 2361 1836 A 76 ALA HB% A 77 VAL HGy% 1.0 . 4.24 2362 1836 A 76 ALA HB% A 77 VAL HGx% 1.0 . 4.24 2363 1837 A 77 VAL H A 77 VAL HGy% 1.0 . 2.98 2364 1837 A 77 VAL H A 77 VAL HGx% 1.0 . 2.98 2365 1838 A 77 VAL H A 78 MET HGy 1.0 . 4.76 2366 1838 A 77 VAL H A 78 MET HGx 1.0 . 4.76 2367 1839 A 78 MET HA A 77 VAL HGy% 1.0 . 4.32 2368 1839 A 78 MET HA A 77 VAL HGx% 1.0 . 4.32 2369 1840 A 78 MET HE% A 77 VAL HGy% 1.0 . 3.99 2370 1840 A 78 MET HE% A 77 VAL HGx% 1.0 . 3.99 2371 1841 A 79 GLU H A 77 VAL HGy% 1.0 . 4.82 2372 1841 A 79 GLU H A 77 VAL HGx% 1.0 . 4.82 2373 1842 A 80 ALA H A 77 VAL HGy% 1.0 . 4.26 2374 1842 A 80 ALA H A 77 VAL HGx% 1.0 . 4.26 2375 1843 A 80 ALA HB% A 77 VAL HGy% 1.0 . 3.59 2376 1843 A 80 ALA HB% A 77 VAL HGx% 1.0 . 3.59 2377 1844 A 91 LEU HDx% A 77 VAL HGy% 1.0 . 3.57 2378 1844 A 91 LEU HDx% A 77 VAL HGx% 1.0 . 3.57 2379 1845 A 91 LEU HDy% A 77 VAL HGy% 1.0 . 3.93 2380 1845 A 91 LEU HDy% A 77 VAL HGx% 1.0 . 3.93 2381 1846 A 78 MET H A 78 MET HGy 1.0 . 2.98 2382 1846 A 78 MET H A 78 MET HGx 1.0 . 2.98 2383 1847 A 78 MET HA A 78 MET HGy 1.0 . 3.73 2384 1847 A 78 MET HA A 78 MET HGx 1.0 . 3.73 2385 1848 A 79 GLU HA A 79 GLU HGx 1.0 . 3.21 2386 1848 A 79 GLU HA A 79 GLU HGy 1.0 . 3.21 2387 1849 A 80 ALA HB% A 89 TRP HBy 1.0 . 3.75 2388 1849 A 80 ALA HB% A 89 TRP HBx 1.0 . 3.75 2389 1850 A 81 GLU H A 89 TRP HBy 1.0 . 5.01 2390 1850 A 81 GLU H A 89 TRP HBx 1.0 . 5.01 2391 1851 A 81 GLU H A 90 ARG HBy 1.0 . 3.85 2392 1851 A 81 GLU H A 90 ARG HBx 1.0 . 3.85 2393 1852 A 81 GLU HA A 82 PRO HGy 1.0 . 4.66 2394 1852 A 81 GLU HA A 82 PRO HGx 1.0 . 4.66 2395 1853 A 81 GLU HBy A 90 ARG HD2 1.0 . 3.73 2396 1853 A 81 GLU HBy A 90 ARG HDy 1.0 . 3.73 2397 1854 A 82 PRO HA A 83 GLN HE21 1.0 . 4.34 2398 1854 A 82 PRO HA A 83 GLN HE22 1.0 . 4.34 2399 1855 A 82 PRO HA A 89 TRP HBy 1.0 . 5.62 2400 1855 A 82 PRO HA A 89 TRP HBx 1.0 . 5.62 2401 1856 A 83 GLN H A 82 PRO HGy 1.0 . 4.59 2402 1856 A 83 GLN H A 82 PRO HGx 1.0 . 4.59 2403 1857 A 83 GLN HE22 A 82 PRO HGx 1.0 . 5.29 2404 1857 A 83 GLN HE21 A 82 PRO HGy 1.0 . 5.29 2405 1857 A 83 GLN HE21 A 82 PRO HGx 1.0 . 5.29 2406 1857 A 83 GLN HE22 A 82 PRO HGy 1.0 . 5.29 2407 1858 A 83 GLN H A 83 GLN HBx 1.0 . 3.14 2408 1858 A 83 GLN H A 83 GLN HBy 1.0 . 3.14 2409 1859 A 83 GLN H A 83 GLN HGy 1.0 . 3.34 2410 1859 A 83 GLN H A 83 GLN HGx 1.0 . 3.34 2411 1860 A 83 GLN H A 90 ARG HBy 1.0 . 5.08 2412 1860 A 83 GLN H A 90 ARG HBx 1.0 . 5.08 2413 1861 A 83 GLN HA A 83 GLN HE21 1.0 . 3.73 2414 1861 A 83 GLN HA A 83 GLN HE22 1.0 . 3.73 2415 1862 A 83 GLN HA A 88 SER HBy 1.0 . 5.18 2416 1862 A 83 GLN HA A 88 SER HBx 1.0 . 5.18 2417 1863 A 84 ALA H A 83 GLN HBx 1.0 . 3.34 2418 1863 A 84 ALA H A 83 GLN HBy 1.0 . 3.34 2419 1864 A 84 ALA HB% A 83 GLN HBx 1.0 . 4.54 2420 1864 A 84 ALA HB% A 83 GLN HBy 1.0 . 4.54 2421 1865 A 85 ASP H A 83 GLN HBx 1.0 . 3.27 2422 1865 A 85 ASP H A 83 GLN HBy 1.0 . 3.27 2423 1866 A 88 SER H A 83 GLN HBx 1.0 . 5.03 2424 1866 A 88 SER H A 83 GLN HBy 1.0 . 5.03 2425 1867 A 83 GLN HBy A 88 SER HBy 1.0 . 4.27 2426 1867 A 83 GLN HBx A 88 SER HBy 1.0 . 4.27 2427 1867 A 88 SER HBx A 83 GLN HBx 1.0 . 4.27 2428 1867 A 83 GLN HBy A 88 SER HBx 1.0 . 4.27 2429 1868 A 83 GLN HE22 A 83 GLN HGy 1.0 . 3.07 2430 1868 A 83 GLN HE21 A 83 GLN HGx 1.0 . 3.07 2431 1868 A 83 GLN HE22 A 83 GLN HGx 1.0 . 3.07 2432 1868 A 83 GLN HE21 A 83 GLN HGy 1.0 . 3.07 2433 1869 A 84 ALA HB% A 83 GLN HGy 1.0 . 5.81 2434 1869 A 84 ALA HB% A 83 GLN HGx 1.0 . 5.81 2435 1870 A 88 SER HA A 83 GLN HGy 1.0 . 5.89 2436 1870 A 88 SER HA A 83 GLN HGx 1.0 . 5.89 2437 1871 A 83 GLN HGx A 88 SER HBy 1.0 . 3.57 2438 1871 A 83 GLN HGy A 88 SER HBy 1.0 . 3.57 2439 1871 A 88 SER HBx A 83 GLN HGy 1.0 . 3.57 2440 1871 A 83 GLN HGx A 88 SER HBx 1.0 . 3.57 2441 1872 A 89 TRP H A 83 GLN HGy 1.0 . 4.39 2442 1872 A 89 TRP H A 83 GLN HGx 1.0 . 4.39 2443 1873 A 89 TRP HA A 83 GLN HGy 1.0 . 4.02 2444 1873 A 89 TRP HA A 83 GLN HGx 1.0 . 4.02 2445 1874 A 90 ARG H A 83 GLN HGy 1.0 . 4.27 2446 1874 A 90 ARG H A 83 GLN HGx 1.0 . 4.27 2447 1875 A 84 ALA H A 83 GLN HE21 1.0 . 4.72 2448 1875 A 84 ALA H A 83 GLN HE22 1.0 . 4.72 2449 1876 A 83 GLN HE21 A 88 SER HBx 1.0 . 5.27 2450 1876 A 83 GLN HE22 A 88 SER HBx 1.0 . 5.27 2451 1876 A 83 GLN HE22 A 88 SER HBy 1.0 . 5.27 2452 1876 A 83 GLN HE21 A 88 SER HBy 1.0 . 5.27 2453 1877 A 89 TRP HA A 83 GLN HE21 1.0 . 4.03 2454 1877 A 89 TRP HA A 83 GLN HE22 1.0 . 4.03 2455 1878 A 90 ARG H A 83 GLN HE21 1.0 . 3.67 2456 1878 A 90 ARG H A 83 GLN HE22 1.0 . 3.67 2457 1879 A 90 ARG HA A 83 GLN HE21 1.0 . 4.80 2458 1879 A 90 ARG HA A 83 GLN HE22 1.0 . 4.80 2459 1880 A 83 GLN HE22 A 90 ARG HBy 1.0 . 3.64 2460 1880 A 83 GLN HE21 A 90 ARG HBx 1.0 . 3.64 2461 1880 A 83 GLN HE22 A 90 ARG HBx 1.0 . 3.64 2462 1880 A 83 GLN HE21 A 90 ARG HBy 1.0 . 3.64 2463 1881 A 83 GLN HE21 A 90 ARG HGx 1.0 . 4.03 2464 1881 A 83 GLN HE22 A 90 ARG HGx 1.0 . 4.03 2465 1881 A 83 GLN HE22 A 90 ARG HGy 1.0 . 4.03 2466 1881 A 83 GLN HE21 A 90 ARG HGy 1.0 . 4.03 2467 1882 A 83 GLN HE21 A 90 ARG HDy 1.0 . 4.13 2468 1882 A 83 GLN HE21 A 90 ARG HD2 1.0 . 4.13 2469 1882 A 83 GLN HE22 A 90 ARG HDy 1.0 . 4.13 2470 1882 A 83 GLN HE22 A 90 ARG HD2 1.0 . 4.13 2471 1883 A 85 ASP H A 88 SER HBy 1.0 . 4.94 2472 1883 A 85 ASP H A 88 SER HBx 1.0 . 4.94 2473 1884 A 87 GLU HBy A 101 ARG HDy 1.0 . 4.15 2474 1884 A 87 GLU HBy A 101 ARG HDx 1.0 . 4.15 2475 1885 A 99 GLN HGx A 88 SER HBy 1.0 . 4.58 2476 1885 A 99 GLN HGx A 88 SER HBx 1.0 . 4.58 2477 1886 A 101 ARG HA A 88 SER HBy 1.0 . 4.83 2478 1886 A 101 ARG HA A 88 SER HBx 1.0 . 4.83 2479 1887 A 101 ARG HBx A 88 SER HBy 1.0 . 5.31 2480 1887 A 101 ARG HBx A 88 SER HBx 1.0 . 5.31 2481 1888 A 89 TRP H A 89 TRP HBy 1.0 . 3.54 2482 1888 A 89 TRP H A 89 TRP HBx 1.0 . 3.54 2483 1889 A 89 TRP H A 100 LEU HBy 1.0 . 4.10 2484 1889 A 89 TRP H A 100 LEU HBx 1.0 . 4.10 2485 1890 A 89 TRP H A 100 LEU HDy% 1.0 . 4.91 2486 1890 A 89 TRP H A 100 LEU HDx% 1.0 . 4.91 2487 1891 A 89 TRP HA A 100 LEU HBy 1.0 . 5.77 2488 1891 A 89 TRP HA A 100 LEU HBx 1.0 . 5.77 2489 1892 A 90 ARG H A 89 TRP HBy 1.0 . 3.89 2490 1892 A 90 ARG H A 89 TRP HBx 1.0 . 3.89 2491 1893 A 100 LEU H A 89 TRP HBy 1.0 . 4.28 2492 1893 A 100 LEU H A 89 TRP HBx 1.0 . 4.28 2493 1894 A 89 TRP HBx A 100 LEU HBy 1.0 . 3.88 2494 1894 A 89 TRP HBy A 100 LEU HBy 1.0 . 3.88 2495 1894 A 100 LEU HBx A 89 TRP HBy 1.0 . 3.88 2496 1894 A 89 TRP HBx A 100 LEU HBx 1.0 . 3.88 2497 1895 A 89 TRP HBy A 100 LEU HDy% 1.0 . 4.46 2498 1895 A 89 TRP HBx A 100 LEU HDy% 1.0 . 4.46 2499 1895 A 100 LEU HDx% A 89 TRP HBy 1.0 . 4.46 2500 1895 A 100 LEU HDx% A 89 TRP HBx 1.0 . 4.46 2501 1896 A 89 TRP HD1 A 100 LEU HDy% 1.0 . 4.37 2502 1896 A 89 TRP HD1 A 100 LEU HDx% 1.0 . 4.37 2503 1897 A 89 TRP HE1 A 100 LEU HDy% 1.0 . 5.22 2504 1897 A 89 TRP HE1 A 100 LEU HDx% 1.0 . 5.22 2505 1898 A 90 ARG H A 90 ARG HBy 1.0 . 3.44 2506 1898 A 90 ARG H A 90 ARG HBx 1.0 . 3.44 2507 1899 A 90 ARG HA A 90 ARG HD2 1.0 . 3.85 2508 1899 A 90 ARG HA A 90 ARG HDy 1.0 . 3.85 2509 1900 A 90 ARG HBy A 90 ARG HD2 1.0 . 2.78 2510 1900 A 90 ARG HBx A 90 ARG HD2 1.0 . 2.78 2511 1900 A 90 ARG HDy A 90 ARG HBy 1.0 . 2.78 2512 1900 A 90 ARG HBx A 90 ARG HDy 1.0 . 2.78 2513 1901 A 91 LEU H A 90 ARG HBy 1.0 . 3.96 2514 1901 A 91 LEU H A 90 ARG HBx 1.0 . 3.96 2515 1902 A 99 GLN HA A 90 ARG HGy 1.0 . 5.05 2516 1902 A 99 GLN HA A 90 ARG HGx 1.0 . 5.05 2517 1903 A 91 LEU HG A 100 LEU HDy% 1.0 . 4.80 2518 1903 A 91 LEU HG A 100 LEU HDx% 1.0 . 4.80 2519 1904 A 91 LEU HDx% A 100 LEU HDy% 1.0 . 3.70 2520 1904 A 91 LEU HDx% A 100 LEU HDx% 1.0 . 3.70 2521 1905 A 95 GLU HA A 96 GLY HAy 1.0 . 5.69 2522 1905 A 95 GLU HA A 96 GLY HAx 1.0 . 5.69 2523 1906 A 97 ALA H A 96 GLY HAy 1.0 . 2.76 2524 1906 A 97 ALA H A 96 GLY HAx 1.0 . 2.76 2525 1907 A 97 ALA HB% A 96 GLY HAy 1.0 . 4.18 2526 1907 A 97 ALA HB% A 96 GLY HAx 1.0 . 4.18 2527 1908 A 98 TYR HBx A 100 LEU HDy% 1.0 . 5.27 2528 1908 A 98 TYR HBx A 100 LEU HDx% 1.0 . 5.27 2529 1909 A 99 GLN HE21 A 101 ARG HDy 1.0 . 4.64 2530 1909 A 99 GLN HE21 A 101 ARG HDx 1.0 . 4.64 2531 1910 A 100 LEU H A 100 LEU HBy 1.0 . 3.40 2532 1910 A 100 LEU H A 100 LEU HBx 1.0 . 3.40 2533 1911 A 100 LEU H A 100 LEU HDy% 1.0 . 4.50 2534 1911 A 100 LEU H A 100 LEU HDx% 1.0 . 4.50 2535 1912 A 100 LEU HA A 100 LEU HDy% 1.0 . 3.48 2536 1912 A 100 LEU HA A 100 LEU HDx% 1.0 . 3.48 2537 1913 A 101 ARG H A 100 LEU HBy 1.0 . 4.25 2538 1913 A 101 ARG H A 100 LEU HBx 1.0 . 4.25 2539 1914 A 101 ARG H A 100 LEU HDy% 1.0 . 3.95 2540 1914 A 101 ARG H A 100 LEU HDx% 1.0 . 3.95 2541 1915 A 101 ARG HA A 100 LEU HDy% 1.0 . 4.51 2542 1915 A 101 ARG HA A 100 LEU HDx% 1.0 . 4.51 2543 1916 A 102 CYS HA A 100 LEU HDy% 1.0 . 5.16 2544 1916 A 102 CYS HA A 100 LEU HDx% 1.0 . 5.16 2545 1917 A 101 ARG H A 101 ARG HGx 1.0 . 3.57 2546 1917 A 101 ARG H A 101 ARG HGy 1.0 . 3.57 2547 1918 A 101 ARG HA A 101 ARG HDy 1.0 . 4.42 2548 1918 A 101 ARG HA A 101 ARG HDx 1.0 . 4.42 2549 1919 A 101 ARG HA A 103 LEU HDy% 1.0 . 4.68 2550 1919 A 101 ARG HA A 103 LEU HDx% 1.0 . 4.68 2551 1920 A 101 ARG HBy A 103 LEU HDy% 1.0 . 4.89 2552 1920 A 101 ARG HBy A 103 LEU HDx% 1.0 . 4.89 2553 1921 A 101 ARG HBx A 101 ARG HDy 1.0 . 3.38 2554 1921 A 101 ARG HBx A 101 ARG HDx 1.0 . 3.38 2555 1922 A 101 ARG HBx A 103 LEU HDy% 1.0 . 4.86 2556 1922 A 101 ARG HBx A 103 LEU HDx% 1.0 . 4.86 2557 1923 A 102 CYS H A 101 ARG HGx 1.0 . 3.75 2558 1923 A 102 CYS H A 101 ARG HGy 1.0 . 3.75 2559 1924 A 101 ARG HGy A 103 LEU HDy% 1.0 . 3.91 2560 1924 A 103 LEU HDx% A 101 ARG HGx 1.0 . 3.91 2561 1924 A 103 LEU HDx% A 101 ARG HGy 1.0 . 3.91 2562 1924 A 101 ARG HGx A 103 LEU HDy% 1.0 . 3.91 2563 1925 A 101 ARG HDy A 103 LEU HDy% 1.0 . 3.31 2564 1925 A 101 ARG HDx A 103 LEU HDy% 1.0 . 3.31 2565 1925 A 103 LEU HDx% A 101 ARG HDy 1.0 . 3.31 2566 1925 A 103 LEU HDx% A 101 ARG HDx 1.0 . 3.31 2567 1926 A 102 CYS H A 102 CYS HBy 1.0 . 3.67 2568 1926 A 102 CYS H A 102 CYS HBx 1.0 . 3.67 2569 1927 A 103 LEU H A 103 LEU HDy% 1.0 . 3.79 2570 1927 A 103 LEU H A 103 LEU HDx% 1.0 . 3.79 2571 1928 A 103 LEU HA A 103 LEU HDy% 1.0 . 2.90 2572 1928 A 103 LEU HA A 103 LEU HDx% 1.0 . 2.90 2573 1929 A 104 GLY H A 103 LEU HDy% 1.0 . 3.77 2574 1929 A 104 GLY H A 103 LEU HDx% 1.0 . 3.77 2575 1930 A 106 VAL HB A 107 SER HBx 1.0 . 4.69 2576 1930 A 106 VAL HB A 107 SER HB3 1.0 . 4.69 2577 1931 A 108 ALA H A 107 SER HBx 1.0 . 3.77 2578 1931 A 108 ALA H A 107 SER HB3 1.0 . 3.77 2579 1932 A 108 ALA HB% A 107 SER HBx 1.0 . 4.47 2580 1932 A 108 ALA HB% A 107 SER HB3 1.0 . 4.47 2581 1933 A 111 GLU H A 110 GLY HAx 1.0 . 3.11 2582 1933 A 111 GLU H A 110 GLY HA3 1.0 . 3.11 2583 1934 A 111 GLU H A 111 GLU HB2 1.0 . 3.46 2584 1934 A 111 GLU H A 111 GLU HBy 1.0 . 3.46 2585 1935 A 111 GLU H A 111 GLU HGx 1.0 . 4.03 2586 1935 A 111 GLU H A 111 GLU HG3 1.0 . 4.03 2587 1936 A 113 GLU HBx A 113 GLU HGx 1.0 . 2.34 2588 1936 A 113 GLU HBy A 113 GLU HGx 1.0 . 2.34 2589 1936 A 113 GLU HG3 A 113 GLU HBx 1.0 . 2.34 2590 1936 A 113 GLU HBy A 113 GLU HG3 1.0 . 2.34 2591 1937 A 39 GLN HA A 41 ASP H 1.0 . 4.20 2592 1938 A 37 LEU HA A 41 ASP H 1.0 . 0.00 2593 1939 A 92 THR HG2% A 98 TYR H 1.0 . 3.41 2594 1940 A 97 ALA HB% A 98 TYR H 1.0 . 0.00 2595 1941 A 103 LEU HB3 A 103 LEU HDy% 1.0 . 3.03 2596 1942 A 101 ARG HBx A 103 LEU HDy% 1.0 . 0.00 2597 1943 A 50 PHE HE% A 40 ALA HB% 1.0 . 3.56 2598 1944 A 50 PHE HE% A 36 LEU HDx% 1.0 . 0.00 2599 1945 A 87 GLU HA A 86 GLY HAx 1.0 . 5.63 2600 1946 A 87 GLU HA A 88 SER HBy 1.0 . 0.00 2601 1947 A 37 LEU HA A 40 ALA H 1.0 . 3.55 2602 1948 A 39 GLN HA A 40 ALA H 1.0 . 0.00 2603 1949 A 14 LEU HA A 32 LEU HDx% 1.0 . 5.05 2604 1950 A 14 LEU HA A 57 LEU HDx% 1.0 . 0.00 2605 1951 A 89 TRP H A 83 GLN HGx 1.0 . 4.62 2606 1952 A 89 TRP H A 83 GLN HBy 1.0 . 0.00 2607 1953 A 23 ASP H A 22 ILE HG1x 1.0 . 4.66 2608 1954 A 23 ASP H A 100 LEU HDy% 1.0 . 0.00 2609 1955 A 22 ILE HG1y A 100 LEU HDy% 1.0 . 3.26 2610 1956 A 22 ILE HG1x A 22 ILE HG1y 1.0 . 0.00 2611 1957 A 80 ALA HB% A 83 GLN HE21 1.0 . 4.83 2612 1958 A 82 PRO HBy A 83 GLN HE21 1.0 . 0.00 2613 1959 A 83 GLN HE21 A 90 ARG HGy 1.0 . 0.00 2614 1960 A 56 VAL HGx% A 11 LEU HG 1.0 . 4.59 2615 1961 A 56 VAL HGx% A 36 LEU HBy 1.0 . 0.00 2616 1962 A 83 GLN HE22 A 83 GLN HBy 1.0 . 3.51 2617 1963 A 83 GLN HE22 A 83 GLN HGx 1.0 . 0.00 2618 1964 A 100 LEU HA A 100 LEU HBx 1.0 . 3.60 2619 1965 A 100 LEU HA A 100 LEU HG 1.0 . 0.00 2620 1966 A 30 PHE HA A 59 VAL HGx% 1.0 . 4.30 2621 1967 A 20 LEU HBx A 30 PHE HA 1.0 . 0.00 2622 1968 A 43 ALA H A 41 ASP H 1.0 . 3.99 2623 1969 A 43 ALA H A 45 GLU H 1.0 . 0.00 2624 1970 A 72 PHE HE% A 22 ILE HG1x 1.0 . 4.37 2625 1971 A 72 PHE HE% A 100 LEU HDy% 1.0 . 0.00 2626 1972 A 9 TYR H A 8 ARG HBx 1.0 . 3.95 2627 1973 A 9 TYR H A 7 GLN HB3 1.0 . 0.00 2628 1974 A 92 THR HG2% A 90 ARG HA 1.0 . 5.64 2629 1975 A 90 ARG HA A 97 ALA HB% 1.0 . 0.00 2630 1976 A 22 ILE HA A 22 ILE HG1x 1.0 . 3.93 2631 1977 A 22 ILE HA A 100 LEU HDy% 1.0 . 0.00 2632 1978 A 98 TYR HBx A 91 LEU HBx 1.0 . 4.63 2633 1979 A 91 LEU HG A 98 TYR HBx 1.0 . 0.00 2634 1980 A 83 GLN HE22 A 83 GLN HBx 1.0 . 4.01 2635 1981 A 83 GLN HE22 A 83 GLN HGy 1.0 . 0.00 2636 1982 A 43 ALA HA A 46 ALA H 1.0 . 3.76 2637 1983 A 46 ALA H A 44 ALA HA 1.0 . 0.00 2638 1984 A 32 LEU HG A 32 LEU HDy% 1.0 . 2.93 2639 1985 A 32 LEU HBy A 32 LEU HDy% 1.0 . 0.00 2640 1986 A 91 LEU HDy% A 100 LEU HG 1.0 . 4.01 2641 1987 A 100 LEU HG A 20 LEU HDx% 1.0 . 0.00 2642 1988 A 22 ILE HG2% A 100 LEU HG 1.0 . 0.00 2643 1989 A 22 ILE H A 22 ILE HG1x 1.0 . 4.41 2644 1990 A 22 ILE H A 100 LEU HDy% 1.0 . 0.00 2645 1991 A 103 LEU HG A 103 LEU HDy% 1.0 . 3.05 2646 1992 A 17 ALA HB% A 103 LEU HDy% 1.0 . 0.00 2647 1993 A 20 LEU HBy A 30 PHE HBx 1.0 . 4.50 2648 1994 A 30 PHE HBx A 59 VAL HGy% 1.0 . 0.00 2649 1995 A 32 LEU HDx% A 30 PHE HBx 1.0 . 0.00 2650 1996 A 30 PHE HBx A 57 LEU HDx% 1.0 . 0.00 2651 1997 A 40 ALA HB% A 39 GLN H 1.0 . 3.81 2652 1998 A 36 LEU HDx% A 39 GLN H 1.0 . 0.00 2653 1999 A 91 LEU HDy% A 91 LEU HG 1.0 . 2.82 2654 2000 A 91 LEU HDy% A 100 LEU HG 1.0 . 0.00 2655 2001 A 91 LEU HDy% A 91 LEU HBx 1.0 . 0.00 2656 2002 A 91 LEU HA A 91 LEU HBx 1.0 . 3.83 2657 2003 A 98 TYR HA A 91 LEU HBx 1.0 . 0.00 2658 2004 A 57 LEU HA A 32 LEU HDy% 1.0 . 4.78 2659 2005 A 57 LEU HA A 59 VAL HGx% 1.0 . 0.00 2660 2006 A 43 ALA HB% A 40 ALA H 1.0 . 4.20 2661 2007 A 36 LEU HG A 40 ALA H 1.0 . 0.00 2662 2008 A 40 ALA HB% A 50 PHE HZ 1.0 . 3.46 2663 2009 A 36 LEU HDx% A 50 PHE HZ 1.0 . 0.00 2664 2010 A 84 ALA H A 83 GLN HBy 1.0 . 3.64 2665 2011 A 84 ALA H A 83 GLN HGx 1.0 . 0.00 2666 2012 A 88 SER H A 83 GLN HGy 1.0 . 5.17 2667 2013 A 88 SER H A 83 GLN HBx 1.0 . 0.00 2668 2014 A 103 LEU HDx% A 19 MET HBx 1.0 . 3.27 2669 2015 A 103 LEU HDx% A 87 GLU HBy 1.0 . 0.00 2670 2016 A 92 THR HG2% A 91 LEU H 1.0 . 4.58 2671 2017 A 97 ALA HB% A 91 LEU H 1.0 . 0.00 2672 2018 A 90 ARG HA A 83 GLN HGy 1.0 . 4.87 2673 2019 A 90 ARG HA A 99 GLN HGx 1.0 . 0.00 2674 2020 A 40 ALA H A 42 LEU H 1.0 . 4.07 2675 2021 A 44 ALA H A 42 LEU H 1.0 . 0.00 2676 2022 A 75 ASN HA A 78 MET H 1.0 . 3.40 2677 2023 A 78 MET HA A 78 MET H 1.0 . 0.00 2678 2024 A 56 VAL HA A 36 LEU HBy 1.0 . 5.11 2679 2025 A 56 VAL HA A 36 LEU HG 1.0 . 0.00 2680 2026 A 20 LEU HG A 21 GLU H 1.0 . 4.49 2681 2027 A 21 GLU H A 22 ILE HG1y 1.0 . 0.00 2682 2028 A 20 LEU HDx% A 100 LEU HDy% 1.0 . 3.15 2683 2029 A 22 ILE HG2% A 100 LEU HDy% 1.0 . 0.00 2684 2030 A 91 LEU HDy% A 100 LEU HDy% 1.0 . 0.00 2685 2031 A 63 ASP H A 25 LEU HDy% 1.0 . 5.00 2686 2032 A 63 ASP H A 68 ARG HBx 1.0 . 0.00 2687 2033 A 103 LEU HG A 103 LEU HDx% 1.0 . 3.05 2688 2034 A 17 ALA HB% A 103 LEU HDx% 1.0 . 0.00 2689 2035 A 55 TRP HA A 74 TYR H 1.0 . 3.22 2690 2036 A 75 ASN HA A 74 TYR H 1.0 . 0.00 2691 2037 A 11 LEU HA A 32 LEU HDx% 1.0 . 5.33 2692 2038 A 11 LEU HA A 57 LEU HDx% 1.0 . 0.00 2693 2039 A 101 ARG HBy A 21 GLU H 1.0 . 3.58 2694 2040 A 21 GLU H A 21 GLU HB2 1.0 . 0.00 2695 2041 A 75 ASN HA A 77 VAL H 1.0 . 4.26 2696 2042 A 78 MET HA A 77 VAL H 1.0 . 0.00 2697 2043 A 20 LEU HDx% A 59 VAL HGx% 1.0 . 3.24 2698 2044 A 20 LEU HBx A 20 LEU HDx% 1.0 . 0.00 2699 2045 A 82 PRO HBy A 89 TRP HE3 1.0 . 4.11 2700 2046 A 80 ALA HB% A 89 TRP HE3 1.0 . 0.00 2701 2047 A 59 VAL HB A 22 ILE HG2% 1.0 . 5.79 2702 2048 A 59 VAL HB A 20 LEU HDx% 1.0 . 0.00 2703 2049 A 36 LEU HBy A 33 ASN H 1.0 . 4.77 2704 2050 A 36 LEU HG A 33 ASN H 1.0 . 0.00 2705 2051 A 20 LEU HG A 100 LEU HDx% 1.0 . 4.07 2706 2052 A 100 LEU HDx% A 22 ILE HG1y 1.0 . 0.00 2707 2053 A 40 ALA HB% A 50 PHE HD% 1.0 . 3.64 2708 2054 A 50 PHE HD% A 36 LEU HDx% 1.0 . 0.00 2709 2055 A 21 GLU HB2 A 103 LEU HDy% 1.0 . 3.46 2710 2056 A 101 ARG HBy A 103 LEU HDy% 1.0 . 0.00 2711 2057 A 61 SER H A 68 ARG HBx 1.0 . 4.74 2712 2058 A 61 SER H A 59 VAL HGy% 1.0 . 0.00 2713 2059 A 30 PHE HA A 59 VAL HGy% 1.0 . 3.91 2714 2060 A 30 PHE HA A 57 LEU HDx% 1.0 . 0.00 2715 2061 A 74 TYR HE% A 51 ALA HA 1.0 . 3.56 2716 2062 A 17 ALA HB% A 19 MET HA 1.0 . 4.55 2717 2063 A 108 ALA HB% A 19 MET HA 1.0 . 0.00 2718 2064 A 39 GLN HBy A 36 LEU HG 1.0 . 5.16 2719 2065 A 39 GLN HBy A 42 LEU HBx 1.0 . 0.00 2720 2066 A 39 GLN HBx A 36 LEU HG 1.0 . 5.13 2721 2067 A 39 GLN HBx A 42 LEU HBx 1.0 . 0.00 2722 2068 A 22 ILE HD1% A 22 ILE HG1x 1.0 . 2.97 2723 2069 A 22 ILE HD1% A 100 LEU HDy% 1.0 . 0.00 2724 2070 A 22 ILE HG1y A 23 ASP HBx 1.0 . 5.50 2725 2071 A 98 TYR HBy A 22 ILE HG1y 1.0 . 0.00 2726 2072 A 11 LEU HDx% A 32 LEU HG 1.0 . 4.33 2727 2073 A 11 LEU HDx% A 56 VAL HB 1.0 . 0.00 2728 2074 A 101 ARG H A 20 LEU HDx% 1.0 . 4.66 2729 2075 A 22 ILE HG2% A 101 ARG H 1.0 . 0.00 2730 2076 A 88 SER H A 87 GLU HBy 1.0 . 4.84 2731 2077 A 31 GLU H A 59 VAL HGx% 1.0 . 4.24 2732 2078 A 31 GLU H A 32 LEU HDy% 1.0 . 0.00 2733 2079 A 88 SER HA A 101 ARG HBy 1.0 . 5.10 2734 2080 A 101 ARG HBy A 100 LEU HA 1.0 . 0.00 2735 2081 A 83 GLN HGx A 88 SER HBy 1.0 . 4.56 2736 2082 A 83 GLN HBy A 88 SER HBy 1.0 . 0.00 2737 2083 A 99 GLN HE21 A 83 GLN HBy 1.0 . 4.74 2738 2084 A 99 GLN HE21 A 83 GLN HGx 1.0 . 0.00 2739 2085 A 72 PHE HE% A 57 LEU HDx% 1.0 . 4.23 2740 2086 A 72 PHE HE% A 59 VAL HGy% 1.0 . 0.00 2741 2087 A 61 SER HBx A 25 LEU HDy% 1.0 . 4.82 2742 2088 A 61 SER HBx A 68 ARG HBx 1.0 . 0.00 2743 2089 A 20 LEU HBy A 100 LEU HDx% 1.0 . 3.86 2744 2090 A 100 LEU HDx% A 57 LEU HDx% 1.0 . 0.00 2745 2091 A 56 VAL HGy% A 11 LEU HG 1.0 . 3.95 2746 2092 A 56 VAL HGy% A 36 LEU HG 1.0 . 0.00 2747 2093 A 83 GLN HA A 83 GLN HBy 1.0 . 3.52 2748 2094 A 83 GLN HA A 83 GLN HGx 1.0 . 0.00 2749 2095 A 80 ALA HB% A 89 TRP HZ3 1.0 . 4.47 2750 2096 A 82 PRO HBy A 89 TRP HZ3 1.0 . 0.00 2751 2097 A 22 ILE HG1x A 59 VAL HGy% 1.0 . 4.18 2752 2098 A 59 VAL HGy% A 100 LEU HDy% 1.0 . 0.00 2753 2099 A 22 ILE HG2% A 22 ILE HG1x 1.0 . 3.57 2754 2100 A 22 ILE HG2% A 100 LEU HDy% 1.0 . 0.00 2755 2101 A 72 PHE HE% A 22 ILE HG2% 1.0 . 4.47 2756 2102 A 72 PHE HE% A 20 LEU HDx% 1.0 . 0.00 2757 2103 A 60 GLU H A 31 GLU H 1.0 . 4.46 2758 2104 A 60 GLU H A 61 SER H 1.0 . 0.00 2759 2105 A 42 LEU HBx A 39 GLN H 1.0 . 4.45 2760 2106 A 36 LEU HG A 39 GLN H 1.0 . 0.00 2761 2107 A 20 LEU HBy A 20 LEU HDx% 1.0 . 3.13 2762 2108 A 20 LEU HDx% A 57 LEU HDx% 1.0 . 0.00 2763 2109 A 19 MET HA A 20 LEU H 1.0 . 3.88 2764 2110 A 28 TRP HA A 20 LEU H 1.0 . 0.00 2765 2111 A 82 PRO HA A 83 GLN HBx 1.0 . 5.52 2766 2112 A 82 PRO HA A 83 GLN HGy 1.0 . 0.00 2767 2113 A 41 ASP HA A 40 ALA H 1.0 . 4.33 2768 2114 A 38 ASP HA A 40 ALA H 1.0 . 0.00 2769 2115 A 80 ALA HB% A 77 VAL HGx% 1.0 . 4.44 2770 2116 A 80 ALA HB% A 10 LEU HG 1.0 . 0.00 2771 2117 A 80 ALA HB% A 91 LEU H 1.0 . 3.97 2772 2118 A 91 LEU H A 90 ARG HGy 1.0 . 0.00 2773 2119 A 72 PHE HZ A 22 ILE HG1x 1.0 . 4.96 2774 2120 A 72 PHE HZ A 100 LEU HDy% 1.0 . 0.00 2775 2121 A 36 LEU HG A 39 GLN HGx 1.0 . 4.92 2776 2122 A 42 LEU HBx A 39 GLN HGx 1.0 . 0.00 2777 2123 A 20 LEU HDx% A 59 VAL HGy% 1.0 . 3.56 2778 2124 A 22 ILE HG2% A 59 VAL HGy% 1.0 . 0.00 2779 2125 A 108 ALA HB% A 18 ASP HA 1.0 . 4.70 2780 2126 A 17 ALA HB% A 18 ASP HA 1.0 . 0.00 2781 2127 A 17 ALA HB% A 103 LEU HB3 1.0 . 3.83 2782 2128 A 103 LEU HG A 103 LEU HB3 1.0 . 0.00 2783 2129 A 47 ASP H A 46 ALA H 1.0 . 2.79 2784 2130 A 45 GLU H A 46 ALA H 1.0 . 0.00 2785 2131 A 42 LEU HBx A 41 ASP H 1.0 . 4.16 2786 2132 A 44 ALA HB% A 41 ASP H 1.0 . 0.00 2787 2133 A 43 ALA HB% A 49 PRO HDy 1.0 . 4.89 2788 2134 A 43 ALA HB% A 37 LEU HA 1.0 . 0.00 2789 2135 A 43 ALA HB% A 39 GLN HA 1.0 . 0.00 2790 2136 A 91 LEU HDx% A 91 LEU HBx 1.0 . 2.96 2791 2137 A 91 LEU HG A 91 LEU HDx% 1.0 . 0.00 2792 2138 A 22 ILE HG2% A 98 TYR HBy 1.0 . 4.26 2793 2139 A 22 ILE HG2% A 23 ASP HBx 1.0 . 0.00 2794 2140 A 100 LEU HDx% A 59 VAL HGx% 1.0 . 3.88 2795 2141 A 100 LEU HDx% A 32 LEU HDy% 1.0 . 0.00 2796 2142 A 56 VAL HB A 33 ASN H 1.0 . 3.84 2797 2143 A 33 ASN H A 32 LEU HBy 1.0 . 0.00 2798 2144 A 32 LEU HG A 33 ASN H 1.0 . 0.00 2799 2145 A 36 LEU HG A 39 GLN HGy 1.0 . 5.01 2800 2146 A 42 LEU HBx A 39 GLN HGy 1.0 . 0.00 2801 2147 A 100 LEU HDx% A 20 LEU HDx% 1.0 . 3.54 2802 2148 A 22 ILE HG2% A 100 LEU HDx% 1.0 . 0.00 2803 2149 A 88 SER HA A 83 GLN HBx 1.0 . 5.45 2804 2150 A 88 SER HA A 83 GLN HGy 1.0 . 0.00 2805 2151 A 74 TYR HE% A 75 ASN H 1.0 . 3.98 2806 2152 A 75 ASN HD22 A 75 ASN H 1.0 . 0.00 2807 2153 A 99 GLN HE22 A 83 GLN HBy 1.0 . 4.89 2808 2154 A 99 GLN HE22 A 83 GLN HGx 1.0 . 0.00 2809 2155 A 61 SER HBy A 68 ARG HBx 1.0 . 4.67 2810 2156 A 61 SER HBy A 25 LEU HDy% 1.0 . 0.00 2811 2157 A 57 LEU HDx% A 30 PHE HBy 1.0 . 4.44 2812 2158 A 32 LEU HDx% A 30 PHE HBy 1.0 . 0.00 2813 2159 A 30 PHE HBy A 59 VAL HGy% 1.0 . 0.00 2814 2160 A 98 TYR HD% A 97 ALA HB% 1.0 . 4.55 2815 2161 A 98 TYR HD% A 92 THR HG2% 1.0 . 0.00 2816 2162 A 74 TYR HD% A 51 ALA HA 1.0 . 3.60 2817 2163 A 74 TYR HD% A 75 ASN HA 1.0 . 0.00 2818 2164 A 74 TYR HD% A 78 MET HA 1.0 . 0.00 2819 2165 A 72 PHE HE% A 70 TRP HBy 1.0 . 4.54 2820 2166 A 70 TRP HZ3 A 70 TRP HBy 1.0 . 0.00 2821 2167 A 33 ASN HD21 A 33 ASN HBy 1.0 . 3.83 2822 2168 A 33 ASN HD21 A 54 ASP HBx 1.0 . 0.00 2823 2169 A 57 LEU HDx% A 100 LEU HDy% 1.0 . 3.48 2824 2170 A 20 LEU HBy A 100 LEU HDy% 1.0 . 0.00 2825 2171 A 17 ALA HB% A 102 CYS HA 1.0 . 4.12 2826 2172 A 103 LEU HG A 102 CYS HA 1.0 . 0.00 2827 2173 A 43 ALA H A 41 ASP HBy 1.0 . 4.51 2828 2173 A 43 ALA H A 41 ASP HBx 1.0 . 4.51 2829 2174 A 50 PHE HD% A 50 PHE HZ 1.0 . 3.66 2830 2175 A 44 ALA HB% A 47 ASP H 1.0 . 4.13 2831 2176 A 93 THR HA A 96 GLY H 1.0 . 4.34 2832 2177 A 89 TRP HE1 A 100 LEU HBy 1.0 . 4.96 2833 2177 A 89 TRP HE1 A 100 LEU HBx 1.0 . 4.96 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 13 GLU H A 10 LEU O 1.0 . 2.0 2 2 A 10 LEU O A 13 GLU N 1.0 . 3.0 3 3 A 14 LEU H A 10 LEU O 1.0 . 2.0 4 4 A 10 LEU O A 14 LEU N 1.0 . 3.0 5 5 A 15 GLU H A 11 LEU O 1.0 . 2.0 6 6 A 11 LEU O A 15 GLU N 1.0 . 3.0 7 7 A 17 ALA H A 14 LEU O 1.0 . 2.0 8 8 A 14 LEU O A 17 ALA N 1.0 . 3.0 9 9 A 19 MET H A 103 LEU O 1.0 . 2.0 10 10 A 103 LEU O A 19 MET N 1.0 . 3.0 11 11 A 21 GLU H A 101 ARG O 1.0 . 2.0 12 12 A 101 ARG O A 21 GLU N 1.0 . 3.0 13 13 A 23 ASP H A 99 GLN O 1.0 . 2.0 14 14 A 99 GLN O A 23 ASP N 1.0 . 3.0 15 15 A 25 LEU H A 22 ILE O 1.0 . 2.0 16 16 A 22 ILE O A 25 LEU N 1.0 . 3.0 17 17 A 28 TRP H A 60 GLU O 1.0 . 2.0 18 18 A 60 GLU O A 28 TRP N 1.0 . 3.0 19 19 A 33 ASN H A 56 VAL O 1.0 . 2.0 20 20 A 56 VAL O A 33 ASN N 1.0 . 3.0 21 21 A 34 GLU H A 32 LEU O 1.0 . 2.0 22 22 A 32 LEU O A 34 GLU N 1.0 . 3.0 23 23 A 37 LEU H A 33 ASN O 1.0 . 2.0 24 24 A 33 ASN O A 37 LEU N 1.0 . 3.0 25 25 A 38 ASP H A 34 GLU O 1.0 . 2.0 26 26 A 34 GLU O A 38 ASP N 1.0 . 3.0 27 27 A 40 ALA H A 36 LEU O 1.0 . 2.0 28 28 A 36 LEU O A 40 ALA N 1.0 . 3.0 29 29 A 41 ASP H A 37 LEU O 1.0 . 2.0 30 30 A 37 LEU O A 41 ASP N 1.0 . 3.0 31 31 A 42 LEU H A 38 ASP O 1.0 . 2.0 32 32 A 38 ASP O A 42 LEU N 1.0 . 3.0 33 33 A 43 ALA H A 39 GLN O 1.0 . 2.0 34 34 A 39 GLN O A 43 ALA N 1.0 . 3.0 35 35 A 44 ALA H A 40 ALA O 1.0 . 2.0 36 36 A 40 ALA O A 44 ALA N 1.0 . 3.0 37 37 A 45 GLU H A 41 ASP O 1.0 . 2.0 38 38 A 41 ASP O A 45 GLU N 1.0 . 3.0 39 39 A 46 ALA H A 43 ALA O 1.0 . 2.0 40 40 A 43 ALA O A 46 ALA N 1.0 . 3.0 41 41 A 47 ASP H A 44 ALA O 1.0 . 2.0 42 42 A 44 ALA O A 47 ASP N 1.0 . 3.0 43 43 A 48 GLN H A 43 ALA O 1.0 . 2.0 44 44 A 43 ALA O A 48 GLN N 1.0 . 3.0 45 45 A 56 VAL H A 72 PHE O 1.0 . 2.0 46 46 A 72 PHE O A 56 VAL N 1.0 . 3.0 47 47 A 57 LEU H A 72 PHE O 1.0 . 2.0 48 48 A 72 PHE O A 57 LEU N 1.0 . 3.0 49 49 A 58 ALA H A 31 GLU O 1.0 . 2.0 50 50 A 31 GLU O A 58 ALA N 1.0 . 3.0 51 51 A 59 VAL H A 70 TRP O 1.0 . 2.0 52 52 A 70 TRP O A 59 VAL N 1.0 . 3.0 53 53 A 60 GLU H A 29 ARG O 1.0 . 2.0 54 54 A 29 ARG O A 60 GLU N 1.0 . 3.0 55 55 A 68 ARG H A 61 SER O 1.0 . 2.0 56 56 A 61 SER O A 68 ARG N 1.0 . 3.0 57 57 A 70 TRP H A 59 VAL O 1.0 . 2.0 58 58 A 59 VAL O A 70 TRP N 1.0 . 3.0 59 59 A 72 PHE H A 57 LEU O 1.0 . 2.0 60 60 A 57 LEU O A 72 PHE N 1.0 . 3.0 61 61 A 74 TYR H A 54 ASP O 1.0 . 2.0 62 62 A 54 ASP O A 74 TYR N 1.0 . 3.0 63 63 A 75 ASN H A 52 SER O 1.0 . 2.0 64 64 A 52 SER O A 75 ASN N 1.0 . 3.0 65 65 A 77 VAL H A 73 SER O 1.0 . 2.0 66 66 A 73 SER O A 77 VAL N 1.0 . 3.0 67 67 A 78 MET H A 74 TYR O 1.0 . 2.0 68 68 A 74 TYR O A 78 MET N 1.0 . 3.0 69 69 A 79 GLU H A 75 ASN O 1.0 . 2.0 70 70 A 75 ASN O A 79 GLU N 1.0 . 3.0 71 71 A 81 GLU H A 90 ARG O 1.0 . 2.0 72 72 A 90 ARG O A 81 GLU N 1.0 . 3.0 73 73 A 83 GLN H A 88 SER O 1.0 . 2.0 74 74 A 88 SER O A 83 GLN N 1.0 . 3.0 75 75 A 86 GLY H A 83 GLN O 1.0 . 2.0 76 76 A 83 GLN O A 86 GLY N 1.0 . 3.0 77 77 A 91 LEU H A 98 TYR O 1.0 . 2.0 78 78 A 98 TYR O A 91 LEU N 1.0 . 3.0 79 79 A 96 GLY H A 93 THR O 1.0 . 2.0 80 80 A 93 THR O A 96 GLY N 1.0 . 3.0 81 81 A 98 TYR H A 91 LEU O 1.0 . 2.0 82 82 A 91 LEU O A 98 TYR N 1.0 . 3.0 stop_ save_ save_DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_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 8 ARG C A 9 TYR N A 9 TYR CA A 9 TYR C 1.0 -97.5 -47.3 PHI 2 2 A 9 TYR N A 9 TYR CA A 9 TYR C A 10 LEU N 1.0 92.5 187.2 PSI 3 3 A 9 TYR C A 10 LEU N A 10 LEU CA A 10 LEU C 1.0 -82.0 -42.0 PHI 4 4 A 10 LEU N A 10 LEU CA A 10 LEU C A 11 LEU N 1.0 -57.8 -12.0 PSI 5 5 A 10 LEU C A 11 LEU N A 11 LEU CA A 11 LEU C 1.0 -79.3 -39.3 PHI 6 6 A 11 LEU N A 11 LEU CA A 11 LEU C A 12 ASP N 1.0 -62.5 -22.5 PSI 7 7 A 11 LEU C A 12 ASP N A 12 ASP CA A 12 ASP C 1.0 -81.2 -41.2 PHI 8 8 A 12 ASP N A 12 ASP CA A 12 ASP C A 13 GLU N 1.0 -61.9 -21.9 PSI 9 9 A 12 ASP C A 13 GLU N A 13 GLU CA A 13 GLU C 1.0 -88.1 -48.1 PHI 10 10 A 13 GLU N A 13 GLU CA A 13 GLU C A 14 LEU N 1.0 -61.0 -21.0 PSI 11 11 A 13 GLU C A 14 LEU N A 14 LEU CA A 14 LEU C 1.0 -86.6 -46.6 PHI 12 12 A 14 LEU N A 14 LEU CA A 14 LEU C A 15 GLU N 1.0 -62.2 -22.2 PSI 13 13 A 14 LEU C A 15 GLU N A 15 GLU CA A 15 GLU C 1.0 -85.6 -42.8 PHI 14 14 A 15 GLU N A 15 GLU CA A 15 GLU C A 16 THR N 1.0 -52.8 -6.0 PSI 15 15 A 15 GLU C A 16 THR N A 16 THR CA A 16 THR C 1.0 -134.9 -79.6 PHI 16 16 A 16 THR N A 16 THR CA A 16 THR C A 17 ALA N 1.0 -27.4 26.9 PSI 17 17 A 17 ALA C A 18 ASP N A 18 ASP CA A 18 ASP C 1.0 -122.1 -63.2 PHI 18 18 A 18 ASP N A 18 ASP CA A 18 ASP C A 19 MET N 1.0 -61.2 -16.6 PSI 19 19 A 18 ASP C A 19 MET N A 19 MET CA A 19 MET C 1.0 -183.7 -82.3 PHI 20 20 A 19 MET N A 19 MET CA A 19 MET C A 20 LEU N 1.0 130.3 170.3 PSI 21 21 A 19 MET C A 20 LEU N A 20 LEU CA A 20 LEU C 1.0 -164.2 -105.4 PHI 22 22 A 20 LEU N A 20 LEU CA A 20 LEU C A 21 GLU N 1.0 116.7 168.2 PSI 23 23 A 20 LEU C A 21 GLU N A 21 GLU CA A 21 GLU C 1.0 -155.7 -99.0 PHI 24 24 A 21 GLU N A 21 GLU CA A 21 GLU C A 22 ILE N 1.0 112.1 152.1 PSI 25 25 A 21 GLU C A 22 ILE N A 22 ILE CA A 22 ILE C 1.0 -154.3 -100.1 PHI 26 26 A 22 ILE N A 22 ILE CA A 22 ILE C A 23 ASP N 1.0 98.3 139.6 PSI 27 27 A 22 ILE C A 23 ASP N A 23 ASP CA A 23 ASP C 1.0 32.7 72.7 PHI 28 28 A 23 ASP N A 23 ASP CA A 23 ASP C A 24 GLY N 1.0 23.8 63.8 PSI 29 29 A 23 ASP C A 24 GLY N A 24 GLY CA A 24 GLY C 1.0 59.7 99.7 PHI 30 30 A 24 GLY N A 24 GLY CA A 24 GLY C A 25 LEU N 1.0 -22.0 21.2 PSI 31 31 A 24 GLY C A 25 LEU N A 25 LEU CA A 25 LEU C 1.0 -132.0 -50.9 PHI 32 32 A 25 LEU N A 25 LEU CA A 25 LEU C A 26 HIS N 1.0 108.8 166.6 PSI 33 33 A 25 LEU C A 26 HIS N A 26 HIS CA A 26 HIS C 1.0 -119.7 -59.8 PHI 34 34 A 26 HIS N A 26 HIS CA A 26 HIS C A 27 ALA N 1.0 106.8 151.3 PSI 35 35 A 26 HIS C A 27 ALA N A 27 ALA CA A 27 ALA C 1.0 -160.4 -52.7 PHI 36 36 A 27 ALA N A 27 ALA CA A 27 ALA C A 28 TRP N 1.0 59.8 163.5 PSI 37 37 A 27 ALA C A 28 TRP N A 28 TRP CA A 28 TRP C 1.0 -122.5 -65.7 PHI 38 38 A 28 TRP N A 28 TRP CA A 28 TRP C A 29 ARG N 1.0 -56.6 -16.6 PSI 39 39 A 28 TRP C A 29 ARG N A 29 ARG CA A 29 ARG C 1.0 -196.0 -99.5 PHI 40 40 A 29 ARG N A 29 ARG CA A 29 ARG C A 30 PHE N 1.0 136.3 176.3 PSI 41 41 A 29 ARG C A 30 PHE N A 30 PHE CA A 30 PHE C 1.0 -171.5 -120.4 PHI 42 42 A 30 PHE N A 30 PHE CA A 30 PHE C A 31 GLU N 1.0 122.7 181.7 PSI 43 43 A 30 PHE C A 31 GLU N A 31 GLU CA A 31 GLU C 1.0 -166.1 -105.5 PHI 44 44 A 31 GLU N A 31 GLU CA A 31 GLU C A 32 LEU N 1.0 125.5 172.7 PSI 45 45 A 31 GLU C A 32 LEU N A 32 LEU CA A 32 LEU C 1.0 -138.9 -84.2 PHI 46 46 A 32 LEU N A 32 LEU CA A 32 LEU C A 33 ASN N 1.0 120.9 160.9 PSI 47 47 A 32 LEU C A 33 ASN N A 33 ASN CA A 33 ASN C 1.0 -107.4 -54.1 PHI 48 48 A 33 ASN N A 33 ASN CA A 33 ASN C A 34 GLU N 1.0 70.6 144.7 PSI 49 49 A 33 ASN C A 34 GLU N A 34 GLU CA A 34 GLU C 1.0 -75.3 -35.3 PHI 50 50 A 34 GLU N A 34 GLU CA A 34 GLU C A 35 ASN N 1.0 -77.4 -6.3 PSI 51 51 A 34 GLU C A 35 ASN N A 35 ASN CA A 35 ASN C 1.0 -82.2 -42.2 PHI 52 52 A 35 ASN N A 35 ASN CA A 35 ASN C A 36 LEU N 1.0 -64.1 -24.1 PSI 53 53 A 35 ASN C A 36 LEU N A 36 LEU CA A 36 LEU C 1.0 -84.4 -44.4 PHI 54 54 A 36 LEU N A 36 LEU CA A 36 LEU C A 37 LEU N 1.0 -63.5 -23.5 PSI 55 55 A 36 LEU C A 37 LEU N A 37 LEU CA A 37 LEU C 1.0 -82.9 -42.9 PHI 56 56 A 37 LEU N A 37 LEU CA A 37 LEU C A 38 ASP N 1.0 -58.4 -18.4 PSI 57 57 A 37 LEU C A 38 ASP N A 38 ASP CA A 38 ASP C 1.0 -85.1 -45.1 PHI 58 58 A 38 ASP N A 38 ASP CA A 38 ASP C A 39 GLN N 1.0 -59.1 -19.1 PSI 59 59 A 38 ASP C A 39 GLN N A 39 GLN CA A 39 GLN C 1.0 -83.9 -43.9 PHI 60 60 A 39 GLN N A 39 GLN CA A 39 GLN C A 40 ALA N 1.0 -60.8 -20.8 PSI 61 61 A 39 GLN C A 40 ALA N A 40 ALA CA A 40 ALA C 1.0 -88.9 -48.9 PHI 62 62 A 40 ALA N A 40 ALA CA A 40 ALA C A 41 ASP N 1.0 -57.3 -17.3 PSI 63 63 A 40 ALA C A 41 ASP N A 41 ASP CA A 41 ASP C 1.0 -87.0 -47.0 PHI 64 64 A 41 ASP N A 41 ASP CA A 41 ASP C A 42 LEU N 1.0 -63.1 -23.1 PSI 65 65 A 41 ASP C A 42 LEU N A 42 LEU CA A 42 LEU C 1.0 -88.3 -48.3 PHI 66 66 A 42 LEU N A 42 LEU CA A 42 LEU C A 43 ALA N 1.0 -58.7 -18.7 PSI 67 67 A 42 LEU C A 43 ALA N A 43 ALA CA A 43 ALA C 1.0 -87.1 -47.1 PHI 68 68 A 43 ALA N A 43 ALA CA A 43 ALA C A 44 ALA N 1.0 -59.3 -19.3 PSI 69 69 A 43 ALA C A 44 ALA N A 44 ALA CA A 44 ALA C 1.0 -86.9 -46.9 PHI 70 70 A 44 ALA N A 44 ALA CA A 44 ALA C A 45 GLU N 1.0 -59.9 -19.9 PSI 71 71 A 44 ALA C A 45 GLU N A 45 GLU CA A 45 GLU C 1.0 -85.3 -45.3 PHI 72 72 A 45 GLU N A 45 GLU CA A 45 GLU C A 46 ALA N 1.0 -49.5 -1.2 PSI 73 73 A 45 GLU C A 46 ALA N A 46 ALA CA A 46 ALA C 1.0 -114.6 -74.6 PHI 74 74 A 46 ALA N A 46 ALA CA A 46 ALA C A 47 ASP N 1.0 -17.3 22.7 PSI 75 75 A 46 ALA C A 47 ASP N A 47 ASP CA A 47 ASP C 1.0 39.2 94.5 PHI 76 76 A 47 ASP N A 47 ASP CA A 47 ASP C A 48 GLN N 1.0 -3.8 65.3 PSI 77 77 A 47 ASP C A 48 GLN N A 48 GLN CA A 48 GLN C 1.0 -146.5 -65.1 PHI 78 78 A 48 GLN N A 48 GLN CA A 48 GLN C A 49 PRO N 1.0 66.3 189.1 PSI 79 79 A 49 PRO N A 49 PRO CA A 49 PRO C A 50 PHE N 1.0 126.7 166.7 PSI 80 80 A 49 PRO C A 50 PHE N A 50 PHE CA A 50 PHE C 1.0 -169.7 -44.7 PHI 81 81 A 50 PHE N A 50 PHE CA A 50 PHE C A 51 ALA N 1.0 104.8 159.9 PSI 82 82 A 50 PHE C A 51 ALA N A 51 ALA CA A 51 ALA C 1.0 -166.7 -62.4 PHI 83 83 A 51 ALA N A 51 ALA CA A 51 ALA C A 52 SER N 1.0 119.9 187.4 PSI 84 84 A 51 ALA C A 52 SER N A 52 SER CA A 52 SER C 1.0 -152.6 -34.0 PHI 85 85 A 52 SER N A 52 SER CA A 52 SER C A 53 GLU N 1.0 108.5 162.1 PSI 86 86 A 55 TRP C A 56 VAL N A 56 VAL CA A 56 VAL C 1.0 -172.8 -110.4 PHI 87 87 A 56 VAL C A 57 LEU N A 57 LEU CA A 57 LEU C 1.0 -167.2 -118.3 PHI 88 88 A 57 LEU N A 57 LEU CA A 57 LEU C A 58 ALA N 1.0 112.5 152.5 PSI 89 89 A 57 LEU C A 58 ALA N A 58 ALA CA A 58 ALA C 1.0 -148.3 -91.6 PHI 90 90 A 58 ALA N A 58 ALA CA A 58 ALA C A 59 VAL N 1.0 100.1 158.2 PSI 91 91 A 58 ALA C A 59 VAL N A 59 VAL CA A 59 VAL C 1.0 -148.3 -104.5 PHI 92 92 A 59 VAL N A 59 VAL CA A 59 VAL C A 60 GLU N 1.0 105.4 164.4 PSI 93 93 A 59 VAL C A 60 GLU N A 60 GLU CA A 60 GLU C 1.0 -150.6 -102.6 PHI 94 94 A 60 GLU N A 60 GLU CA A 60 GLU C A 61 SER N 1.0 113.4 159.2 PSI 95 95 A 60 GLU C A 61 SER N A 61 SER CA A 61 SER C 1.0 -178.0 -80.3 PHI 96 96 A 61 SER N A 61 SER CA A 61 SER C A 62 LEU N 1.0 116.3 159.1 PSI 97 97 A 61 SER C A 62 LEU N A 62 LEU CA A 62 LEU C 1.0 -153.4 -61.8 PHI 98 98 A 62 LEU N A 62 LEU CA A 62 LEU C A 63 ASP N 1.0 107.8 163.0 PSI 99 99 A 62 LEU C A 63 ASP N A 63 ASP CA A 63 ASP C 1.0 -140.0 -15.6 PHI 100 100 A 63 ASP N A 63 ASP CA A 63 ASP C A 64 GLY N 1.0 97.9 169.1 PSI 101 101 A 65 ARG C A 66 THR N A 66 THR CA A 66 THR C 1.0 -148.0 -35.2 PHI 102 102 A 66 THR N A 66 THR CA A 66 THR C A 67 ARG N 1.0 92.8 172.4 PSI 103 103 A 66 THR C A 67 ARG N A 67 ARG CA A 67 ARG C 1.0 -123.2 -55.9 PHI 104 104 A 67 ARG N A 67 ARG CA A 67 ARG C A 68 ARG N 1.0 100.4 165.0 PSI 105 105 A 67 ARG C A 68 ARG N A 68 ARG CA A 68 ARG C 1.0 -159.7 -87.8 PHI 106 106 A 68 ARG N A 68 ARG CA A 68 ARG C A 69 GLU N 1.0 117.5 157.5 PSI 107 107 A 68 ARG C A 69 GLU N A 69 GLU CA A 69 GLU C 1.0 -152.4 -94.3 PHI 108 108 A 69 GLU N A 69 GLU CA A 69 GLU C A 70 TRP N 1.0 124.7 164.7 PSI 109 109 A 69 GLU C A 70 TRP N A 70 TRP CA A 70 TRP C 1.0 -169.0 -91.1 PHI 110 110 A 70 TRP N A 70 TRP CA A 70 TRP C A 71 ARG N 1.0 126.6 167.4 PSI 111 111 A 70 TRP C A 71 ARG N A 71 ARG CA A 71 ARG C 1.0 -159.8 -101.9 PHI 112 112 A 71 ARG N A 71 ARG CA A 71 ARG C A 72 PHE N 1.0 101.4 163.8 PSI 113 113 A 71 ARG C A 72 PHE N A 72 PHE CA A 72 PHE C 1.0 -145.9 -105.9 PHI 114 114 A 72 PHE N A 72 PHE CA A 72 PHE C A 73 SER N 1.0 116.0 156.0 PSI 115 115 A 72 PHE C A 73 SER N A 73 SER CA A 73 SER C 1.0 -142.3 -31.6 PHI 116 116 A 73 SER N A 73 SER CA A 73 SER C A 74 TYR N 1.0 144.1 190.0 PSI 117 117 A 73 SER C A 74 TYR N A 74 TYR CA A 74 TYR C 1.0 -78.3 -38.3 PHI 118 118 A 74 TYR N A 74 TYR CA A 74 TYR C A 75 ASN N 1.0 -61.7 -21.7 PSI 119 119 A 74 TYR C A 75 ASN N A 75 ASN CA A 75 ASN C 1.0 -81.4 -41.4 PHI 120 120 A 75 ASN N A 75 ASN CA A 75 ASN C A 76 ALA N 1.0 -61.0 -21.0 PSI 121 121 A 75 ASN C A 76 ALA N A 76 ALA CA A 76 ALA C 1.0 -83.3 -43.3 PHI 122 122 A 76 ALA N A 76 ALA CA A 76 ALA C A 77 VAL N 1.0 -60.6 -20.6 PSI 123 123 A 76 ALA C A 77 VAL N A 77 VAL CA A 77 VAL C 1.0 -88.5 -48.5 PHI 124 124 A 77 VAL N A 77 VAL CA A 77 VAL C A 78 MET N 1.0 -60.7 -20.3 PSI 125 125 A 77 VAL C A 78 MET N A 78 MET CA A 78 MET C 1.0 -85.5 -45.5 PHI 126 126 A 78 MET N A 78 MET CA A 78 MET C A 79 GLU N 1.0 -54.4 -2.6 PSI 127 127 A 78 MET C A 79 GLU N A 79 GLU CA A 79 GLU C 1.0 -119.6 -77.5 PHI 128 128 A 79 GLU N A 79 GLU CA A 79 GLU C A 80 ALA N 1.0 -31.5 8.5 PSI 129 129 A 79 GLU C A 80 ALA N A 80 ALA CA A 80 ALA C 1.0 -143.1 -11.6 PHI 130 130 A 80 ALA N A 80 ALA CA A 80 ALA C A 81 GLU N 1.0 115.4 163.9 PSI 131 131 A 80 ALA C A 81 GLU N A 81 GLU CA A 81 GLU C 1.0 -152.3 -78.8 PHI 132 132 A 81 GLU N A 81 GLU CA A 81 GLU C A 82 PRO N 1.0 93.4 176.3 PSI 133 133 A 82 PRO C A 83 GLN N A 83 GLN CA A 83 GLN C 1.0 -146.2 -60.5 PHI 134 134 A 83 GLN N A 83 GLN CA A 83 GLN C A 84 ALA N 1.0 83.5 203.9 PSI 135 135 A 83 GLN C A 84 ALA N A 84 ALA CA A 84 ALA C 1.0 -79.7 -39.7 PHI 136 136 A 84 ALA N A 84 ALA CA A 84 ALA C A 85 ASP N 1.0 -46.3 -6.3 PSI 137 137 A 84 ALA C A 85 ASP N A 85 ASP CA A 85 ASP C 1.0 -117.6 -61.5 PHI 138 138 A 85 ASP N A 85 ASP CA A 85 ASP C A 86 GLY N 1.0 -17.9 22.1 PSI 139 139 A 85 ASP C A 86 GLY N A 86 GLY CA A 86 GLY C 1.0 59.8 101.4 PHI 140 140 A 86 GLY N A 86 GLY CA A 86 GLY C A 87 GLU N 1.0 -12.0 51.7 PSI 141 141 A 86 GLY C A 87 GLU N A 87 GLU CA A 87 GLU C 1.0 -137.1 -55.8 PHI 142 142 A 87 GLU C A 88 SER N A 88 SER CA A 88 SER C 1.0 -163.4 -64.5 PHI 143 143 A 88 SER N A 88 SER CA A 88 SER C A 89 TRP N 1.0 102.9 167.5 PSI 144 144 A 88 SER C A 89 TRP N A 89 TRP CA A 89 TRP C 1.0 -166.4 -96.6 PHI 145 145 A 89 TRP N A 89 TRP CA A 89 TRP C A 90 ARG N 1.0 125.5 173.6 PSI 146 146 A 89 TRP C A 90 ARG N A 90 ARG CA A 90 ARG C 1.0 -171.9 -75.0 PHI 147 147 A 90 ARG N A 90 ARG CA A 90 ARG C A 91 LEU N 1.0 96.8 150.5 PSI 148 148 A 90 ARG C A 91 LEU N A 91 LEU CA A 91 LEU C 1.0 -147.9 -92.2 PHI 149 149 A 91 LEU N A 91 LEU CA A 91 LEU C A 92 THR N 1.0 102.7 157.5 PSI 150 150 A 91 LEU C A 92 THR N A 92 THR CA A 92 THR C 1.0 -157.4 -63.3 PHI 151 151 A 92 THR N A 92 THR CA A 92 THR C A 93 THR N 1.0 97.8 180.0 PSI 152 152 A 92 THR C A 93 THR N A 93 THR CA A 93 THR C 1.0 -165.6 -62.3 PHI 153 153 A 93 THR N A 93 THR CA A 93 THR C A 94 GLY N 1.0 139.5 186.5 PSI 154 154 A 93 THR C A 94 GLY N A 94 GLY CA A 94 GLY C 1.0 -81.7 -40.4 PHI 155 155 A 94 GLY N A 94 GLY CA A 94 GLY C A 95 GLU N 1.0 -47.4 1.9 PSI 156 156 A 94 GLY C A 95 GLU N A 95 GLU CA A 95 GLU C 1.0 -131.0 -50.6 PHI 157 157 A 95 GLU N A 95 GLU CA A 95 GLU C A 96 GLY N 1.0 -48.7 25.5 PSI 158 158 A 96 GLY C A 97 ALA N A 97 ALA CA A 97 ALA C 1.0 -180.6 -78.3 PHI 159 159 A 97 ALA N A 97 ALA CA A 97 ALA C A 98 TYR N 1.0 106.3 166.5 PSI 160 160 A 97 ALA C A 98 TYR N A 98 TYR CA A 98 TYR C 1.0 -158.6 -97.6 PHI 161 161 A 98 TYR N A 98 TYR CA A 98 TYR C A 99 GLN N 1.0 108.1 179.7 PSI 162 162 A 98 TYR C A 99 GLN N A 99 GLN CA A 99 GLN C 1.0 -145.2 -83.2 PHI 163 163 A 99 GLN N A 99 GLN CA A 99 GLN C A 100 LEU N 1.0 103.8 144.4 PSI 164 164 A 99 GLN C A 100 LEU N A 100 LEU CA A 100 LEU C 1.0 -135.1 -95.1 PHI 165 165 A 100 LEU N A 100 LEU CA A 100 LEU C A 101 ARG N 1.0 112.4 164.5 PSI 166 166 A 100 LEU C A 101 ARG N A 101 ARG CA A 101 ARG C 1.0 -143.7 -103.4 PHI 167 167 A 101 ARG N A 101 ARG CA A 101 ARG C A 102 CYS N 1.0 108.6 148.6 PSI 168 168 A 101 ARG C A 102 CYS N A 102 CYS CA A 102 CYS C 1.0 -125.1 -83.9 PHI 169 169 A 102 CYS N A 102 CYS CA A 102 CYS C A 103 LEU N 1.0 109.4 149.7 PSI 170 170 A 102 CYS C A 103 LEU N A 103 LEU CA A 103 LEU C 1.0 -151.6 -46.7 PHI 171 171 A 103 LEU N A 103 LEU CA A 103 LEU C A 104 GLY N 1.0 92.3 182.9 PSI stop_ save_