data_nef_c15109_2jng save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 SER middle . . 3 A 3 HIS middle . . 4 A 4 MET middle . . 5 A 5 ARG middle . . 6 A 6 SER middle . . 7 A 7 GLU middle . . 8 A 8 PHE middle . . 9 A 9 ALA middle . . 10 A 10 SER middle . . 11 A 11 GLY middle . false 12 A 12 ASN middle . . 13 A 13 THR middle . . 14 A 14 TYR middle . . 15 A 15 ALA middle . . 16 A 16 LEU middle . . 17 A 17 TYR middle . . 18 A 18 VAL middle . . 19 A 19 ARG middle . . 20 A 20 ASP middle . . 21 A 21 THR middle . . 22 A 22 LEU middle . . 23 A 23 GLN middle . . 24 A 24 PRO middle . false 25 A 25 GLY middle . false 26 A 26 MET middle . . 27 A 27 ARG middle . . 28 A 28 VAL middle . . 29 A 29 ARG middle . . 30 A 30 MET middle . . 31 A 31 LEU middle . . 32 A 32 ASP middle . . 33 A 33 ASP middle . . 34 A 34 TYR middle . . 35 A 35 GLU middle . . 36 A 36 GLU middle . . 37 A 37 ILE middle . . 38 A 38 SER middle . . 39 A 39 ALA middle . . 40 A 40 GLY middle . false 41 A 41 ASP middle . . 42 A 42 GLU middle . . 43 A 43 GLY middle . false 44 A 44 GLU middle . . 45 A 45 PHE middle . . 46 A 46 ARG middle . . 47 A 47 GLN middle . . 48 A 48 SER middle . . 49 A 49 ASN middle . . 50 A 50 ASN middle . . 51 A 51 GLY middle . false 52 A 52 VAL middle . . 53 A 53 PRO middle . false 54 A 54 PRO middle . false 55 A 55 VAL middle . . 56 A 56 GLN middle . . 57 A 57 VAL middle . . 58 A 58 PHE middle . . 59 A 59 TRP middle . . 60 A 60 GLU middle . . 61 A 61 SER middle . . 62 A 62 THR middle . . 63 A 63 GLY middle . false 64 A 64 ARG middle . . 65 A 65 THR middle . . 66 A 66 TYR middle . . 67 A 67 TRP middle . . 68 A 68 VAL middle . . 69 A 69 HIS middle . . 70 A 70 TRP middle . . 71 A 71 HIS middle . . 72 A 72 MET middle . . 73 A 73 LEU middle . . 74 A 74 GLU middle . . 75 A 75 ILE middle . . 76 A 76 LEU middle . . 77 A 77 GLY middle . false 78 A 78 PHE middle . . 79 A 79 GLU middle . . 80 A 80 GLU middle . . 81 A 81 ASP middle . . 82 A 82 ILE middle . . 83 A 83 GLU middle . . 84 A 84 ASP middle . . 85 A 85 MET middle . . 86 A 86 VAL middle . . 87 A 87 GLU middle . . 88 A 88 ALA middle . . 89 A 89 ASP middle . . 90 A 90 GLU middle . . 91 A 91 TYR middle . . 92 A 92 GLN middle . . 93 A 93 GLY middle . false 94 A 94 ALA middle . . 95 A 95 VAL middle . . 96 A 96 ALA middle . . 97 A 97 SER middle . . 98 A 98 ARG middle . . 99 A 99 VAL middle . . 100 A 100 LEU middle . . 101 A 101 GLY middle . false 102 A 102 ARG middle . . 103 A 103 ALA middle . . 104 A 104 LEU middle . . 105 A 105 PRO end . false stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY HA2 H 1 3.881 0.400 A 1 GLY HA3 H 1 3.881 0.400 A 1 GLY C C 13 173.848 0.400 A 1 GLY CA C 13 45.288 0.400 A 2 SER H H 1 8.018 0.020 A 2 SER HA H 1 4.371 0.020 A 2 SER HB2 H 1 3.828 0.400 A 2 SER HB3 H 1 3.828 0.400 A 2 SER C C 13 173.848 0.400 A 2 SER CA C 13 58.287 0.400 A 2 SER CB C 13 63.916 0.400 A 2 SER N N 15 120.389 0.400 A 3 HIS H H 1 7.941 0.020 A 3 HIS HA H 1 4.697 0.020 A 3 HIS HBx H 1 2.780 0.020 A 3 HIS HBy H 1 2.977 0.020 A 3 HIS C C 13 174.822 0.400 A 3 HIS CA C 13 55.965 0.400 A 3 HIS CB C 13 30.779 0.400 A 3 HIS N N 15 127.858 0.400 A 4 MET H H 1 8.523 0.020 A 4 MET HA H 1 4.690 0.020 A 4 MET HBx H 1 1.997 0.020 A 4 MET HBy H 1 2.141 0.020 A 4 MET HGx H 1 2.543 0.020 A 4 MET HGy H 1 2.604 0.020 A 4 MET C C 13 177.337 0.400 A 4 MET CA C 13 55.009 0.400 A 4 MET CB C 13 34.168 0.400 A 4 MET CG C 13 32.255 0.400 A 4 MET N N 15 120.645 0.400 A 5 ARG H H 1 8.596 0.020 A 5 ARG HA H 1 3.202 0.020 A 5 ARG HBy H 1 1.636 0.020 A 5 ARG HBx H 1 0.735 0.020 A 5 ARG HDy H 1 3.176 0.020 A 5 ARG HDx H 1 2.913 0.020 A 5 ARG HGy H 1 1.252 0.020 A 5 ARG HGx H 1 0.990 0.020 A 5 ARG C C 13 177.622 0.400 A 5 ARG CA C 13 60.077 0.400 A 5 ARG CB C 13 30.670 0.400 A 5 ARG CD C 13 44.182 0.400 A 5 ARG CG C 13 26.210 0.400 A 5 ARG N N 15 122.585 0.400 A 6 SER H H 1 8.083 0.020 A 6 SER HA H 1 4.189 0.020 A 6 SER HB2 H 1 3.961 0.400 A 6 SER HB3 H 1 3.961 0.400 A 6 SER C C 13 175.161 0.400 A 6 SER CA C 13 59.790 0.400 A 6 SER CB C 13 62.823 0.400 A 6 SER N N 15 112.270 0.400 A 7 GLU H H 1 8.055 0.020 A 7 GLU HA H 1 4.111 0.020 A 7 GLU HB2 H 1 1.900 0.400 A 7 GLU HB3 H 1 1.900 0.400 A 7 GLU HG2 H 1 2.122 0.400 A 7 GLU HG3 H 1 2.122 0.400 A 7 GLU C C 13 176.233 0.400 A 7 GLU CA C 13 56.785 0.400 A 7 GLU CB C 13 29.666 0.400 A 7 GLU CG C 13 37.269 0.400 A 7 GLU N N 15 120.319 0.400 A 8 PHE H H 1 7.747 0.020 A 8 PHE HA H 1 4.434 0.020 A 8 PHE HBy H 1 3.199 0.020 A 8 PHE HBx H 1 3.051 0.020 A 8 PHE HD1 H 1 7.362 0.400 A 8 PHE HD2 H 1 7.362 0.400 A 8 PHE HE1 H 1 7.060 0.400 A 8 PHE HE2 H 1 7.060 0.400 A 8 PHE CA C 13 57.276 0.400 A 8 PHE CB C 13 40.780 0.400 A 8 PHE CD1 C 13 132.100 0.400 A 8 PHE CE1 C 13 131.800 0.400 A 8 PHE N N 15 119.097 0.400 A 9 ALA HA H 1 4.121 0.020 A 9 ALA HB% H 1 1.423 0.400 A 9 ALA C C 13 177.622 0.400 A 9 ALA CA C 13 53.820 0.400 A 9 ALA CB C 13 19.119 0.400 A 10 SER H H 1 7.830 0.020 A 10 SER HA H 1 4.627 0.020 A 10 SER HBy H 1 4.051 0.020 A 10 SER HBx H 1 3.951 0.020 A 10 SER CA C 13 56.785 0.400 A 10 SER CB C 13 65.255 0.400 A 10 SER N N 15 109.373 0.400 A 11 GLY HAy H 1 3.985 0.020 A 11 GLY HAx H 1 3.833 0.020 A 11 GLY CA C 13 46.600 0.400 A 12 ASN HA H 1 4.593 0.020 A 12 ASN HB2 H 1 2.763 0.400 A 12 ASN HB3 H 1 2.763 0.400 A 12 ASN HD21 H 1 6.961 0.400 A 12 ASN HD22 H 1 6.961 0.400 A 12 ASN C C 13 177.162 0.400 A 12 ASN CA C 13 55.542 0.400 A 12 ASN CB C 13 38.596 0.400 A 12 ASN ND2 N 15 112.500 0.400 A 13 THR H H 1 7.868 0.020 A 13 THR HA H 1 4.047 0.020 A 13 THR HB H 1 4.408 0.020 A 13 THR HG2% H 1 1.381 0.400 A 13 THR C C 13 177.381 0.400 A 13 THR CA C 13 65.583 0.400 A 13 THR CB C 13 68.479 0.400 A 13 THR CG2 C 13 23.341 0.400 A 13 THR N N 15 113.676 0.400 A 14 TYR H H 1 8.121 0.020 A 14 TYR HA H 1 3.459 0.020 A 14 TYR HB2 H 1 2.863 0.400 A 14 TYR HB3 H 1 2.863 0.400 A 14 TYR HD1 H 1 6.617 0.400 A 14 TYR HD2 H 1 6.617 0.400 A 14 TYR HE1 H 1 6.849 0.400 A 14 TYR HE2 H 1 6.849 0.400 A 14 TYR C C 13 176.167 0.400 A 14 TYR CA C 13 61.266 0.400 A 14 TYR CB C 13 38.020 0.400 A 14 TYR CD1 C 13 132.800 0.400 A 14 TYR CE1 C 13 118.500 0.400 A 14 TYR N N 15 124.216 0.400 A 15 ALA H H 1 8.485 0.020 A 15 ALA HA H 1 3.539 0.020 A 15 ALA HB% H 1 1.683 0.400 A 15 ALA C C 13 178.737 0.400 A 15 ALA CA C 13 55.350 0.400 A 15 ALA CB C 13 19.707 0.400 A 15 ALA N N 15 120.082 0.400 A 16 LEU H H 1 7.210 0.020 A 16 LEU HA H 1 3.560 0.020 A 16 LEU HB2 H 1 1.710 0.400 A 16 LEU HB3 H 1 1.710 0.400 A 16 LEU HDx% H 1 0.698 0.400 A 16 LEU HDy% H 1 0.802 0.400 A 16 LEU HG H 1 1.410 0.020 A 16 LEU C C 13 178.278 0.400 A 16 LEU CA C 13 57.490 0.400 A 16 LEU CB C 13 41.300 0.400 A 16 LEU CD1 C 13 22.680 0.400 A 16 LEU CD2 C 13 25.210 0.400 A 16 LEU N N 15 115.389 0.400 A 17 TYR H H 1 7.104 0.020 A 17 TYR HA H 1 4.127 0.020 A 17 TYR HBy H 1 3.061 0.020 A 17 TYR HBx H 1 2.811 0.020 A 17 TYR HD1 H 1 6.851 0.400 A 17 TYR HD2 H 1 6.851 0.400 A 17 TYR HE1 H 1 6.849 0.400 A 17 TYR HE2 H 1 6.849 0.400 A 17 TYR C C 13 178.125 0.400 A 17 TYR CA C 13 60.665 0.400 A 17 TYR CB C 13 37.474 0.400 A 17 TYR CD1 C 13 133.400 0.400 A 17 TYR CE1 C 13 118.500 0.400 A 17 TYR N N 15 120.586 0.400 A 18 VAL H H 1 8.027 0.020 A 18 VAL HA H 1 2.802 0.020 A 18 VAL HB H 1 1.756 0.020 A 18 VAL HGx% H 1 0.428 0.400 A 18 VAL HGy% H 1 0.994 0.400 A 18 VAL C C 13 177.633 0.400 A 18 VAL CA C 13 67.004 0.400 A 18 VAL CB C 13 31.708 0.400 A 18 VAL CG1 C 13 22.152 0.400 A 18 VAL CG2 C 13 22.152 0.400 A 18 VAL N N 15 123.129 0.400 A 19 ARG H H 1 7.623 0.020 A 19 ARG HA H 1 2.515 0.020 A 19 ARG HBy H 1 1.030 0.020 A 19 ARG HBx H 1 -0.138 0.020 A 19 ARG HDy H 1 2.665 0.020 A 19 ARG HDx H 1 2.421 0.020 A 19 ARG HG2 H 1 0.661 0.400 A 19 ARG HG3 H 1 0.661 0.400 A 19 ARG C C 13 178.147 0.400 A 19 ARG CA C 13 58.274 0.400 A 19 ARG CB C 13 29.161 0.400 A 19 ARG CD C 13 43.526 0.400 A 19 ARG CG C 13 25.773 0.400 A 19 ARG N N 15 119.148 0.400 A 20 ASP H H 1 7.541 0.020 A 20 ASP HA H 1 4.228 0.020 A 20 ASP HB2 H 1 2.474 0.400 A 20 ASP HB3 H 1 2.474 0.400 A 20 ASP C C 13 176.922 0.400 A 20 ASP CA C 13 55.760 0.400 A 20 ASP CB C 13 40.876 0.400 A 20 ASP N N 15 116.272 0.400 A 21 THR H H 1 7.255 0.020 A 21 THR HA H 1 3.831 0.020 A 21 THR HB H 1 3.189 0.020 A 21 THR HG2% H 1 0.944 0.400 A 21 THR C C 13 174.669 0.400 A 21 THR CA C 13 64.490 0.400 A 21 THR CB C 13 69.408 0.400 A 21 THR CG2 C 13 21.565 0.400 A 21 THR N N 15 115.475 0.400 A 22 LEU H H 1 7.961 0.020 A 22 LEU HA H 1 3.900 0.020 A 22 LEU HB2 H 1 1.200 0.400 A 22 LEU HB3 H 1 1.200 0.400 A 22 LEU HDx% H 1 0.344 0.400 A 22 LEU HDy% H 1 0.180 0.400 A 22 LEU C C 13 176.112 0.400 A 22 LEU CD1 C 13 25.460 0.400 A 22 LEU CD2 C 13 25.280 0.400 A 22 LEU N N 15 122.308 0.400 A 23 GLN H H 1 7.803 0.020 A 23 GLN HA H 1 5.025 0.020 A 23 GLN HBy H 1 2.380 0.020 A 23 GLN HBx H 1 1.652 0.020 A 23 GLN HE2x H 1 6.884 0.020 A 23 GLN HE2y H 1 7.473 0.020 A 23 GLN HGx H 1 2.429 0.020 A 23 GLN HGy H 1 2.470 0.020 A 23 GLN CA C 13 52.229 0.400 A 23 GLN CB C 13 30.943 0.400 A 23 GLN CG C 13 33.102 0.400 A 23 GLN N N 15 123.751 0.400 A 23 GLN NE2 N 15 112.509 0.400 A 24 PRO HA H 1 3.914 0.020 A 24 PRO HBx H 1 1.872 0.020 A 24 PRO HBy H 1 2.149 0.020 A 24 PRO HDy H 1 4.094 0.020 A 24 PRO HDx H 1 3.766 0.020 A 24 PRO HGx H 1 1.782 0.020 A 24 PRO HGy H 1 2.192 0.020 A 24 PRO C C 13 176.484 0.400 A 24 PRO CA C 13 64.613 0.400 A 24 PRO CB C 13 31.818 0.400 A 24 PRO CD C 13 51.163 0.400 A 24 PRO CG C 13 27.890 0.400 A 25 GLY H H 1 8.712 0.020 A 25 GLY HAy H 1 4.609 0.020 A 25 GLY HAx H 1 3.682 0.020 A 25 GLY C C 13 174.920 0.400 A 25 GLY CA C 13 44.797 0.400 A 25 GLY N N 15 111.922 0.400 A 26 MET H H 1 8.009 0.020 A 26 MET HA H 1 3.694 0.020 A 26 MET HB2 H 1 1.389 0.400 A 26 MET HB3 H 1 1.389 0.400 A 26 MET HE% H 1 1.975 0.400 A 26 MET HGy H 1 2.319 0.020 A 26 MET HGx H 1 1.561 0.020 A 26 MET C C 13 174.778 0.400 A 26 MET CA C 13 57.823 0.400 A 26 MET CB C 13 33.730 0.400 A 26 MET CE C 13 17.820 0.400 A 26 MET CG C 13 33.897 0.400 A 26 MET N N 15 119.457 0.400 A 27 ARG H H 1 8.414 0.020 A 27 ARG HA H 1 5.134 0.020 A 27 ARG HB2 H 1 1.861 0.400 A 27 ARG HB3 H 1 1.861 0.400 A 27 ARG HDx H 1 3.137 0.020 A 27 ARG HDy H 1 3.270 0.020 A 27 ARG HGy H 1 1.890 0.020 A 27 ARG HGx H 1 1.601 0.020 A 27 ARG C C 13 176.419 0.400 A 27 ARG CA C 13 55.350 0.400 A 27 ARG CB C 13 31.066 0.400 A 27 ARG CD C 13 42.843 0.400 A 27 ARG CG C 13 28.532 0.400 A 27 ARG N N 15 120.708 0.400 A 28 VAL H H 1 8.854 0.020 A 28 VAL HA H 1 5.292 0.020 A 28 VAL HB H 1 2.011 0.020 A 28 VAL HGx% H 1 0.302 0.400 A 28 VAL HGy% H 1 0.717 0.400 A 28 VAL C C 13 172.973 0.400 A 28 VAL CA C 13 58.260 0.400 A 28 VAL CB C 13 36.599 0.400 A 28 VAL CG1 C 13 19.119 0.400 A 28 VAL CG2 C 13 23.928 0.400 A 28 VAL N N 15 114.195 0.400 A 29 ARG H H 1 9.138 0.020 A 29 ARG HA H 1 5.411 0.020 A 29 ARG HBy H 1 1.808 0.020 A 29 ARG HBx H 1 1.738 0.020 A 29 ARG HD2 H 1 3.333 0.400 A 29 ARG HD3 H 1 3.333 0.400 A 29 ARG HG2 H 1 1.566 0.400 A 29 ARG HG3 H 1 1.566 0.400 A 29 ARG C C 13 174.909 0.400 A 29 ARG CA C 13 53.642 0.400 A 29 ARG CB C 13 35.015 0.400 A 29 ARG CD C 13 43.581 0.400 A 29 ARG CG C 13 26.948 0.400 A 29 ARG N N 15 120.157 0.400 A 30 MET H H 1 9.389 0.020 A 30 MET HA H 1 4.748 0.020 A 30 MET HB2 H 1 2.028 0.400 A 30 MET HB3 H 1 2.028 0.400 A 30 MET HE% H 1 2.167 0.400 A 30 MET HGy H 1 2.843 0.020 A 30 MET HGx H 1 2.359 0.020 A 30 MET C C 13 178.169 0.400 A 30 MET CA C 13 55.063 0.400 A 30 MET CB C 13 33.840 0.400 A 30 MET CE C 13 20.290 0.400 A 30 MET CG C 13 33.812 0.400 A 30 MET N N 15 126.374 0.400 A 31 LEU H H 1 9.902 0.020 A 31 LEU HA H 1 4.351 0.020 A 31 LEU HB2 H 1 1.650 0.400 A 31 LEU HB3 H 1 1.650 0.400 A 31 LEU HDx% H 1 0.814 0.400 A 31 LEU HDy% H 1 0.737 0.400 A 31 LEU HG H 1 1.380 0.020 A 31 LEU C C 13 175.850 0.400 A 31 LEU CD1 C 13 22.810 0.400 A 31 LEU CD2 C 13 25.310 0.400 A 31 LEU N N 15 128.243 0.400 A 32 ASP H H 1 6.927 0.020 A 32 ASP HA H 1 5.009 0.020 A 32 ASP HBx H 1 2.167 0.020 A 32 ASP HBy H 1 2.726 0.020 A 32 ASP C C 13 173.050 0.400 A 32 ASP CA C 13 52.201 0.400 A 32 ASP CB C 13 45.616 0.400 A 32 ASP N N 15 115.446 0.400 A 33 ASP H H 1 8.334 0.020 A 33 ASP HA H 1 4.584 0.020 A 33 ASP HBy H 1 2.669 0.020 A 33 ASP HBx H 1 2.460 0.020 A 33 ASP C C 13 176.573 0.400 A 33 ASP CA C 13 54.708 0.400 A 33 ASP CB C 13 41.190 0.400 A 33 ASP N N 15 117.829 0.400 A 34 TYR H H 1 8.681 0.020 A 34 TYR HA H 1 4.441 0.020 A 34 TYR HBx H 1 2.558 0.020 A 34 TYR HBy H 1 2.856 0.020 A 34 TYR HD1 H 1 7.190 0.400 A 34 TYR HD2 H 1 7.190 0.400 A 34 TYR HE1 H 1 7.147 0.400 A 34 TYR HE2 H 1 7.147 0.400 A 34 TYR C C 13 172.204 0.400 A 34 TYR CA C 13 58.096 0.400 A 34 TYR CB C 13 40.725 0.400 A 34 TYR CD1 C 13 133.300 0.400 A 34 TYR CE1 C 13 118.900 0.400 A 34 TYR N N 15 124.342 0.400 A 35 GLU H H 1 8.745 0.020 A 35 GLU HA H 1 3.297 0.020 A 35 GLU HB2 H 1 1.720 0.400 A 35 GLU HB3 H 1 1.720 0.400 A 35 GLU HGy H 1 1.631 0.020 A 35 GLU HGx H 1 1.359 0.020 A 35 GLU C C 13 176.265 0.400 A 35 GLU CA C 13 57.768 0.400 A 35 GLU CB C 13 26.196 0.400 A 35 GLU CG C 13 35.629 0.400 A 35 GLU N N 15 123.443 0.400 A 36 GLU H H 1 6.089 0.020 A 36 GLU HA H 1 3.915 0.020 A 36 GLU HBy H 1 1.770 0.020 A 36 GLU HBx H 1 1.107 0.020 A 36 GLU HGx H 1 1.661 0.020 A 36 GLU HGy H 1 1.821 0.020 A 36 GLU C C 13 174.209 0.400 A 36 GLU CA C 13 56.921 0.400 A 36 GLU CB C 13 30.288 0.400 A 36 GLU CG C 13 35.957 0.400 A 36 GLU N N 15 117.852 0.400 A 37 ILE H H 1 8.165 0.020 A 37 ILE HA H 1 3.600 0.020 A 37 ILE HB H 1 1.689 0.020 A 37 ILE HD1% H 1 -0.286 0.400 A 37 ILE HG1y H 1 0.706 0.020 A 37 ILE HG1x H 1 0.216 0.020 A 37 ILE HG2% H 1 -0.202 0.400 A 37 ILE C C 13 175.237 0.400 A 37 ILE CA C 13 58.397 0.400 A 37 ILE CB C 13 35.944 0.400 A 37 ILE CD1 C 13 9.105 0.400 A 37 ILE CG1 C 13 26.592 0.400 A 37 ILE CG2 C 13 16.906 0.400 A 37 ILE N N 15 121.502 0.400 A 38 SER H H 1 8.089 0.020 A 38 SER HA H 1 4.730 0.020 A 38 SER HBy H 1 3.676 0.020 A 38 SER HBx H 1 3.532 0.020 A 38 SER C C 13 173.312 0.400 A 38 SER CA C 13 57.440 0.400 A 38 SER CB C 13 64.763 0.400 A 38 SER N N 15 124.349 0.400 A 39 ALA H H 1 9.021 0.020 A 39 ALA HA H 1 3.377 0.020 A 39 ALA HB% H 1 1.055 0.400 A 39 ALA C C 13 178.847 0.400 A 39 ALA CA C 13 53.711 0.400 A 39 ALA CB C 13 17.589 0.400 A 39 ALA N N 15 126.302 0.400 A 40 GLY H H 1 9.242 0.020 A 40 GLY HAx H 1 3.401 0.020 A 40 GLY HAy H 1 4.498 0.020 A 40 GLY C C 13 174.384 0.400 A 40 GLY CA C 13 44.988 0.400 A 40 GLY N N 15 113.130 0.400 A 41 ASP H H 1 8.205 0.020 A 41 ASP HA H 1 4.560 0.020 A 41 ASP HB2 H 1 2.638 0.400 A 41 ASP HB3 H 1 2.638 0.400 A 41 ASP C C 13 175.215 0.400 A 41 ASP CA C 13 55.692 0.400 A 41 ASP CB C 13 41.081 0.400 A 41 ASP N N 15 123.594 0.400 A 42 GLU H H 1 8.861 0.020 A 42 GLU HA H 1 5.745 0.020 A 42 GLU HBy H 1 2.082 0.020 A 42 GLU HBx H 1 1.920 0.020 A 42 GLU HGx H 1 2.214 0.020 A 42 GLU HGy H 1 2.621 0.020 A 42 GLU C C 13 176.440 0.400 A 42 GLU CA C 13 54.558 0.400 A 42 GLU CB C 13 33.539 0.400 A 42 GLU CG C 13 37.214 0.400 A 42 GLU N N 15 118.969 0.400 A 43 GLY H H 1 8.515 0.020 A 43 GLY HAy H 1 4.388 0.020 A 43 GLY HAx H 1 3.448 0.020 A 43 GLY C C 13 170.687 0.400 A 43 GLY CA C 13 46.135 0.400 A 43 GLY N N 15 107.295 0.400 A 44 GLU H H 1 8.612 0.020 A 44 GLU HA H 1 4.751 0.020 A 44 GLU HB2 H 1 1.863 0.400 A 44 GLU HB3 H 1 1.863 0.400 A 44 GLU HGx H 1 1.858 0.020 A 44 GLU HGy H 1 2.036 0.020 A 44 GLU C C 13 175.828 0.400 A 44 GLU CA C 13 53.998 0.400 A 44 GLU CB C 13 34.031 0.400 A 44 GLU CG C 13 36.845 0.400 A 44 GLU N N 15 118.972 0.400 A 45 PHE H H 1 9.003 0.020 A 45 PHE HA H 1 4.209 0.020 A 45 PHE HBy H 1 2.850 0.020 A 45 PHE HBx H 1 2.729 0.020 A 45 PHE HD1 H 1 6.802 0.400 A 45 PHE HD2 H 1 6.802 0.400 A 45 PHE C C 13 174.034 0.400 A 45 PHE CA C 13 58.014 0.400 A 45 PHE CB C 13 39.414 0.400 A 45 PHE CD1 C 13 131.701 0.400 A 45 PHE N N 15 126.727 0.400 A 46 ARG H H 1 8.067 0.020 A 46 ARG HA H 1 4.131 0.020 A 46 ARG HB2 H 1 1.335 0.400 A 46 ARG HB3 H 1 1.335 0.400 A 46 ARG HDy H 1 2.930 0.020 A 46 ARG HDx H 1 2.821 0.020 A 46 ARG HG2 H 1 1.299 0.400 A 46 ARG HG3 H 1 1.299 0.400 A 46 ARG C C 13 174.165 0.400 A 46 ARG CA C 13 55.623 0.400 A 46 ARG CB C 13 32.173 0.400 A 46 ARG CD C 13 42.269 0.400 A 46 ARG CG C 13 25.964 0.400 A 46 ARG N N 15 128.414 0.400 A 47 GLN H H 1 6.668 0.020 A 47 GLN HA H 1 4.242 0.020 A 47 GLN HB2 H 1 1.998 0.400 A 47 GLN HB3 H 1 1.998 0.400 A 47 GLN HE2x H 1 6.943 0.020 A 47 GLN HE2y H 1 7.181 0.020 A 47 GLN HG2 H 1 1.578 0.400 A 47 GLN HG3 H 1 1.578 0.400 A 47 GLN C C 13 172.065 0.400 A 47 GLN CA C 13 54.749 0.400 A 47 GLN CB C 13 29.891 0.400 A 47 GLN CG C 13 31.777 0.400 A 47 GLN N N 15 110.959 0.400 A 47 GLN NE2 N 15 111.802 0.400 A 48 SER H H 1 8.938 0.020 A 48 SER HA H 1 5.917 0.020 A 48 SER HBx H 1 3.908 0.020 A 48 SER HBy H 1 4.265 0.020 A 48 SER C C 13 173.608 0.400 A 48 SER CA C 13 56.621 0.400 A 48 SER CB C 13 68.725 0.400 A 48 SER N N 15 114.905 0.400 A 49 ASN H H 1 9.273 0.020 A 49 ASN HA H 1 4.921 0.020 A 49 ASN HBy H 1 3.210 0.020 A 49 ASN HBx H 1 3.001 0.020 A 49 ASN HD2x H 1 6.026 0.020 A 49 ASN HD2y H 1 7.497 0.020 A 49 ASN CA C 13 52.283 0.400 A 49 ASN CB C 13 39.304 0.400 A 49 ASN N N 15 119.490 0.400 A 49 ASN ND2 N 15 112.409 0.400 A 50 ASN HA H 1 5.073 0.020 A 50 ASN HBy H 1 2.969 0.020 A 50 ASN HBx H 1 2.769 0.020 A 50 ASN HD2x H 1 6.959 0.020 A 50 ASN HD2y H 1 7.616 0.020 A 50 ASN C C 13 175.850 0.400 A 50 ASN CA C 13 52.844 0.400 A 50 ASN CB C 13 38.348 0.400 A 50 ASN ND2 N 15 112.905 0.400 A 51 GLY H H 1 8.117 0.020 A 51 GLY HAy H 1 4.082 0.020 A 51 GLY HAx H 1 3.432 0.020 A 51 GLY C C 13 172.065 0.400 A 51 GLY CA C 13 43.991 0.400 A 51 GLY N N 15 109.440 0.400 A 52 VAL H H 1 7.762 0.020 A 52 VAL HA H 1 4.111 0.020 A 52 VAL HB H 1 1.865 0.020 A 52 VAL HGx% H 1 0.881 0.400 A 52 VAL HGy% H 1 0.934 0.400 A 52 VAL CA C 13 58.178 0.400 A 52 VAL CB C 13 35.069 0.400 A 52 VAL CG1 C 13 20.636 0.400 A 52 VAL CG2 C 13 21.319 0.400 A 52 VAL N N 15 115.586 0.400 A 53 PRO HA H 1 4.304 0.020 A 53 PRO HBx H 1 0.787 0.020 A 53 PRO HBy H 1 1.259 0.020 A 53 PRO HDy H 1 3.722 0.020 A 53 PRO HDx H 1 2.982 0.020 A 53 PRO HGy H 1 1.950 0.020 A 53 PRO HGx H 1 1.485 0.020 A 53 PRO CA C 13 61.402 0.400 A 53 PRO CB C 13 32.118 0.400 A 53 PRO CD C 13 50.207 0.400 A 53 PRO CG C 13 27.262 0.400 A 54 PRO HA H 1 4.513 0.020 A 54 PRO HBy H 1 2.727 0.020 A 54 PRO HBx H 1 2.047 0.020 A 54 PRO HDy H 1 3.643 0.020 A 54 PRO HDx H 1 3.377 0.020 A 54 PRO HG2 H 1 2.360 0.400 A 54 PRO HG3 H 1 2.360 0.400 A 54 PRO C C 13 176.637 0.400 A 54 PRO CA C 13 65.351 0.400 A 54 PRO CB C 13 34.433 0.400 A 54 PRO CD C 13 51.382 0.400 A 54 PRO CG C 13 27.836 0.400 A 55 VAL H H 1 7.894 0.020 A 55 VAL HA H 1 3.740 0.020 A 55 VAL HB H 1 1.480 0.020 A 55 VAL HGx% H 1 -0.821 0.400 A 55 VAL HGy% H 1 0.282 0.400 A 55 VAL C C 13 173.859 0.400 A 55 VAL CA C 13 62.441 0.400 A 55 VAL CB C 13 31.927 0.400 A 55 VAL CG1 C 13 19.925 0.400 A 55 VAL CG2 C 13 22.548 0.400 A 55 VAL N N 15 117.100 0.400 A 56 GLN H H 1 8.812 0.020 A 56 GLN HA H 1 3.454 0.020 A 56 GLN HBy H 1 1.270 0.020 A 56 GLN HBx H 1 -1.231 0.020 A 56 GLN HE2x H 1 6.506 0.020 A 56 GLN HE2y H 1 7.194 0.020 A 56 GLN HGy H 1 0.960 0.020 A 56 GLN HGx H 1 0.351 0.020 A 56 GLN C C 13 174.034 0.400 A 56 GLN CA C 13 55.555 0.400 A 56 GLN CB C 13 27.972 0.400 A 56 GLN CG C 13 35.179 0.400 A 56 GLN N N 15 129.002 0.400 A 56 GLN NE2 N 15 113.009 0.400 A 57 VAL H H 1 7.402 0.020 A 57 VAL HA H 1 4.162 0.020 A 57 VAL HB H 1 1.067 0.020 A 57 VAL HGx% H 1 -1.287 0.400 A 57 VAL HGy% H 1 0.489 0.400 A 57 VAL C C 13 173.619 0.400 A 57 VAL CA C 13 59.299 0.400 A 57 VAL CB C 13 36.490 0.400 A 57 VAL CG1 C 13 18.614 0.400 A 57 VAL CG2 C 13 22.521 0.400 A 57 VAL N N 15 129.395 0.400 A 58 PHE H H 1 8.465 0.020 A 58 PHE HA H 1 4.072 0.020 A 58 PHE HBx H 1 2.398 0.020 A 58 PHE HBy H 1 2.790 0.020 A 58 PHE HD1 H 1 6.914 0.400 A 58 PHE HD2 H 1 6.914 0.400 A 58 PHE HE1 H 1 7.177 0.400 A 58 PHE HE2 H 1 7.177 0.400 A 58 PHE C C 13 173.269 0.400 A 58 PHE CA C 13 57.577 0.400 A 58 PHE CB C 13 39.988 0.400 A 58 PHE CD1 C 13 131.400 0.400 A 58 PHE CE1 C 13 131.400 0.400 A 58 PHE N N 15 125.306 0.400 A 59 TRP H H 1 7.769 0.020 A 59 TRP HA H 1 4.441 0.020 A 59 TRP HB2 H 1 3.280 0.400 A 59 TRP HB3 H 1 3.280 0.400 A 59 TRP HD1 H 1 7.205 0.020 A 59 TRP HE1 H 1 8.357 0.020 A 59 TRP HH2 H 1 6.805 0.020 A 59 TRP HZ2 H 1 7.075 0.020 A 59 TRP HZ3 H 1 7.303 0.020 A 59 TRP C C 13 176.025 0.400 A 59 TRP CA C 13 56.593 0.400 A 59 TRP CB C 13 29.338 0.400 A 59 TRP CD1 C 13 129.300 0.400 A 59 TRP CH2 C 13 125.200 0.400 A 59 TRP CZ2 C 13 113.500 0.400 A 59 TRP CZ3 C 13 121.200 0.400 A 59 TRP N N 15 131.363 0.400 A 59 TRP NE1 N 15 125.000 0.400 A 60 GLU H H 1 9.021 0.020 A 60 GLU HA H 1 3.951 0.020 A 60 GLU HB2 H 1 2.118 0.400 A 60 GLU HB3 H 1 2.118 0.400 A 60 GLU HG2 H 1 2.402 0.400 A 60 GLU HG3 H 1 2.402 0.400 A 60 GLU C C 13 178.672 0.400 A 60 GLU CA C 13 58.656 0.400 A 60 GLU CB C 13 29.420 0.400 A 60 GLU CG C 13 36.613 0.400 A 60 GLU N N 15 123.388 0.400 A 61 SER H H 1 8.401 0.020 A 61 SER HA H 1 4.199 0.020 A 61 SER HB2 H 1 3.901 0.400 A 61 SER HB3 H 1 3.901 0.400 A 61 SER C C 13 176.462 0.400 A 61 SER CA C 13 59.585 0.400 A 61 SER CB C 13 62.632 0.400 A 61 SER N N 15 111.939 0.400 A 62 THR H H 1 6.995 0.020 A 62 THR HA H 1 4.322 0.020 A 62 THR HB H 1 4.087 0.020 A 62 THR HG2% H 1 1.002 0.400 A 62 THR C C 13 176.572 0.400 A 62 THR CA C 13 61.170 0.400 A 62 THR CB C 13 70.037 0.400 A 62 THR CG2 C 13 22.302 0.400 A 62 THR N N 15 108.452 0.400 A 63 GLY H H 1 8.175 0.020 A 63 GLY HAx H 1 3.584 0.020 A 63 GLY HAy H 1 3.928 0.020 A 63 GLY C C 13 173.487 0.400 A 63 GLY CA C 13 46.791 0.400 A 63 GLY N N 15 112.062 0.400 A 64 ARG H H 1 7.652 0.020 A 64 ARG HA H 1 4.740 0.020 A 64 ARG HBy H 1 1.979 0.020 A 64 ARG HBx H 1 1.790 0.020 A 64 ARG HDx H 1 3.203 0.020 A 64 ARG HDy H 1 3.288 0.020 A 64 ARG HG2 H 1 1.587 0.400 A 64 ARG HG3 H 1 1.587 0.400 A 64 ARG C C 13 175.478 0.400 A 64 ARG CA C 13 54.230 0.400 A 64 ARG CB C 13 34.796 0.400 A 64 ARG CD C 13 43.608 0.400 A 64 ARG CG C 13 27.375 0.400 A 64 ARG N N 15 117.175 0.400 A 65 THR H H 1 8.227 0.020 A 65 THR HA H 1 5.465 0.020 A 65 THR HB H 1 3.720 0.020 A 65 THR HG2% H 1 1.065 0.400 A 65 THR C C 13 176.134 0.400 A 65 THR CA C 13 60.309 0.400 A 65 THR CB C 13 71.130 0.400 A 65 THR CG2 C 13 22.330 0.400 A 65 THR N N 15 109.582 0.400 A 66 TYR H H 1 8.867 0.020 A 66 TYR HA H 1 4.564 0.020 A 66 TYR HBy H 1 3.340 0.020 A 66 TYR HBx H 1 2.968 0.020 A 66 TYR HD1 H 1 7.232 0.400 A 66 TYR HD2 H 1 7.232 0.400 A 66 TYR HE1 H 1 6.930 0.400 A 66 TYR HE2 H 1 6.930 0.400 A 66 TYR C C 13 175.215 0.400 A 66 TYR CA C 13 60.337 0.400 A 66 TYR CB C 13 44.496 0.400 A 66 TYR CD1 C 13 134.200 0.400 A 66 TYR CE1 C 13 118.200 0.400 A 66 TYR N N 15 121.772 0.400 A 67 TRP H H 1 8.154 0.020 A 67 TRP HA H 1 5.448 0.020 A 67 TRP HBy H 1 2.825 0.020 A 67 TRP HBx H 1 2.745 0.020 A 67 TRP HD1 H 1 7.190 0.020 A 67 TRP HE1 H 1 10.010 0.020 A 67 TRP HH2 H 1 6.688 0.020 A 67 TRP HZ2 H 1 7.170 0.020 A 67 TRP HZ3 H 1 7.195 0.020 A 67 TRP C C 13 176.222 0.400 A 67 TRP CA C 13 56.580 0.400 A 67 TRP CB C 13 27.945 0.400 A 67 TRP CD1 C 13 127.500 0.400 A 67 TRP CH2 C 13 124.100 0.400 A 67 TRP CZ2 C 13 113.800 0.400 A 67 TRP CZ3 C 13 122.900 0.400 A 67 TRP N N 15 128.561 0.400 A 67 TRP NE1 N 15 129.428 0.400 A 68 VAL H H 1 9.675 0.020 A 68 VAL HA H 1 4.535 0.020 A 68 VAL HB H 1 2.296 0.020 A 68 VAL HGx% H 1 0.887 0.400 A 68 VAL HGy% H 1 1.266 0.400 A 68 VAL C C 13 173.225 0.400 A 68 VAL CA C 13 58.766 0.400 A 68 VAL CB C 13 36.012 0.400 A 68 VAL CG1 C 13 18.573 0.400 A 68 VAL CG2 C 13 22.371 0.400 A 68 VAL N N 15 113.136 0.400 A 69 HIS H H 1 6.828 0.020 A 69 HIS HA H 1 4.465 0.020 A 69 HIS HBy H 1 3.247 0.020 A 69 HIS HBx H 1 2.308 0.020 A 69 HIS HD2 H 1 6.408 0.020 A 69 HIS C C 13 176.561 0.400 A 69 HIS CA C 13 56.457 0.400 A 69 HIS CB C 13 34.195 0.400 A 69 HIS CD2 C 13 117.600 0.400 A 69 HIS N N 15 116.840 0.400 A 70 TRP H H 1 7.631 0.020 A 70 TRP HA H 1 4.037 0.020 A 70 TRP HB2 H 1 3.361 0.400 A 70 TRP HB3 H 1 3.361 0.400 A 70 TRP HD1 H 1 7.520 0.020 A 70 TRP HE1 H 1 10.497 0.020 A 70 TRP HE3 H 1 7.190 0.020 A 70 TRP HH2 H 1 7.257 0.020 A 70 TRP HZ2 H 1 7.585 0.020 A 70 TRP HZ3 H 1 6.580 0.020 A 70 TRP C C 13 177.206 0.400 A 70 TRP CA C 13 60.378 0.400 A 70 TRP CB C 13 31.544 0.400 A 70 TRP CD1 C 13 128.400 0.400 A 70 TRP CE3 C 13 120.700 0.400 A 70 TRP CH2 C 13 125.300 0.400 A 70 TRP CZ2 C 13 114.800 0.400 A 70 TRP CZ3 C 13 122.500 0.400 A 70 TRP N N 15 118.716 0.400 A 70 TRP NE1 N 15 129.261 0.400 A 71 HIS H H 1 8.094 0.020 A 71 HIS HA H 1 4.465 0.020 A 71 HIS HBx H 1 3.081 0.020 A 71 HIS HBy H 1 3.557 0.020 A 71 HIS HD2 H 1 6.850 0.020 A 71 HIS HE1 H 1 7.417 0.020 A 71 HIS C C 13 174.450 0.400 A 71 HIS CA C 13 58.028 0.400 A 71 HIS CB C 13 30.329 0.400 A 71 HIS CD2 C 13 118.700 0.400 A 71 HIS CE1 C 13 138.600 0.400 A 71 HIS N N 15 106.507 0.400 A 72 MET H H 1 7.000 0.020 A 72 MET HA H 1 4.142 0.020 A 72 MET HBx H 1 1.652 0.020 A 72 MET HBy H 1 2.716 0.020 A 72 MET HE% H 1 1.757 0.400 A 72 MET HGx H 1 1.409 0.020 A 72 MET HGy H 1 2.541 0.020 A 72 MET C C 13 173.115 0.400 A 72 MET CA C 13 56.552 0.400 A 72 MET CB C 13 32.514 0.400 A 72 MET CE C 13 19.230 0.400 A 72 MET CG C 13 33.539 0.400 A 72 MET N N 15 116.765 0.400 A 73 LEU H H 1 7.242 0.020 A 73 LEU HA H 1 5.131 0.020 A 73 LEU HDx% H 1 0.990 0.400 A 73 LEU C C 13 176.003 0.400 A 73 LEU CD1 C 13 22.400 0.400 A 73 LEU N N 15 115.800 0.400 A 74 GLU H H 1 9.470 0.020 A 74 GLU HA H 1 4.541 0.020 A 74 GLU HBx H 1 2.022 0.020 A 74 GLU HBy H 1 2.134 0.020 A 74 GLU HGx H 1 1.958 0.020 A 74 GLU HGy H 1 2.350 0.020 A 74 GLU C C 13 175.478 0.400 A 74 GLU CA C 13 54.653 0.400 A 74 GLU CB C 13 32.637 0.400 A 74 GLU CG C 13 36.217 0.400 A 74 GLU N N 15 123.044 0.400 A 75 ILE H H 1 9.346 0.020 A 75 ILE HA H 1 3.852 0.020 A 75 ILE HB H 1 1.898 0.020 A 75 ILE HD1% H 1 0.727 0.400 A 75 ILE HG1x H 1 0.713 0.020 A 75 ILE HG1y H 1 1.728 0.020 A 75 ILE HG2% H 1 0.807 0.400 A 75 ILE C C 13 175.915 0.400 A 75 ILE CA C 13 63.479 0.400 A 75 ILE CB C 13 38.403 0.400 A 75 ILE CD1 C 13 14.925 0.400 A 75 ILE CG1 C 13 27.357 0.400 A 75 ILE CG2 C 13 18.559 0.400 A 75 ILE N N 15 127.091 0.400 A 76 LEU H H 1 8.574 0.020 A 76 LEU HA H 1 4.576 0.020 A 76 LEU HB2 H 1 1.585 0.400 A 76 LEU HB3 H 1 1.585 0.400 A 76 LEU HDx% H 1 0.907 0.400 A 76 LEU HDy% H 1 0.907 0.400 A 76 LEU C C 13 177.764 0.400 A 76 LEU CA C 13 53.239 0.400 A 76 LEU CB C 13 41.203 0.400 A 76 LEU CD1 C 13 25.314 0.400 A 76 LEU N N 15 128.631 0.400 A 77 GLY H H 1 7.718 0.020 A 77 GLY HAx H 1 3.581 0.020 A 77 GLY HAy H 1 4.356 0.020 A 77 GLY C C 13 174.340 0.400 A 77 GLY CA C 13 44.305 0.400 A 77 GLY N N 15 105.633 0.400 A 78 PHE H H 1 8.851 0.020 A 78 PHE HA H 1 4.750 0.020 A 78 PHE HBx H 1 2.840 0.020 A 78 PHE HBy H 1 3.261 0.020 A 78 PHE HD1 H 1 7.284 0.400 A 78 PHE HD2 H 1 7.284 0.400 A 78 PHE C C 13 176.331 0.400 A 78 PHE CA C 13 58.389 0.400 A 78 PHE CB C 13 39.632 0.400 A 78 PHE CD1 C 13 131.903 0.400 A 78 PHE N N 15 120.928 0.400 A 79 GLU H H 1 8.859 0.020 A 79 GLU HA H 1 4.200 0.020 A 79 GLU HBx H 1 1.881 0.020 A 79 GLU HBy H 1 1.995 0.020 A 79 GLU HG2 H 1 2.227 0.400 A 79 GLU HG3 H 1 2.227 0.400 A 79 GLU C C 13 176.594 0.400 A 79 GLU CA C 13 57.358 0.400 A 79 GLU CB C 13 30.342 0.400 A 79 GLU CG C 13 36.422 0.400 A 79 GLU N N 15 122.781 0.400 A 80 GLU H H 1 8.614 0.020 A 80 GLU HA H 1 4.216 0.020 A 80 GLU HBy H 1 1.993 0.020 A 80 GLU HBx H 1 1.883 0.020 A 80 GLU HG2 H 1 2.215 0.400 A 80 GLU HG3 H 1 2.215 0.400 A 80 GLU C C 13 176.047 0.400 A 80 GLU CA C 13 56.675 0.400 A 80 GLU CB C 13 30.615 0.400 A 80 GLU CG C 13 36.258 0.400 A 80 GLU N N 15 121.237 0.400 A 81 ASP H H 1 8.392 0.020 A 81 ASP HA H 1 4.608 0.020 A 81 ASP HBx H 1 2.600 0.020 A 81 ASP HBy H 1 2.715 0.020 A 81 ASP C C 13 176.200 0.400 A 81 ASP CA C 13 54.353 0.400 A 81 ASP CB C 13 41.244 0.400 A 81 ASP N N 15 121.767 0.400 A 82 ILE H H 1 8.029 0.020 A 82 ILE HA H 1 4.103 0.020 A 82 ILE HB H 1 1.832 0.020 A 82 ILE HD1% H 1 0.786 0.400 A 82 ILE HG1y H 1 1.408 0.020 A 82 ILE HG1x H 1 1.102 0.020 A 82 ILE HG2% H 1 0.848 0.400 A 82 ILE C C 13 176.440 0.400 A 82 ILE CA C 13 61.293 0.400 A 82 ILE CB C 13 38.895 0.400 A 82 ILE CD1 C 13 13.258 0.400 A 82 ILE CG1 C 13 27.303 0.400 A 82 ILE CG2 C 13 17.794 0.400 A 82 ILE N N 15 121.346 0.400 A 83 GLU H H 1 8.450 0.020 A 83 GLU HA H 1 4.216 0.020 A 83 GLU HBy H 1 1.993 0.020 A 83 GLU HBx H 1 1.883 0.020 A 83 GLU HG2 H 1 2.215 0.400 A 83 GLU HG3 H 1 2.215 0.400 A 83 GLU C C 13 176.156 0.400 A 83 GLU CA C 13 56.675 0.400 A 83 GLU CB C 13 30.615 0.400 A 83 GLU CG C 13 36.258 0.400 A 83 GLU N N 15 124.859 0.400 A 84 ASP H H 1 8.306 0.020 A 84 ASP HA H 1 4.536 0.020 A 84 ASP HBx H 1 2.549 0.020 A 84 ASP HBy H 1 2.648 0.020 A 84 ASP C C 13 176.047 0.400 A 84 ASP CA C 13 54.407 0.400 A 84 ASP CB C 13 41.354 0.400 A 84 ASP N N 15 121.536 0.400 A 85 MET H H 1 8.249 0.020 A 85 MET HA H 1 4.421 0.020 A 85 MET HBx H 1 1.965 0.020 A 85 MET HBy H 1 2.030 0.020 A 85 MET HGy H 1 2.531 0.020 A 85 MET HGx H 1 2.463 0.020 A 85 MET C C 13 176.025 0.400 A 85 MET CA C 13 55.528 0.400 A 85 MET CB C 13 32.965 0.400 A 85 MET CG C 13 32.050 0.400 A 85 MET N N 15 121.088 0.400 A 86 VAL H H 1 8.146 0.020 A 86 VAL HA H 1 4.027 0.020 A 86 VAL HB H 1 2.009 0.020 A 86 VAL HGx% H 1 0.883 0.400 A 86 VAL HGy% H 1 0.883 0.400 A 86 VAL C C 13 176.156 0.400 A 86 VAL CA C 13 62.277 0.400 A 86 VAL CB C 13 32.747 0.400 A 86 VAL CG1 C 13 20.991 0.400 A 86 VAL N N 15 122.019 0.400 A 87 GLU H H 1 8.503 0.020 A 87 GLU HA H 1 4.223 0.020 A 87 GLU HBy H 1 1.993 0.020 A 87 GLU HBx H 1 1.883 0.020 A 87 GLU HG2 H 1 2.215 0.400 A 87 GLU HG3 H 1 2.215 0.400 A 87 GLU C C 13 176.156 0.400 A 87 GLU CA C 13 56.402 0.400 A 87 GLU CB C 13 30.615 0.400 A 87 GLU CG C 13 36.449 0.400 A 87 GLU N N 15 125.068 0.400 A 88 ALA H H 1 8.335 0.020 A 88 ALA HA H 1 4.250 0.020 A 88 ALA HB% H 1 1.334 0.400 A 88 ALA C C 13 177.523 0.400 A 88 ALA CA C 13 52.557 0.400 A 88 ALA CB C 13 19.392 0.400 A 88 ALA N N 15 125.400 0.400 A 89 ASP H H 1 8.325 0.020 A 89 ASP HA H 1 4.516 0.020 A 89 ASP HB2 H 1 2.621 0.400 A 89 ASP HB3 H 1 2.621 0.400 A 89 ASP C C 13 176.572 0.400 A 89 ASP CA C 13 54.544 0.400 A 89 ASP CB C 13 41.299 0.400 A 89 ASP N N 15 119.879 0.400 A 90 GLU H H 1 8.363 0.020 A 90 GLU HA H 1 4.147 0.020 A 90 GLU HB2 H 1 1.847 0.400 A 90 GLU HB3 H 1 1.847 0.400 A 90 GLU HGx H 1 2.032 0.020 A 90 GLU HGy H 1 2.081 0.020 A 90 GLU C C 13 176.506 0.400 A 90 GLU CA C 13 56.976 0.400 A 90 GLU CB C 13 30.178 0.400 A 90 GLU CG C 13 36.149 0.400 A 90 GLU N N 15 120.910 0.400 A 91 TYR H H 1 8.233 0.020 A 91 TYR HA H 1 4.473 0.020 A 91 TYR HB2 H 1 2.996 0.400 A 91 TYR HB3 H 1 2.996 0.400 A 91 TYR HD1 H 1 7.109 0.400 A 91 TYR HD2 H 1 7.109 0.400 A 91 TYR HE1 H 1 6.795 0.400 A 91 TYR HE2 H 1 6.795 0.400 A 91 TYR C C 13 176.112 0.400 A 91 TYR CA C 13 58.424 0.400 A 91 TYR CB C 13 38.485 0.400 A 91 TYR CD1 C 13 133.300 0.400 A 91 TYR CE1 C 13 118.200 0.400 A 91 TYR N N 15 120.908 0.400 A 92 GLN H H 1 8.248 0.020 A 92 GLN HA H 1 4.191 0.020 A 92 GLN HBy H 1 2.059 0.020 A 92 GLN HBx H 1 1.881 0.020 A 92 GLN HE2x H 1 6.832 0.020 A 92 GLN HE2y H 1 7.510 0.020 A 92 GLN HG2 H 1 2.272 0.400 A 92 GLN HG3 H 1 2.272 0.400 A 92 GLN C C 13 176.265 0.400 A 92 GLN CA C 13 55.924 0.400 A 92 GLN CB C 13 29.202 0.400 A 92 GLN CG C 13 33.662 0.400 A 92 GLN N N 15 122.312 0.400 A 92 GLN NE2 N 15 112.700 0.400 A 93 GLY H H 1 7.818 0.020 A 93 GLY HA2 H 1 3.830 0.400 A 93 GLY HA3 H 1 3.830 0.400 A 93 GLY C C 13 173.750 0.400 A 93 GLY CA C 13 45.206 0.400 A 93 GLY N N 15 108.957 0.400 A 94 ALA H H 1 8.091 0.020 A 94 ALA HA H 1 4.293 0.020 A 94 ALA HB% H 1 1.321 0.400 A 94 ALA C C 13 178.070 0.400 A 94 ALA CA C 13 52.611 0.400 A 94 ALA CB C 13 19.174 0.400 A 94 ALA N N 15 123.638 0.400 A 95 VAL H H 1 8.075 0.020 A 95 VAL HA H 1 3.990 0.020 A 95 VAL HB H 1 2.030 0.020 A 95 VAL HGx% H 1 0.893 0.400 A 95 VAL HGy% H 1 0.893 0.400 A 95 VAL C C 13 176.353 0.400 A 95 VAL CA C 13 62.687 0.400 A 95 VAL CB C 13 32.501 0.400 A 95 VAL CG1 C 13 20.991 0.400 A 95 VAL N N 15 119.438 0.400 A 96 ALA H H 1 8.329 0.020 A 96 ALA HA H 1 4.234 0.020 A 96 ALA HB% H 1 1.336 0.400 A 96 ALA C C 13 177.906 0.400 A 96 ALA CA C 13 52.816 0.400 A 96 ALA CB C 13 19.160 0.400 A 96 ALA N N 15 126.892 0.400 A 97 SER H H 1 8.153 0.020 A 97 SER HA H 1 4.331 0.020 A 97 SER HB2 H 1 3.831 0.400 A 97 SER HB3 H 1 3.831 0.400 A 97 SER C C 13 174.669 0.400 A 97 SER CA C 13 58.561 0.400 A 97 SER CB C 13 63.616 0.400 A 97 SER N N 15 114.421 0.400 A 98 ARG H H 1 8.212 0.020 A 98 ARG HA H 1 4.302 0.020 A 98 ARG HBy H 1 1.801 0.020 A 98 ARG HBx H 1 1.716 0.020 A 98 ARG HD2 H 1 3.120 0.400 A 98 ARG HD3 H 1 3.120 0.400 A 98 ARG HGy H 1 1.580 0.020 A 98 ARG HGx H 1 1.521 0.020 A 98 ARG C C 13 176.244 0.400 A 98 ARG CA C 13 56.375 0.400 A 98 ARG CB C 13 30.861 0.400 A 98 ARG CD C 13 43.362 0.400 A 98 ARG CG C 13 27.111 0.400 A 98 ARG N N 15 122.986 0.400 A 99 VAL H H 1 8.119 0.020 A 99 VAL HA H 1 4.010 0.020 A 99 VAL HB H 1 2.007 0.020 A 99 VAL HGx% H 1 0.881 0.400 A 99 VAL HGy% H 1 0.881 0.400 A 99 VAL C C 13 176.156 0.400 A 99 VAL CA C 13 62.550 0.400 A 99 VAL CB C 13 32.473 0.400 A 99 VAL CG1 C 13 20.827 0.400 A 99 VAL N N 15 121.434 0.400 A 100 LEU H H 1 8.287 0.020 A 100 LEU HA H 1 4.303 0.020 A 100 LEU HBy H 1 1.627 0.020 A 100 LEU HBx H 1 1.543 0.020 A 100 LEU HDx% H 1 0.811 0.400 A 100 LEU HDy% H 1 0.811 0.400 A 100 LEU HG H 1 0.873 0.020 A 100 LEU CA C 13 55.323 0.400 A 100 LEU CB C 13 42.378 0.400 A 100 LEU CD1 C 13 23.450 0.400 A 100 LEU CG C 13 24.844 0.400 A 100 LEU N N 15 125.814 0.400 A 101 GLY H H 1 8.388 0.020 A 101 GLY HA2 H 1 3.881 0.400 A 101 GLY HA3 H 1 3.881 0.400 A 101 GLY C C 13 173.225 0.400 A 101 GLY CA C 13 45.560 0.400 A 101 GLY N N 15 110.117 0.400 A 102 ARG H H 1 7.771 0.020 A 102 ARG HA H 1 4.150 0.020 A 102 ARG HBy H 1 1.810 0.020 A 102 ARG HBx H 1 1.652 0.020 A 102 ARG HD2 H 1 3.128 0.400 A 102 ARG HD3 H 1 3.128 0.400 A 102 ARG HG2 H 1 1.510 0.400 A 102 ARG HG3 H 1 1.510 0.400 A 102 ARG CA C 13 57.304 0.400 A 102 ARG CB C 13 31.435 0.400 A 102 ARG CD C 13 43.526 0.400 A 102 ARG CG C 13 27.166 0.400 A 102 ARG N N 15 125.374 0.400 A 103 ALA HA H 1 4.250 0.020 A 103 ALA HB% H 1 1.320 0.400 A 103 ALA C C 13 176.003 0.400 A 103 ALA CA C 13 52.557 0.400 A 103 ALA CB C 13 19.172 0.400 A 104 LEU H H 1 7.895 0.020 A 104 LEU HA H 1 4.460 0.020 A 104 LEU N N 15 121.704 0.400 A 105 PRO HA H 1 4.275 0.020 A 105 PRO HB2 H 1 2.059 0.400 A 105 PRO HB3 H 1 2.059 0.400 A 105 PRO HDy H 1 3.541 0.020 A 105 PRO HDx H 1 3.391 0.020 A 105 PRO HGx H 1 1.801 0.020 A 105 PRO HGy H 1 1.842 0.020 A 105 PRO CA C 13 64.818 0.400 A 105 PRO CB C 13 34.413 0.400 A 105 PRO CD C 13 50.125 0.400 A 105 PRO CG C 13 24.830 0.400 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 27 ARG HA A 44 GLU HA 1.0 1.8 2.7 2 2 A 33 ASP HA A 39 ALA H 1.0 1.8 3.5 3 3 A 45 PHE H A 28 VAL HGx% 1.0 1.8 5.0 4 4 A 30 MET HE% A 37 ILE HG2% 1.0 1.8 3.5 5 5 A 56 GLN H A 47 GLN H 1.0 1.8 5.0 6 6 A 55 VAL HGx% A 70 TRP H 1.0 1.8 5.0 7 7 A 55 VAL H A 68 VAL H 1.0 1.8 3.5 8 8 A 31 LEU H A 40 GLY H 1.0 1.8 5.0 9 9 A 28 VAL HGy% A 43 GLY H 1.0 1.8 2.7 10 10 A 65 THR HA A 59 TRP H 1.0 1.8 3.5 11 11 A 74 GLU H A 29 ARG H 1.0 1.8 3.5 12 12 A 33 ASP HA A 38 SER HA 1.0 1.8 3.5 13 13 A 65 THR HB A 56 GLN HGx 1.0 1.8 5.0 14 14 A 47 GLN H A 56 GLN HBx 1.0 1.8 3.5 15 15 A 40 GLY H A 30 MET HGy 1.0 1.8 6.0 16 16 A 44 GLU HA A 28 VAL H 1.0 1.8 5.0 17 17 A 40 GLY H A 30 MET H 1.0 1.8 5.0 18 18 A 39 ALA H A 34 TYR H 1.0 1.8 6.0 19 19 A 45 PHE H A 28 VAL HGy% 1.0 1.8 5.0 20 20 A 46 ARG H A 57 VAL HGy% 1.0 1.8 5.0 21 21 A 65 THR HA A 58 PHE HA 1.0 1.8 2.7 22 22 A 33 ASP HA A 39 ALA HB% 1.0 1.8 5.0 23 23 A 28 VAL HA A 76 LEU H 1.0 1.8 5.0 24 24 A 56 GLN H A 48 SER HA 1.0 1.8 3.5 25 25 A 40 GLY H A 30 MET HB2 1.0 1.8 3.5 26 25 A 40 GLY H A 30 MET HB3 1.0 1.8 3.5 27 26 A 47 GLN H A 56 GLN HBy 1.0 1.8 6.0 28 27 A 67 TRP HA A 57 VAL H 1.0 1.8 3.5 29 28 A 39 ALA HB% A 33 ASP H 1.0 1.8 5.0 30 29 A 56 GLN HGx A 65 THR HG2% 1.0 1.8 5.0 31 30 A 31 LEU H A 39 ALA HA 1.0 1.8 5.0 32 31 A 57 VAL HGx% A 44 GLU H 1.0 1.8 3.5 33 32 A 15 ALA HB% A 71 HIS HA 1.0 1.8 5.0 34 33 A 40 GLY H A 30 MET HGx 1.0 1.8 5.0 35 34 A 68 VAL H A 55 VAL HGy% 1.0 1.8 5.0 36 35 A 30 MET H A 41 ASP H 1.0 1.8 5.0 37 36 A 27 ARG HA A 45 PHE H 1.0 1.8 3.5 38 37 A 57 VAL H A 66 TYR H 1.0 1.8 3.5 39 38 A 65 THR HA A 58 PHE H 1.0 1.8 5.0 40 39 A 37 ILE HD1% A 66 TYR HE% 1.0 1.8 5.0 41 40 A 65 THR HA A 58 PHE HBx 1.0 1.8 5.0 42 41 A 75 ILE HD1% A 22 LEU H 1.0 1.8 6.0 43 42 A 39 ALA HB% A 32 ASP H 1.0 1.8 5.0 44 43 A 15 ALA HB% A 71 HIS H 1.0 1.8 5.0 45 44 A 30 MET HE% A 37 ILE HB 1.0 1.8 3.5 46 45 A 30 MET HE% A 37 ILE HD1% 1.0 1.8 6.0 47 46 A 42 GLU HA A 29 ARG HA 1.0 1.8 3.5 48 47 A 65 THR HB A 57 VAL H 1.0 1.8 6.0 49 48 A 28 VAL HGx% A 45 PHE HA 1.0 1.8 5.0 50 49 A 39 ALA H A 33 ASP H 1.0 1.8 6.0 51 50 A 65 THR HA A 58 PHE HBy 1.0 1.8 6.0 52 51 A 58 PHE HA A 65 THR HG2% 1.0 1.8 5.0 53 52 A 59 TRP H A 65 THR HG2% 1.0 1.8 6.0 54 53 A 40 GLY H A 30 MET HA 1.0 1.8 5.0 55 54 A 30 MET HGy A 39 ALA HA 1.0 1.8 5.0 56 55 A 56 GLN H A 47 GLN HB2 1.0 1.8 6.0 57 55 A 56 GLN H A 47 GLN HB3 1.0 1.8 6.0 58 56 A 66 TYR HBy A 59 TRP HE1 1.0 1.8 5.0 59 57 A 65 THR HB A 56 GLN HGy 1.0 1.8 6.0 60 58 A 65 THR HB A 56 GLN HE2y 1.0 1.8 5.0 61 59 A 77 GLY H A 26 MET HE% 1.0 1.8 6.0 62 60 A 47 GLN H A 56 GLN HA 1.0 1.8 6.0 63 61 A 56 GLN H A 48 SER H 1.0 1.8 6.0 64 62 A 39 ALA HA A 32 ASP H 1.0 1.8 5.0 65 63 A 55 VAL H A 68 VAL HGy% 1.0 1.8 5.0 66 64 A 55 VAL H A 68 VAL HGx% 1.0 1.8 6.0 67 65 A 56 GLN H A 49 ASN H 1.0 1.8 6.0 68 66 A 60 GLU H A 43 GLY HAx 1.0 1.8 5.0 69 67 A 34 TYR H A 39 ALA HB% 1.0 1.8 6.0 70 68 A 45 PHE H A 28 VAL H 1.0 1.8 5.0 71 69 A 39 ALA H A 33 ASP HBx 1.0 1.8 6.0 72 70 A 59 TRP H A 43 GLY HAx 1.0 1.8 5.0 73 71 A 55 VAL H A 67 TRP HA 1.0 1.8 5.0 74 72 A 60 GLU H A 43 GLY HAy 1.0 1.8 3.5 75 73 A 67 TRP HA A 56 GLN HA 1.0 1.8 3.5 76 74 A 43 GLY HAx A 59 TRP HA 1.0 1.8 3.5 77 75 A 65 THR HA A 58 PHE HD% 1.0 1.8 5.0 78 76 A 29 ARG HA A 42 GLU HGx 1.0 1.8 6.0 79 77 A 26 MET HE% A 78 PHE H 1.0 1.8 6.0 80 78 A 44 GLU HA A 28 VAL HGx% 1.0 1.8 5.0 81 79 A 15 ALA HB% A 71 HIS HBx 1.0 1.8 6.0 82 80 A 55 VAL HGx% A 69 HIS HA 1.0 1.8 5.0 83 81 A 57 VAL HGy% A 67 TRP HA 1.0 1.8 5.0 84 82 A 13 THR HG2% A 8 PHE HD% 1.0 1.8 5.0 85 83 A 8 PHE HD% A 13 THR HB 1.0 1.8 6.0 86 84 A 15 ALA HB% A 70 TRP HA 1.0 1.8 6.0 87 85 A 28 VAL HGx% A 43 GLY H 1.0 1.8 5.0 88 86 A 30 MET HE% A 37 ILE H 1.0 1.8 5.0 89 87 A 30 MET HE% A 37 ILE HA 1.0 1.8 6.0 90 88 A 30 MET HE% A 37 ILE HG1x 1.0 1.8 6.0 91 89 A 30 MET HE% A 37 ILE HG1y 1.0 1.8 5.0 92 90 A 39 ALA HB% A 33 ASP HBx 1.0 1.8 6.0 93 91 A 57 VAL H A 67 TRP H 1.0 1.8 5.0 94 92 A 57 VAL HGy% A 68 VAL HGy% 1.0 1.8 3.5 95 93 A 43 GLY HAy A 60 GLU HG2 1.0 1.8 5.0 96 93 A 43 GLY HAy A 60 GLU HG3 1.0 1.8 5.0 97 94 A 55 VAL HGx% A 69 HIS H 1.0 1.8 5.0 98 95 A 15 ALA HB% A 71 HIS HBy 1.0 1.8 5.0 99 96 A 68 VAL H A 56 GLN HA 1.0 1.8 5.0 100 97 A 40 GLY H A 29 ARG HG2 1.0 1.8 6.0 101 97 A 40 GLY H A 29 ARG HG3 1.0 1.8 6.0 102 98 A 41 ASP H A 30 MET HB2 1.0 1.8 3.5 103 98 A 30 MET HB3 A 41 ASP H 1.0 1.8 3.5 104 99 A 26 MET HE% A 77 GLY HAx 1.0 1.8 5.0 105 100 A 33 ASP HA A 38 SER H 1.0 1.8 6.0 106 101 A 55 VAL HGx% A 70 TRP HA 1.0 1.8 5.0 107 102 A 71 HIS HA A 14 TYR HD% 1.0 1.8 5.0 108 103 A 46 ARG H A 57 VAL HA 1.0 1.8 3.5 109 104 A 74 GLU HBy A 31 LEU HDx% 1.0 1.8 6.0 110 105 A 56 GLN HGx A 66 TYR H 1.0 1.8 5.0 111 106 A 65 THR HG2% A 56 GLN HGy 1.0 1.8 5.0 112 107 A 65 THR HB A 56 GLN HE2x 1.0 1.8 5.0 113 108 A 37 ILE HG2% A 30 MET HB2 1.0 1.8 2.7 114 108 A 37 ILE HG2% A 30 MET HB3 1.0 1.8 2.7 115 109 A 37 ILE HG2% A 30 MET HGy 1.0 1.8 2.7 116 110 A 70 TRP H A 15 ALA HB% 1.0 1.8 5.0 117 111 A 44 GLU H A 58 PHE HBy 1.0 1.8 3.5 118 112 A 44 GLU H A 58 PHE H 1.0 1.8 3.5 119 113 A 59 TRP H A 44 GLU H 1.0 1.8 6.0 120 114 A 39 ALA HA A 30 MET HGx 1.0 1.8 3.5 121 115 A 39 ALA HA A 30 MET HB2 1.0 1.8 3.5 122 115 A 30 MET HB3 A 39 ALA HA 1.0 1.8 3.5 123 116 A 30 MET HE% A 39 ALA HA 1.0 1.8 6.0 124 117 A 29 ARG H A 76 LEU H 1.0 1.8 6.0 125 118 A 27 ARG HA A 43 GLY H 1.0 1.8 5.0 126 119 A 47 GLN H A 56 GLN HGx 1.0 1.8 6.0 127 120 A 47 GLN H A 56 GLN HGy 1.0 1.8 6.0 128 121 A 68 VAL H A 57 VAL HGy% 1.0 1.8 5.0 129 122 A 43 GLY H A 28 VAL H 1.0 1.8 3.5 130 123 A 55 VAL H A 67 TRP HBy 1.0 1.8 5.0 131 124 A 64 ARG H A 58 PHE HE% 1.0 1.8 5.0 132 125 A 28 VAL HGx% A 44 GLU H 1.0 1.8 6.0 133 126 A 29 ARG H A 76 LEU HDx% 1.0 1.8 5.0 134 126 A 29 ARG H A 76 LEU HDy% 1.0 1.8 5.0 135 127 A 77 GLY H A 27 ARG H 1.0 1.8 6.0 136 128 A 58 PHE HA A 66 TYR H 1.0 1.8 5.0 137 129 A 74 GLU H A 29 ARG HBx 1.0 1.8 5.0 138 130 A 8 PHE HD% A 14 TYR H 1.0 1.8 5.0 139 131 A 45 PHE H A 57 VAL HGy% 1.0 1.8 5.0 140 132 A 31 LEU H A 39 ALA HB% 1.0 1.8 6.0 141 133 A 28 VAL HGx% A 76 LEU H 1.0 1.8 5.0 142 134 A 56 GLN H A 48 SER HBy 1.0 1.8 6.0 143 135 A 56 GLN H A 48 SER HBx 1.0 1.8 6.0 144 136 A 33 ASP H A 39 ALA HA 1.0 1.8 6.0 145 137 A 66 TYR H A 58 PHE H 1.0 1.8 6.0 146 138 A 74 GLU H A 31 LEU HDx% 1.0 1.8 5.0 147 139 A 74 GLU HA A 31 LEU HDy% 1.0 1.8 6.0 148 140 A 31 LEU HDx% A 74 GLU HA 1.0 1.8 6.0 149 141 A 74 GLU HBy A 31 LEU HDy% 1.0 1.8 5.0 150 142 A 48 SER HA A 55 VAL HGy% 1.0 1.8 5.0 151 143 A 28 VAL HA A 75 ILE HA 1.0 1.8 5.0 152 144 A 31 LEU HDy% A 74 GLU HGy 1.0 1.8 6.0 153 145 A 27 ARG HA A 44 GLU HGy 1.0 1.8 6.0 154 146 A 29 ARG HA A 42 GLU HGy 1.0 1.8 6.0 155 147 A 75 ILE HD1% A 22 LEU HDy% 1.0 1.8 6.0 156 148 A 57 VAL HGx% A 44 GLU HB2 1.0 1.8 5.0 157 148 A 57 VAL HGx% A 44 GLU HB3 1.0 1.8 5.0 158 149 A 15 ALA HB% A 70 TRP HB2 1.0 1.8 3.5 159 149 A 15 ALA HB% A 70 TRP HB3 1.0 1.8 3.5 160 150 A 55 VAL HGx% A 68 VAL HGx% 1.0 1.8 5.0 161 151 A 37 ILE HD1% A 66 TYR HBy 1.0 1.8 5.0 162 152 A 37 ILE HD1% A 66 TYR HBx 1.0 1.8 5.0 163 153 A 48 SER HBy A 70 TRP HZ2 1.0 1.8 3.5 164 154 A 55 VAL HGy% A 68 VAL HGy% 1.0 1.8 6.0 165 155 A 57 VAL HGy% A 68 VAL HGx% 1.0 1.8 5.0 166 156 A 55 VAL HGy% A 68 VAL HGx% 1.0 1.8 6.0 167 157 A 75 ILE HD1% A 21 THR HG2% 1.0 1.8 5.0 168 158 A 59 TRP HE1 A 66 TYR HBx 1.0 1.8 2.7 169 159 A 65 THR HG2% A 56 GLN HE2x 1.0 1.8 5.0 170 160 A 30 MET H A 42 GLU HA 1.0 1.8 5.0 171 161 A 55 VAL HGx% A 68 VAL HGy% 1.0 1.8 3.5 172 162 A 44 GLU HA A 28 VAL HGy% 1.0 1.8 5.0 173 163 A 31 LEU HDx% A 74 GLU HGy 1.0 1.8 6.0 174 164 A 31 LEU HDx% A 74 GLU HGx 1.0 1.8 6.0 175 165 A 33 ASP HA A 38 SER HBx 1.0 1.8 6.0 176 166 A 66 TYR H A 59 TRP HE1 1.0 1.8 5.0 177 167 A 59 TRP H A 66 TYR H 1.0 1.8 5.0 178 168 A 66 TYR HBy A 59 TRP HD1 1.0 1.8 5.0 179 169 A 65 THR HA A 59 TRP HD1 1.0 1.8 5.0 180 170 A 68 VAL H A 57 VAL H 1.0 1.8 5.0 181 171 A 56 GLN H A 67 TRP HA 1.0 1.8 5.0 182 172 A 43 GLY HAx A 60 GLU HG2 1.0 1.8 6.0 183 172 A 43 GLY HAx A 60 GLU HG3 1.0 1.8 6.0 184 173 A 33 ASP HA A 39 ALA HA 1.0 1.8 5.0 185 174 A 68 VAL H A 55 VAL HA 1.0 1.8 5.0 186 175 A 5 ARG HDx A 14 TYR HE% 1.0 1.8 6.0 187 176 A 41 ASP H A 29 ARG HG2 1.0 1.8 6.0 188 176 A 41 ASP H A 29 ARG HG3 1.0 1.8 6.0 189 177 A 56 GLN HBy A 47 GLN HB2 1.0 1.8 6.0 190 177 A 56 GLN HBy A 47 GLN HB3 1.0 1.8 6.0 191 178 A 77 GLY HAx A 26 MET HB2 1.0 1.8 6.0 192 178 A 77 GLY HAx A 26 MET HB3 1.0 1.8 6.0 193 179 A 55 VAL HGx% A 70 TRP HB2 1.0 1.8 5.0 194 179 A 55 VAL HGx% A 70 TRP HB3 1.0 1.8 5.0 195 180 A 30 MET HE% A 68 VAL HGx% 1.0 1.8 3.5 196 181 A 58 PHE H A 46 ARG HG2 1.0 1.8 5.0 197 181 A 58 PHE H A 46 ARG HG3 1.0 1.8 5.0 198 182 A 46 ARG H A 58 PHE H 1.0 1.8 5.0 199 183 A 28 VAL HGx% A 45 PHE HBx 1.0 1.8 5.0 200 184 A 28 VAL HGx% A 45 PHE HBy 1.0 1.8 2.7 201 185 A 59 TRP HE1 A 66 TYR HA 1.0 1.8 6.0 202 186 A 45 PHE H A 57 VAL HGx% 1.0 1.8 5.0 203 187 A 65 THR HA A 57 VAL HA 1.0 1.8 6.0 204 188 A 39 ALA H A 33 ASP HBy 1.0 1.8 5.0 205 189 A 39 ALA HB% A 33 ASP HBy 1.0 1.8 5.0 206 190 A 65 THR HG2% A 58 PHE HBx 1.0 1.8 5.0 207 191 A 65 THR HG2% A 56 GLN HE2y 1.0 1.8 5.0 208 192 A 65 THR HG2% A 58 PHE HD% 1.0 1.8 3.5 209 193 A 37 ILE HG2% A 30 MET HGx 1.0 1.8 5.0 210 194 A 28 VAL HGx% A 57 VAL HGx% 1.0 1.8 3.5 211 195 A 28 VAL HGx% A 57 VAL HGy% 1.0 1.8 3.5 212 196 A 44 GLU H A 58 PHE HD% 1.0 1.8 5.0 213 197 A 55 VAL HGx% A 70 TRP HE1 1.0 1.8 5.0 214 198 A 37 ILE HD1% A 59 TRP HD1 1.0 1.8 3.5 215 199 A 66 TYR H A 56 GLN HA 1.0 1.8 5.0 216 200 A 65 THR HA A 59 TRP HE1 1.0 1.8 6.0 217 201 A 15 ALA HB% A 71 HIS HD2 1.0 1.8 6.0 218 202 A 43 GLY H A 29 ARG HA 1.0 1.8 5.0 219 203 A 43 GLY H A 28 VAL HA 1.0 1.8 5.0 220 204 A 58 PHE HD% A 65 THR H 1.0 1.8 5.0 221 205 A 75 ILE HD1% A 21 THR H 1.0 1.8 6.0 222 206 A 55 VAL H A 69 HIS H 1.0 1.8 6.0 223 207 A 71 HIS HA A 15 ALA H 1.0 1.8 6.0 224 208 A 77 GLY HAx A 27 ARG H 1.0 1.8 6.0 225 209 A 66 TYR HE% A 37 ILE H 1.0 1.8 6.0 226 210 A 74 GLU H A 31 LEU HDy% 1.0 1.8 6.0 227 211 A 74 GLU H A 29 ARG HA 1.0 1.8 6.0 228 212 A 74 GLU H A 28 VAL HA 1.0 1.8 6.0 229 213 A 30 MET HGy A 41 ASP H 1.0 1.8 5.0 230 214 A 30 MET HGx A 41 ASP H 1.0 1.8 6.0 231 215 A 75 ILE HD1% A 23 GLN H 1.0 1.8 6.0 232 216 A 14 TYR H A 8 PHE HBy 1.0 1.8 6.0 233 217 A 30 MET H A 42 GLU HGx 1.0 1.8 6.0 234 218 A 56 GLN HA A 67 TRP H 1.0 1.8 5.0 235 219 A 76 LEU H A 28 VAL HB 1.0 1.8 6.0 236 220 A 59 TRP H A 64 ARG H 1.0 1.8 5.0 237 221 A 77 GLY H A 26 MET HB2 1.0 1.8 6.0 238 221 A 77 GLY H A 26 MET HB3 1.0 1.8 6.0 239 222 A 28 VAL H A 76 LEU HDx% 1.0 1.8 6.0 240 222 A 28 VAL H A 76 LEU HDy% 1.0 1.8 6.0 241 223 A 40 GLY H A 32 ASP H 1.0 1.8 6.0 242 224 A 58 PHE HD% A 64 ARG H 1.0 1.8 5.0 243 225 A 70 TRP H A 55 VAL HGy% 1.0 1.8 6.0 244 226 A 30 MET H A 42 GLU H 1.0 1.8 6.0 245 227 A 29 ARG H A 75 ILE HA 1.0 1.8 5.0 246 228 A 74 GLU H A 30 MET H 1.0 1.8 6.0 247 229 A 59 TRP H A 43 GLY HAy 1.0 1.8 6.0 248 230 A 42 GLU HA A 29 ARG HG2 1.0 1.8 5.0 249 230 A 42 GLU HA A 29 ARG HG3 1.0 1.8 5.0 250 231 A 28 VAL HGy% A 42 GLU HA 1.0 1.8 5.0 251 232 A 71 HIS HA A 15 ALA HA 1.0 1.8 5.0 252 233 A 58 PHE HBy A 44 GLU HB2 1.0 1.8 3.5 253 233 A 58 PHE HBy A 44 GLU HB3 1.0 1.8 3.5 254 234 A 28 VAL HA A 76 LEU HDx% 1.0 1.8 5.0 255 234 A 28 VAL HA A 76 LEU HDy% 1.0 1.8 5.0 256 235 A 31 LEU HDy% A 74 GLU HGx 1.0 1.8 6.0 257 236 A 37 ILE HD1% A 66 TYR HA 1.0 1.8 6.0 258 237 A 28 VAL HB A 76 LEU HDx% 1.0 1.8 6.0 259 237 A 76 LEU HDy% A 28 VAL HB 1.0 1.8 6.0 260 238 A 28 VAL HGy% A 42 GLU HGx 1.0 1.8 6.0 261 239 A 75 ILE HD1% A 22 LEU HDx% 1.0 1.8 6.0 262 240 A 37 ILE HG2% A 68 VAL HGy% 1.0 1.8 5.0 263 241 A 22 LEU HDy% A 75 ILE HG2% 1.0 1.8 6.0 264 242 A 28 VAL HGx% A 75 ILE HA 1.0 1.8 5.0 265 243 A 55 VAL HGx% A 48 SER HA 1.0 1.8 6.0 266 244 A 42 GLU HA A 29 ARG HD2 1.0 1.8 6.0 267 244 A 42 GLU HA A 29 ARG HD3 1.0 1.8 6.0 268 245 A 13 THR HB A 8 PHE HBx 1.0 1.8 5.0 269 246 A 13 THR HB A 8 PHE HBy 1.0 1.8 6.0 270 247 A 40 GLY HAy A 29 ARG HG2 1.0 1.8 6.0 271 247 A 29 ARG HG3 A 40 GLY HAy 1.0 1.8 6.0 272 248 A 40 GLY HAx A 29 ARG HG2 1.0 1.8 5.0 273 248 A 29 ARG HG3 A 40 GLY HAx 1.0 1.8 5.0 274 249 A 57 VAL HGy% A 45 PHE HBy 1.0 1.8 5.0 275 250 A 57 VAL HGx% A 43 GLY HAx 1.0 1.8 3.5 276 251 A 57 VAL HGx% A 43 GLY HAy 1.0 1.8 5.0 277 252 A 13 THR HG2% A 8 PHE HBx 1.0 1.8 6.0 278 253 A 13 THR HG2% A 8 PHE HBy 1.0 1.8 6.0 279 254 A 65 THR HB A 58 PHE HA 1.0 1.8 5.0 280 255 A 28 VAL HGy% A 45 PHE HBx 1.0 1.8 6.0 281 256 A 28 VAL HGy% A 45 PHE HBy 1.0 1.8 5.0 282 257 A 39 ALA HB% A 32 ASP HA 1.0 1.8 5.0 283 258 A 48 SER HA A 70 TRP HZ2 1.0 1.8 5.0 284 259 A 48 SER HA A 55 VAL HA 1.0 1.8 5.0 285 260 A 75 ILE HD1% A 21 THR HB 1.0 1.8 5.0 286 261 A 28 VAL HGx% A 76 LEU HDx% 1.0 1.8 6.0 287 261 A 28 VAL HGx% A 76 LEU HDy% 1.0 1.8 6.0 288 262 A 55 VAL HGx% A 70 TRP HE3 1.0 1.8 5.0 289 263 A 74 GLU H A 28 VAL HB 1.0 1.8 5.0 290 264 A 58 PHE HE% A 63 GLY HAx 1.0 1.8 5.0 291 265 A 44 GLU HA A 57 VAL HGx% 1.0 1.8 5.0 292 266 A 21 THR HG2% A 75 ILE HG2% 1.0 1.8 5.0 293 267 A 68 VAL HGy% A 37 ILE HG1y 1.0 1.8 5.0 294 268 A 55 VAL HGy% A 48 SER HBy 1.0 1.8 3.5 295 269 A 28 VAL HGy% A 45 PHE HA 1.0 1.8 5.0 296 270 A 56 GLN HBx A 47 GLN HB2 1.0 1.8 5.0 297 270 A 56 GLN HBx A 47 GLN HB3 1.0 1.8 5.0 298 271 A 38 SER HA A 33 ASP HBx 1.0 1.8 6.0 299 272 A 43 GLY HAx A 59 TRP HB2 1.0 1.8 5.0 300 272 A 43 GLY HAx A 59 TRP HB3 1.0 1.8 5.0 301 273 A 39 ALA HA A 32 ASP HA 1.0 1.8 5.0 302 274 A 43 GLY HAy A 59 TRP HA 1.0 1.8 3.5 303 275 A 75 ILE HA A 28 VAL HB 1.0 1.8 5.0 304 276 A 33 ASP HA A 38 SER HBy 1.0 1.8 6.0 305 277 A 68 VAL HGy% A 57 VAL HB 1.0 1.8 2.7 306 278 A 75 ILE HD1% A 18 VAL HGx% 1.0 1.8 6.0 307 279 A 55 VAL H A 67 TRP HD1 1.0 1.8 6.0 308 280 A 71 HIS HBx A 14 TYR HD% 1.0 1.8 5.0 309 281 A 75 ILE HD1% A 18 VAL HA 1.0 1.8 6.0 310 282 A 29 ARG H A 74 GLU HBy 1.0 1.8 5.0 311 283 A 57 VAL H A 66 TYR HA 1.0 1.8 5.0 312 284 A 14 TYR HE% A 5 ARG HA 1.0 1.8 6.0 313 285 A 14 TYR HE% A 5 ARG HGx 1.0 1.8 6.0 314 286 A 48 SER HBx A 70 TRP HZ2 1.0 1.8 5.0 315 287 A 70 TRP HE3 A 18 VAL HB 1.0 1.8 6.0 316 288 A 48 SER HBy A 70 TRP HH2 1.0 1.8 6.0 317 289 A 46 ARG H A 57 VAL H 1.0 1.8 6.0 318 290 A 37 ILE HB A 68 VAL HGy% 1.0 1.8 6.0 319 291 A 57 VAL HA A 46 ARG HG2 1.0 1.8 5.0 320 291 A 57 VAL HA A 46 ARG HG3 1.0 1.8 5.0 321 292 A 18 VAL HGy% A 70 TRP HB2 1.0 1.8 5.0 322 292 A 70 TRP HB3 A 18 VAL HGy% 1.0 1.8 5.0 323 293 A 57 VAL HA A 45 PHE HD% 1.0 1.8 5.0 324 294 A 57 VAL HGx% A 68 VAL HGy% 1.0 1.8 3.5 325 295 A 57 VAL HGy% A 45 PHE HD% 1.0 1.8 3.5 326 296 A 66 TYR H A 57 VAL HA 1.0 1.8 5.0 327 297 A 65 THR HA A 56 GLN HGx 1.0 1.8 6.0 328 298 A 56 GLN HBx A 65 THR HG2% 1.0 1.8 6.0 329 299 A 37 ILE HG2% A 30 MET H 1.0 1.8 5.0 330 300 A 58 PHE HBx A 44 GLU HB2 1.0 1.8 5.0 331 300 A 58 PHE HBx A 44 GLU HB3 1.0 1.8 5.0 332 301 A 56 GLN H A 47 GLN HE2x 1.0 1.8 6.0 333 302 A 37 ILE HD1% A 59 TRP HE1 1.0 1.8 5.0 334 303 A 37 ILE HD1% A 59 TRP HB2 1.0 1.8 5.0 335 303 A 37 ILE HD1% A 59 TRP HB3 1.0 1.8 5.0 336 304 A 65 THR HA A 59 TRP HB2 1.0 1.8 5.0 337 304 A 65 THR HA A 59 TRP HB3 1.0 1.8 5.0 338 305 A 30 MET HE% A 72 MET H 1.0 1.8 6.0 339 306 A 30 MET HE% A 72 MET HA 1.0 1.8 6.0 340 307 A 30 MET HE% A 72 MET HE% 1.0 1.8 3.5 341 308 A 65 THR HG2% A 46 ARG HG2 1.0 1.8 6.0 342 308 A 65 THR HG2% A 46 ARG HG3 1.0 1.8 6.0 343 309 A 70 TRP HE3 A 18 VAL HGy% 1.0 1.8 5.0 344 310 A 43 GLY H A 60 GLU H 1.0 1.8 6.0 345 311 A 43 GLY H A 60 GLU HG2 1.0 1.8 6.0 346 311 A 43 GLY H A 60 GLU HG3 1.0 1.8 6.0 347 312 A 43 GLY H A 57 VAL HGx% 1.0 1.8 5.0 348 313 A 58 PHE HA A 65 THR H 1.0 1.8 5.0 349 314 A 47 GLN H A 57 VAL HGy% 1.0 1.8 5.0 350 315 A 44 GLU HGy A 25 GLY H 1.0 1.8 6.0 351 316 A 58 PHE HE% A 63 GLY H 1.0 1.8 6.0 352 317 A 45 PHE HBy A 25 GLY H 1.0 1.8 6.0 353 318 A 68 VAL H A 55 VAL HB 1.0 1.8 5.0 354 319 A 28 VAL H A 44 GLU H 1.0 1.8 5.0 355 320 A 70 TRP H A 55 VAL HB 1.0 1.8 5.0 356 321 A 42 GLU H A 60 GLU HG2 1.0 1.8 6.0 357 321 A 60 GLU HG3 A 42 GLU H 1.0 1.8 6.0 358 322 A 49 ASN H A 55 VAL HA 1.0 1.8 5.0 359 323 A 71 HIS HBx A 15 ALA H 1.0 1.8 6.0 360 324 A 78 PHE H A 26 MET HB2 1.0 1.8 6.0 361 324 A 78 PHE H A 26 MET HB3 1.0 1.8 6.0 362 325 A 66 TYR H A 37 ILE HD1% 1.0 1.8 6.0 363 326 A 60 GLU H A 42 GLU H 1.0 1.8 6.0 364 327 A 59 TRP HE1 A 68 VAL HGx% 1.0 1.8 5.0 365 328 A 66 TYR HE% A 59 TRP HE1 1.0 1.8 6.0 366 329 A 58 PHE H A 43 GLY HAx 1.0 1.8 5.0 367 330 A 30 MET H A 41 ASP HB2 1.0 1.8 5.0 368 330 A 30 MET H A 41 ASP HB3 1.0 1.8 5.0 369 331 A 45 PHE H A 27 ARG HGx 1.0 1.8 6.0 370 332 A 39 ALA H A 32 ASP HA 1.0 1.8 6.0 371 333 A 76 LEU H A 27 ARG H 1.0 1.8 6.0 372 334 A 27 ARG HA A 76 LEU H 1.0 1.8 6.0 373 335 A 59 TRP H A 64 ARG HA 1.0 1.8 5.0 374 336 A 42 GLU H A 61 SER H 1.0 1.8 6.0 375 337 A 40 GLY H A 31 LEU HA 1.0 1.8 5.0 376 338 A 42 GLU H A 59 TRP HZ3 1.0 1.8 5.0 377 339 A 49 ASN H A 70 TRP HZ2 1.0 1.8 6.0 378 340 A 18 VAL HB A 70 TRP HB2 1.0 1.8 6.0 379 340 A 70 TRP HB3 A 18 VAL HB 1.0 1.8 6.0 380 341 A 28 VAL HGy% A 42 GLU HBx 1.0 1.8 6.0 381 342 A 55 VAL HGy% A 70 TRP HA 1.0 1.8 6.0 382 343 A 27 ARG HA A 44 GLU HGx 1.0 1.8 6.0 383 344 A 42 GLU HGy A 29 ARG HG2 1.0 1.8 6.0 384 344 A 29 ARG HG3 A 42 GLU HGy 1.0 1.8 6.0 385 345 A 75 ILE HD1% A 22 LEU HB2 1.0 1.8 5.0 386 345 A 75 ILE HD1% A 22 LEU HB3 1.0 1.8 5.0 387 346 A 59 TRP HZ3 A 41 ASP HB2 1.0 1.8 5.0 388 346 A 41 ASP HB3 A 59 TRP HZ3 1.0 1.8 5.0 389 347 A 39 ALA HB% A 31 LEU HA 1.0 1.8 5.0 390 348 A 30 MET HGy A 39 ALA HB% 1.0 1.8 6.0 391 349 A 28 VAL HA A 75 ILE HG2% 1.0 1.8 6.0 392 350 A 57 VAL HGx% A 28 VAL HB 1.0 1.8 5.0 393 351 A 57 VAL HGx% A 68 VAL HGx% 1.0 1.8 5.0 394 352 A 65 THR HG2% A 46 ARG HDy 1.0 1.8 6.0 395 353 A 44 GLU HA A 27 ARG HDx 1.0 1.8 6.0 396 354 A 44 GLU HA A 27 ARG HDy 1.0 1.8 6.0 397 355 A 15 ALA HB% A 70 TRP HD1 1.0 1.8 5.0 398 356 A 55 VAL HGx% A 69 HIS HBx 1.0 1.8 6.0 399 357 A 55 VAL HGx% A 48 SER HBy 1.0 1.8 6.0 400 358 A 42 GLU HGx A 29 ARG HD2 1.0 1.8 6.0 401 358 A 42 GLU HGx A 29 ARG HD3 1.0 1.8 6.0 402 359 A 44 GLU HGy A 25 GLY HAy 1.0 1.8 5.0 403 360 A 44 GLU HGy A 25 GLY HAx 1.0 1.8 6.0 404 361 A 37 ILE HD1% A 68 VAL HGy% 1.0 1.8 5.0 405 362 A 28 VAL HGy% A 57 VAL HGy% 1.0 1.8 3.5 406 363 A 57 VAL HGy% A 28 VAL HB 1.0 1.8 5.0 407 364 A 55 VAL HGy% A 68 VAL HB 1.0 1.8 5.0 408 365 A 57 VAL HGy% A 45 PHE HBx 1.0 1.8 5.0 409 366 A 55 VAL HGy% A 70 TRP HE3 1.0 1.8 5.0 410 367 A 55 VAL HGy% A 48 SER HBx 1.0 1.8 5.0 411 368 A 28 VAL HGy% A 57 VAL HGx% 1.0 1.8 2.7 412 369 A 58 PHE HBx A 46 ARG HG2 1.0 1.8 5.0 413 369 A 58 PHE HBx A 46 ARG HG3 1.0 1.8 5.0 414 370 A 21 THR HG2% A 75 ILE HG1y 1.0 1.8 6.0 415 371 A 58 PHE HD% A 44 GLU HB2 1.0 1.8 5.0 416 371 A 58 PHE HD% A 44 GLU HB3 1.0 1.8 5.0 417 372 A 26 MET HE% A 77 GLY HAy 1.0 1.8 6.0 418 373 A 28 VAL HB A 73 LEU HDx% 1.0 1.8 5.0 419 374 A 42 GLU H A 60 GLU HB2 1.0 1.8 6.0 420 374 A 42 GLU H A 60 GLU HB3 1.0 1.8 6.0 421 375 A 58 PHE HE% A 63 GLY HAy 1.0 1.8 5.0 422 376 A 22 LEU HDy% A 75 ILE HG1y 1.0 1.8 5.0 423 377 A 68 VAL HGx% A 57 VAL HB 1.0 1.8 5.0 424 378 A 45 PHE HA A 57 VAL HA 1.0 1.8 3.5 425 379 A 70 TRP HA A 15 ALA HA 1.0 1.8 6.0 426 380 A 8 PHE HD% A 14 TYR HA 1.0 1.8 6.0 427 381 A 68 VAL HGx% A 59 TRP HZ2 1.0 1.8 3.5 428 382 A 66 TYR HE% A 36 GLU HGy 1.0 1.8 6.0 429 383 A 66 TYR HE% A 36 GLU H 1.0 1.8 6.0 430 384 A 66 TYR HBx A 59 TRP HD1 1.0 1.8 3.5 431 385 A 75 ILE HD1% A 17 TYR HD% 1.0 1.8 6.0 432 386 A 66 TYR HE% A 35 GLU HB2 1.0 1.8 6.0 433 386 A 66 TYR HE% A 35 GLU HB3 1.0 1.8 6.0 434 387 A 37 ILE HG2% A 59 TRP HB2 1.0 1.8 5.0 435 387 A 37 ILE HG2% A 59 TRP HB3 1.0 1.8 5.0 436 388 A 29 ARG HBx A 74 GLU HA 1.0 1.8 6.0 437 389 A 14 TYR HE% A 5 ARG HDy 1.0 1.8 6.0 438 390 A 55 VAL HGy% A 45 PHE HA 1.0 1.8 5.0 439 391 A 44 GLU HGx A 25 GLY HAy 1.0 1.8 6.0 440 392 A 48 SER HA A 70 TRP HH2 1.0 1.8 6.0 441 393 A 18 VAL HGx% A 70 TRP HB2 1.0 1.8 6.0 442 393 A 70 TRP HB3 A 18 VAL HGx% 1.0 1.8 6.0 443 394 A 72 MET HE% A 32 ASP HBx 1.0 1.8 6.0 444 395 A 30 MET HE% A 68 VAL HB 1.0 1.8 6.0 445 396 A 30 MET HE% A 68 VAL HGy% 1.0 1.8 5.0 446 397 A 37 ILE HG2% A 68 VAL HGx% 1.0 1.8 5.0 447 398 A 68 VAL HGx% A 37 ILE HG1y 1.0 1.8 6.0 448 399 A 28 VAL HGx% A 45 PHE HD% 1.0 1.8 5.0 449 400 A 74 GLU H A 31 LEU HB2 1.0 1.8 6.0 450 400 A 74 GLU H A 31 LEU HB3 1.0 1.8 6.0 451 401 A 28 VAL HA A 76 LEU HA 1.0 1.8 6.0 452 402 A 22 LEU HDx% A 75 ILE HG2% 1.0 1.8 6.0 453 403 A 22 LEU HDy% A 75 ILE HG1x 1.0 1.8 6.0 454 404 A 28 VAL HGx% A 57 VAL HB 1.0 1.8 6.0 455 405 A 56 GLN HBx A 47 GLN HE2y 1.0 1.8 6.0 456 406 A 59 TRP HE1 A 37 ILE HG1y 1.0 1.8 5.0 457 407 A 66 TYR HBy A 59 TRP HB2 1.0 1.8 6.0 458 407 A 66 TYR HBy A 59 TRP HB3 1.0 1.8 6.0 459 408 A 56 GLN HBy A 46 ARG HB2 1.0 1.8 6.0 460 408 A 56 GLN HBy A 46 ARG HB3 1.0 1.8 6.0 461 409 A 45 PHE HBy A 26 MET H 1.0 1.8 6.0 462 410 A 58 PHE HE% A 65 THR H 1.0 1.8 5.0 463 411 A 45 PHE HBx A 25 GLY H 1.0 1.8 5.0 464 412 A 45 PHE HD% A 25 GLY H 1.0 1.8 5.0 465 413 A 64 ARG H A 59 TRP HB2 1.0 1.8 3.5 466 413 A 64 ARG H A 59 TRP HB3 1.0 1.8 3.5 467 414 A 49 ASN H A 55 VAL HB 1.0 1.8 6.0 468 415 A 45 PHE HBx A 26 MET H 1.0 1.8 3.5 469 416 A 27 ARG H A 22 LEU HDx% 1.0 1.8 6.0 470 417 A 74 GLU H A 30 MET HA 1.0 1.8 5.0 471 418 A 59 TRP HE1 A 37 ILE HG1x 1.0 1.8 5.0 472 419 A 30 MET H A 59 TRP HH2 1.0 1.8 5.0 473 420 A 31 LEU H A 68 VAL HGx% 1.0 1.8 6.0 474 421 A 48 SER HBy A 70 TRP HE1 1.0 1.8 6.0 475 422 A 70 TRP HE1 A 55 VAL HB 1.0 1.8 5.0 476 423 A 59 TRP H A 37 ILE HD1% 1.0 1.8 6.0 477 424 A 41 ASP H A 59 TRP HZ3 1.0 1.8 6.0 478 425 A 58 PHE H A 46 ARG HDy 1.0 1.8 6.0 479 426 A 29 ARG HA A 59 TRP HH2 1.0 1.8 5.0 480 427 A 42 GLU HA A 59 TRP HH2 1.0 1.8 6.0 481 428 A 15 ALA HA A 70 TRP HB2 1.0 1.8 3.5 482 428 A 70 TRP HB3 A 15 ALA HA 1.0 1.8 3.5 483 429 A 56 GLN HGx A 67 TRP HA 1.0 1.8 6.0 484 430 A 27 ARG HA A 44 GLU HB2 1.0 1.8 5.0 485 430 A 27 ARG HA A 44 GLU HB3 1.0 1.8 5.0 486 431 A 6 SER HA A 11 GLY HAx 1.0 1.8 5.0 487 432 A 14 TYR HD% A 5 ARG HA 1.0 1.8 6.0 488 433 A 37 ILE HG2% A 59 TRP HH2 1.0 1.8 5.0 489 434 A 45 PHE HD% A 24 PRO HA 1.0 1.8 2.7 490 435 A 26 MET HE% A 78 PHE HA 1.0 1.8 6.0 491 436 A 65 THR HG2% A 46 ARG HDx 1.0 1.8 6.0 492 437 A 72 MET HE% A 34 TYR HA 1.0 1.8 6.0 493 438 A 40 GLY HAy A 29 ARG HD2 1.0 1.8 6.0 494 438 A 29 ARG HD3 A 40 GLY HAy 1.0 1.8 6.0 495 439 A 28 VAL HGx% A 43 GLY HAx 1.0 1.8 6.0 496 440 A 13 THR HG2% A 8 PHE HE% 1.0 1.8 6.0 497 441 A 28 VAL HGy% A 59 TRP HH2 1.0 1.8 3.5 498 442 A 21 THR HG2% A 75 ILE HG1x 1.0 1.8 6.0 499 443 A 55 VAL HA A 67 TRP HBx 1.0 1.8 6.0 500 444 A 43 GLY HAy A 60 GLU HB2 1.0 1.8 5.0 501 444 A 43 GLY HAy A 60 GLU HB3 1.0 1.8 5.0 502 445 A 13 THR HB A 8 PHE HE% 1.0 1.8 6.0 503 446 A 72 MET HE% A 34 TYR HBy 1.0 1.8 5.0 504 447 A 26 MET HE% A 75 ILE HG2% 1.0 1.8 6.0 505 448 A 26 MET HE% A 78 PHE HD% 1.0 1.8 6.0 506 449 A 30 MET HE% A 59 TRP HH2 1.0 1.8 5.0 507 450 A 28 VAL HGy% A 73 LEU HDx% 1.0 1.8 5.0 508 451 A 28 VAL HGx% A 73 LEU HDx% 1.0 1.8 5.0 509 452 A 37 ILE HD1% A 62 THR HG2% 1.0 1.8 5.0 510 453 A 59 TRP HE1 A 68 VAL HGy% 1.0 1.8 2.7 511 454 A 42 GLU HA A 59 TRP HZ3 1.0 1.8 3.5 512 455 A 30 MET HGy A 37 ILE HD1% 1.0 1.8 6.0 513 456 A 37 ILE HG2% A 59 TRP HZ3 1.0 1.8 5.0 514 457 A 75 ILE HG2% A 21 THR HB 1.0 1.8 6.0 515 458 A 57 VAL HGx% A 45 PHE HBy 1.0 1.8 5.0 516 459 A 55 VAL HGy% A 70 TRP HZ3 1.0 1.8 5.0 517 460 A 58 PHE HA A 46 ARG HG2 1.0 1.8 6.0 518 460 A 58 PHE HA A 46 ARG HG3 1.0 1.8 6.0 519 461 A 37 ILE HG1y A 66 TYR HD% 1.0 1.8 5.0 520 462 A 68 VAL HGx% A 30 MET HB2 1.0 1.8 5.0 521 462 A 30 MET HB3 A 68 VAL HGx% 1.0 1.8 5.0 522 463 A 67 TRP HBy A 54 PRO HBx 1.0 1.8 6.0 523 464 A 37 ILE HB A 30 MET HB2 1.0 1.8 5.0 524 464 A 30 MET HB3 A 37 ILE HB 1.0 1.8 5.0 525 465 A 29 ARG HBx A 74 GLU HGx 1.0 1.8 5.0 526 466 A 42 GLU HGy A 29 ARG HBy 1.0 1.8 6.0 527 467 A 37 ILE HG1y A 66 TYR HBx 1.0 1.8 5.0 528 468 A 40 GLY HAx A 29 ARG HD2 1.0 1.8 5.0 529 468 A 29 ARG HD3 A 40 GLY HAx 1.0 1.8 5.0 530 469 A 43 GLY HAx A 59 TRP HZ3 1.0 1.8 5.0 531 470 A 69 HIS HA A 53 PRO HBx 1.0 1.8 5.0 532 471 A 69 HIS HA A 53 PRO HBy 1.0 1.8 5.0 533 472 A 28 VAL HA A 74 GLU HBy 1.0 1.8 6.0 534 473 A 69 HIS HA A 53 PRO HA 1.0 1.8 5.0 535 474 A 67 TRP HBy A 54 PRO HA 1.0 1.8 6.0 536 475 A 68 VAL HGy% A 59 TRP HZ2 1.0 1.8 2.7 537 476 A 66 TYR HE% A 37 ILE HB 1.0 1.8 5.0 538 477 A 68 VAL HGy% A 34 TYR HE% 1.0 1.8 6.0 539 478 A 34 TYR HE% A 68 VAL HA 1.0 1.8 6.0 540 479 A 66 TYR HE% A 34 TYR HE% 1.0 1.8 5.0 541 480 A 68 VAL HGx% A 59 TRP HH2 1.0 1.8 5.0 542 481 A 30 MET HGx A 59 TRP HH2 1.0 1.8 5.0 543 482 A 58 PHE HD% A 63 GLY HAx 1.0 1.8 5.0 544 483 A 14 TYR HD% A 5 ARG HDx 1.0 1.8 6.0 545 484 A 72 MET HE% A 34 TYR HD% 1.0 1.8 5.0 546 485 A 68 VAL HGy% A 34 TYR HD% 1.0 1.8 6.0 547 486 A 68 VAL HA A 34 TYR HD% 1.0 1.8 6.0 548 487 A 28 VAL HA A 76 LEU HB2 1.0 1.8 5.0 549 487 A 28 VAL HA A 76 LEU HB3 1.0 1.8 5.0 550 488 A 66 TYR HE% A 34 TYR HD% 1.0 1.8 5.0 551 489 A 55 VAL HGy% A 45 PHE HBy 1.0 1.8 6.0 552 490 A 55 VAL HGy% A 45 PHE HD% 1.0 1.8 5.0 553 491 A 70 TRP HE3 A 19 ARG HA 1.0 1.8 5.0 554 492 A 56 GLN HBx A 46 ARG H 1.0 1.8 5.0 555 493 A 74 GLU HGx A 29 ARG HG2 1.0 1.8 6.0 556 493 A 29 ARG HG3 A 74 GLU HGx 1.0 1.8 6.0 557 494 A 71 HIS HA A 18 VAL HGy% 1.0 1.8 6.0 558 495 A 55 VAL HGy% A 70 TRP HH2 1.0 1.8 5.0 559 496 A 75 ILE HD1% A 17 TYR HE% 1.0 1.8 6.0 560 497 A 77 GLY H A 27 ARG HB2 1.0 1.8 6.0 561 497 A 77 GLY H A 27 ARG HB3 1.0 1.8 6.0 562 498 A 43 GLY H A 59 TRP HH2 1.0 1.8 6.0 563 499 A 37 ILE HD1% A 62 THR H 1.0 1.8 6.0 564 500 A 56 GLN HE2y A 67 TRP HE1 1.0 1.8 6.0 565 501 A 32 ASP H A 72 MET HA 1.0 1.8 6.0 566 502 A 45 PHE HD% A 26 MET H 1.0 1.8 5.0 567 503 A 29 ARG H A 73 LEU HA 1.0 1.8 5.0 568 504 A 30 MET H A 76 LEU HDx% 1.0 1.8 6.0 569 504 A 30 MET H A 76 LEU HDy% 1.0 1.8 6.0 570 505 A 39 ALA H A 30 MET HE% 1.0 1.8 6.0 571 506 A 45 PHE H A 24 PRO HA 1.0 1.8 6.0 572 507 A 31 LEU H A 73 LEU HA 1.0 1.8 5.0 573 508 A 70 TRP HE1 A 54 PRO HDy 1.0 1.8 6.0 574 509 A 70 TRP HE1 A 54 PRO HG2 1.0 1.8 6.0 575 509 A 70 TRP HE1 A 54 PRO HG3 1.0 1.8 6.0 576 510 A 56 GLN HE2x A 67 TRP HE1 1.0 1.8 6.0 577 511 A 24 PRO HGy A 47 GLN HB2 1.0 1.8 6.0 578 511 A 47 GLN HB3 A 24 PRO HGy 1.0 1.8 6.0 579 512 A 36 GLU HGy A 66 TYR HD% 1.0 1.8 6.0 580 513 A 11 GLY HAx A 6 SER HB2 1.0 1.8 5.0 581 513 A 11 GLY HAx A 6 SER HB3 1.0 1.8 5.0 582 514 A 75 ILE HG2% A 17 TYR HE% 1.0 1.8 6.0 583 515 A 75 ILE HG2% A 18 VAL HA 1.0 1.8 5.0 584 516 A 55 VAL HGx% A 67 TRP HBx 1.0 1.8 5.0 585 517 A 72 MET HE% A 32 ASP HBy 1.0 1.8 6.0 586 518 A 71 HIS HA A 18 VAL HGx% 1.0 1.8 6.0 587 519 A 55 VAL HGy% A 47 GLN HB2 1.0 1.8 6.0 588 519 A 55 VAL HGy% A 47 GLN HB3 1.0 1.8 6.0 589 520 A 74 GLU HGx A 31 LEU HG 1.0 1.8 6.0 590 521 A 44 GLU HGy A 27 ARG HGy 1.0 1.8 6.0 591 522 A 78 PHE HD% A 26 MET HA 1.0 1.8 6.0 592 523 A 56 GLN HGx A 46 ARG HDx 1.0 1.8 6.0 593 524 A 8 PHE HE% A 14 TYR HB2 1.0 1.8 6.0 594 524 A 8 PHE HE% A 14 TYR HB3 1.0 1.8 6.0 595 525 A 59 TRP HH2 A 41 ASP HB2 1.0 1.8 5.0 596 525 A 41 ASP HB3 A 59 TRP HH2 1.0 1.8 5.0 597 526 A 75 ILE HD1% A 26 MET HE% 1.0 1.8 6.0 598 527 A 37 ILE HG2% A 59 TRP HZ2 1.0 1.8 5.0 599 528 A 55 VAL HGx% A 70 TRP HZ3 1.0 1.8 6.0 600 529 A 28 VAL HGy% A 59 TRP HZ3 1.0 1.8 3.5 601 530 A 62 THR HG2% A 36 GLU HBx 1.0 1.8 6.0 602 531 A 74 GLU HBy A 29 ARG HBy 1.0 1.8 5.0 603 532 A 66 TYR HBy A 37 ILE HG1x 1.0 1.8 6.0 604 533 A 41 ASP HA A 30 MET HB2 1.0 1.8 5.0 605 533 A 30 MET HB3 A 41 ASP HA 1.0 1.8 5.0 606 534 A 30 MET HE% A 59 TRP HZ2 1.0 1.8 6.0 607 535 A 14 TYR HE% A 8 PHE HE% 1.0 1.8 5.0 608 536 A 37 ILE HG2% A 66 TYR HD% 1.0 1.8 5.0 609 537 A 22 LEU HDy% A 73 LEU HDx% 1.0 1.8 6.0 610 538 A 22 LEU HDy% A 73 LEU HDx% 1.0 1.8 6.0 611 539 A 26 MET HE% A 23 GLN H 1.0 1.8 3.5 612 540 A 31 LEU H A 32 ASP H 1.0 1.8 3.5 613 541 A 24 PRO HDx A 24 PRO HDy 1.0 1.8 2.7 614 542 A 37 ILE HD1% A 37 ILE H 1.0 1.8 3.5 615 543 A 17 TYR H A 16 LEU H 1.0 1.8 2.7 616 544 A 16 LEU H A 13 THR HA 1.0 1.8 3.5 617 545 A 71 HIS H A 72 MET H 1.0 1.8 3.5 618 546 A 64 ARG H A 62 THR HB 1.0 1.8 5.0 619 547 A 24 PRO HDy A 23 GLN HA 1.0 1.8 3.5 620 548 A 82 ILE HA A 82 ILE H 1.0 1.8 3.5 621 549 A 17 TYR H A 17 TYR HA 1.0 1.8 2.7 622 550 A 69 HIS H A 72 MET HE% 1.0 1.8 5.0 623 551 A 64 ARG H A 62 THR HG2% 1.0 1.8 5.0 624 552 A 20 ASP H A 19 ARG H 1.0 1.8 3.5 625 553 A 57 VAL HGy% A 55 VAL HGy% 1.0 1.8 3.5 626 554 A 27 ARG HA A 28 VAL H 1.0 1.8 2.7 627 555 A 69 HIS H A 72 MET H 1.0 1.8 5.0 628 556 A 72 MET H A 69 HIS HBy 1.0 1.8 5.0 629 557 A 82 ILE HA A 82 ILE HG2% 1.0 1.8 3.5 630 558 A 24 PRO HDx A 23 GLN HA 1.0 1.8 2.7 631 559 A 82 ILE H A 82 ILE HG2% 1.0 1.8 5.0 632 560 A 30 MET HE% A 32 ASP H 1.0 1.8 3.5 633 561 A 18 VAL HGx% A 18 VAL H 1.0 1.8 2.7 634 562 A 28 VAL HGy% A 29 ARG H 1.0 1.8 3.5 635 563 A 64 ARG H A 63 GLY H 1.0 1.8 2.7 636 564 A 57 VAL HGx% A 58 PHE H 1.0 1.8 2.7 637 565 A 17 TYR H A 18 VAL H 1.0 1.8 3.5 638 566 A 17 TYR HD% A 18 VAL H 1.0 1.8 5.0 639 567 A 28 VAL HGy% A 28 VAL H 1.0 1.8 2.7 640 568 A 76 LEU H A 75 ILE HG2% 1.0 1.8 5.0 641 569 A 70 TRP H A 72 MET H 1.0 1.8 5.0 642 570 A 47 GLN H A 47 GLN HB2 1.0 1.8 3.5 643 570 A 47 GLN H A 47 GLN HB3 1.0 1.8 3.5 644 571 A 63 GLY H A 62 THR H 1.0 1.8 2.7 645 572 A 68 VAL H A 68 VAL HA 1.0 1.8 3.5 646 573 A 23 GLN H A 26 MET H 1.0 1.8 5.0 647 574 A 31 LEU H A 30 MET HA 1.0 1.8 2.7 648 575 A 67 TRP H A 66 TYR HBx 1.0 1.8 5.0 649 576 A 68 VAL HGy% A 67 TRP H 1.0 1.8 5.0 650 577 A 56 GLN H A 57 VAL HGy% 1.0 1.8 5.0 651 578 A 34 TYR H A 38 SER H 1.0 1.8 6.0 652 579 A 46 ARG HA A 46 ARG HB2 1.0 1.8 2.7 653 579 A 46 ARG HB3 A 46 ARG HA 1.0 1.8 2.7 654 580 A 24 PRO HDx A 23 GLN HGy 1.0 1.8 6.0 655 581 A 23 GLN HA A 23 GLN HGy 1.0 1.8 5.0 656 582 A 24 PRO HDy A 23 GLN HGy 1.0 1.8 5.0 657 583 A 19 ARG HA A 19 ARG H 1.0 1.8 2.7 658 584 A 82 ILE HA A 82 ILE HD1% 1.0 1.8 5.0 659 585 A 82 ILE H A 82 ILE HD1% 1.0 1.8 5.0 660 586 A 68 VAL HGy% A 66 TYR HBx 1.0 1.8 3.5 661 587 A 27 ARG HA A 27 ARG HGx 1.0 1.8 5.0 662 588 A 26 MET HE% A 23 GLN HGy 1.0 1.8 6.0 663 589 A 55 VAL HGx% A 57 VAL HGy% 1.0 1.8 2.7 664 590 A 68 VAL H A 67 TRP HA 1.0 1.8 2.7 665 591 A 82 ILE HG2% A 82 ILE HD1% 1.0 1.8 3.5 666 592 A 57 VAL H A 56 GLN HA 1.0 1.8 2.7 667 593 A 64 ARG HA A 64 ARG HG2 1.0 1.8 3.5 668 593 A 64 ARG HA A 64 ARG HG3 1.0 1.8 3.5 669 594 A 62 THR HB A 64 ARG HG2 1.0 1.8 5.0 670 594 A 62 THR HB A 64 ARG HG3 1.0 1.8 5.0 671 595 A 62 THR HG2% A 64 ARG HG2 1.0 1.8 6.0 672 595 A 62 THR HG2% A 64 ARG HG3 1.0 1.8 6.0 673 596 A 38 SER HA A 34 TYR H 1.0 1.8 3.5 674 597 A 37 ILE HG2% A 38 SER H 1.0 1.8 2.7 675 598 A 34 TYR HD% A 35 GLU H 1.0 1.8 5.0 676 599 A 22 LEU H A 21 THR H 1.0 1.8 2.7 677 600 A 67 TRP H A 66 TYR HA 1.0 1.8 2.7 678 601 A 67 TRP HA A 67 TRP H 1.0 1.8 3.5 679 602 A 56 GLN H A 56 GLN HA 1.0 1.8 3.5 680 603 A 56 GLN HGx A 57 VAL H 1.0 1.8 3.5 681 604 A 19 ARG H A 19 ARG HG2 1.0 1.8 5.0 682 604 A 19 ARG H A 19 ARG HG3 1.0 1.8 5.0 683 605 A 19 ARG H A 18 VAL H 1.0 1.8 3.5 684 606 A 26 MET HE% A 23 GLN HA 1.0 1.8 6.0 685 607 A 35 GLU H A 35 GLU HA 1.0 1.8 2.7 686 608 A 47 GLN H A 46 ARG HB2 1.0 1.8 2.7 687 608 A 47 GLN H A 46 ARG HB3 1.0 1.8 2.7 688 609 A 82 ILE HG2% A 83 GLU HBy 1.0 1.8 6.0 689 610 A 58 PHE H A 57 VAL HA 1.0 1.8 2.7 690 611 A 17 TYR H A 16 LEU HG 1.0 1.8 5.0 691 612 A 70 TRP H A 71 HIS H 1.0 1.8 3.5 692 613 A 82 ILE HG2% A 83 GLU H 1.0 1.8 5.0 693 614 A 18 VAL HGx% A 17 TYR HD% 1.0 1.8 5.0 694 615 A 56 GLN HBy A 56 GLN HGy 1.0 1.8 3.5 695 616 A 28 VAL H A 27 ARG HGx 1.0 1.8 5.0 696 617 A 15 ALA H A 16 LEU H 1.0 1.8 2.7 697 618 A 14 TYR HA A 16 LEU H 1.0 1.8 5.0 698 619 A 77 GLY H A 75 ILE HG2% 1.0 1.8 6.0 699 620 A 30 MET H A 29 ARG HG2 1.0 1.8 3.5 700 620 A 30 MET H A 29 ARG HG3 1.0 1.8 3.5 701 621 A 37 ILE H A 34 TYR HD% 1.0 1.8 5.0 702 622 A 83 GLU H A 83 GLU HA 1.0 1.8 3.5 703 623 A 37 ILE HG2% A 34 TYR H 1.0 1.8 6.0 704 624 A 57 VAL H A 56 GLN HGy 1.0 1.8 5.0 705 625 A 16 LEU H A 18 VAL H 1.0 1.8 5.0 706 626 A 52 VAL HGy% A 52 VAL H 1.0 1.8 2.7 707 627 A 82 ILE HG2% A 83 GLU HA 1.0 1.8 6.0 708 628 A 68 VAL H A 68 VAL HGy% 1.0 1.8 2.7 709 629 A 16 LEU H A 16 LEU HDx% 1.0 1.8 5.0 710 630 A 32 ASP H A 30 MET HA 1.0 1.8 5.0 711 631 A 32 ASP H A 30 MET HB2 1.0 1.8 5.0 712 631 A 30 MET HB3 A 32 ASP H 1.0 1.8 5.0 713 632 A 21 THR H A 20 ASP H 1.0 1.8 2.7 714 633 A 72 MET H A 72 MET HBy 1.0 1.8 5.0 715 634 A 72 MET H A 72 MET HA 1.0 1.8 3.5 716 635 A 64 ARG H A 64 ARG HA 1.0 1.8 3.5 717 636 A 17 TYR HD% A 17 TYR H 1.0 1.8 5.0 718 637 A 82 ILE H A 82 ILE HG1y 1.0 1.8 6.0 719 638 A 37 ILE H A 37 ILE HG1y 1.0 1.8 5.0 720 639 A 37 ILE H A 37 ILE HG1x 1.0 1.8 5.0 721 640 A 22 LEU H A 23 GLN H 1.0 1.8 5.0 722 641 A 18 VAL H A 17 TYR HBy 1.0 1.8 5.0 723 642 A 23 GLN H A 23 GLN HGy 1.0 1.8 5.0 724 643 A 23 GLN H A 24 PRO HDx 1.0 1.8 5.0 725 644 A 34 TYR H A 37 ILE H 1.0 1.8 5.0 726 645 A 58 PHE H A 58 PHE HBy 1.0 1.8 2.7 727 646 A 30 MET H A 30 MET HA 1.0 1.8 3.5 728 647 A 30 MET H A 29 ARG HBy 1.0 1.8 5.0 729 648 A 30 MET H A 29 ARG HBx 1.0 1.8 5.0 730 649 A 30 MET HE% A 31 LEU H 1.0 1.8 5.0 731 650 A 31 LEU H A 30 MET HB2 1.0 1.8 5.0 732 650 A 31 LEU H A 30 MET HB3 1.0 1.8 5.0 733 651 A 31 LEU H A 30 MET HGy 1.0 1.8 5.0 734 652 A 31 LEU H A 30 MET HGx 1.0 1.8 3.5 735 653 A 59 TRP H A 57 VAL HGx% 1.0 1.8 5.0 736 654 A 17 TYR H A 13 THR HA 1.0 1.8 5.0 737 655 A 23 GLN H A 24 PRO HDy 1.0 1.8 5.0 738 656 A 5 ARG HBy A 5 ARG HBx 1.0 1.8 2.7 739 657 A 23 GLN HBx A 23 GLN HBy 1.0 1.8 2.7 740 658 A 26 MET HE% A 23 GLN HBy 1.0 1.8 6.0 741 659 A 47 GLN HA A 47 GLN HB2 1.0 1.8 2.7 742 659 A 47 GLN HB3 A 47 GLN HA 1.0 1.8 2.7 743 660 A 47 GLN H A 47 GLN HA 1.0 1.8 3.5 744 661 A 72 MET HA A 72 MET HBy 1.0 1.8 3.5 745 662 A 23 GLN HA A 23 GLN HGx 1.0 1.8 5.0 746 663 A 23 GLN HGy A 23 GLN HBx 1.0 1.8 3.5 747 664 A 23 GLN HGy A 23 GLN HGx 1.0 1.8 2.7 748 665 A 23 GLN HGy A 23 GLN HBy 1.0 1.8 3.5 749 666 A 36 GLU HBx A 36 GLU HA 1.0 1.8 3.5 750 667 A 64 ARG HBy A 64 ARG HG2 1.0 1.8 2.7 751 667 A 64 ARG HG3 A 64 ARG HBy 1.0 1.8 2.7 752 668 A 64 ARG HA A 64 ARG HBx 1.0 1.8 3.5 753 669 A 64 ARG HBx A 64 ARG HG2 1.0 1.8 2.7 754 669 A 64 ARG HG3 A 64 ARG HBx 1.0 1.8 2.7 755 670 A 64 ARG HA A 64 ARG HBy 1.0 1.8 3.5 756 671 A 64 ARG HBy A 64 ARG HBx 1.0 1.8 2.7 757 672 A 62 THR HG2% A 64 ARG HBx 1.0 1.8 6.0 758 673 A 62 THR HG2% A 64 ARG HBy 1.0 1.8 6.0 759 674 A 62 THR HB A 64 ARG HBy 1.0 1.8 6.0 760 675 A 37 ILE HD1% A 37 ILE HA 1.0 1.8 3.5 761 676 A 29 ARG HA A 29 ARG HBx 1.0 1.8 3.5 762 677 A 29 ARG HA A 29 ARG HBy 1.0 1.8 3.5 763 678 A 29 ARG HBx A 29 ARG HBy 1.0 1.8 2.7 764 679 A 56 GLN HGx A 56 GLN HGy 1.0 1.8 2.7 765 680 A 37 ILE HB A 37 ILE HA 1.0 1.8 3.5 766 681 A 37 ILE HD1% A 37 ILE HB 1.0 1.8 3.5 767 682 A 82 ILE HD1% A 82 ILE HG1y 1.0 1.8 2.7 768 683 A 82 ILE HA A 82 ILE HB 1.0 1.8 3.5 769 684 A 75 ILE HA A 75 ILE HB 1.0 1.8 3.5 770 685 A 58 PHE HBx A 58 PHE HBy 1.0 1.8 2.7 771 686 A 37 ILE HG2% A 37 ILE HA 1.0 1.8 2.7 772 687 A 37 ILE HG2% A 37 ILE HB 1.0 1.8 2.7 773 688 A 37 ILE HG2% A 37 ILE HD1% 1.0 1.8 3.5 774 689 A 37 ILE HG2% A 37 ILE H 1.0 1.8 5.0 775 690 A 24 PRO HA A 24 PRO HBx 1.0 1.8 3.5 776 691 A 82 ILE HG2% A 82 ILE HG1y 1.0 1.8 3.5 777 692 A 82 ILE HG2% A 82 ILE HB 1.0 1.8 2.7 778 693 A 13 THR HA A 16 LEU HDy% 1.0 1.8 3.5 779 694 A 13 THR HA A 16 LEU HDx% 1.0 1.8 5.0 780 695 A 75 ILE HG2% A 75 ILE HB 1.0 1.8 2.7 781 696 A 27 ARG HA A 27 ARG HDy 1.0 1.8 5.0 782 697 A 62 THR HB A 64 ARG HDx 1.0 1.8 6.0 783 698 A 62 THR HG2% A 64 ARG HDx 1.0 1.8 6.0 784 699 A 68 VAL HGy% A 68 VAL HGx% 1.0 1.8 2.7 785 700 A 62 THR HB A 64 ARG HBx 1.0 1.8 6.0 786 701 A 28 VAL HGy% A 28 VAL HA 1.0 1.8 3.5 787 702 A 27 ARG HA A 28 VAL HGy% 1.0 1.8 5.0 788 703 A 5 ARG HBy A 5 ARG HGy 1.0 1.8 3.5 789 704 A 5 ARG HBx A 5 ARG HGy 1.0 1.8 3.5 790 705 A 37 ILE HG2% A 37 ILE HG1x 1.0 1.8 2.7 791 706 A 37 ILE HD1% A 37 ILE HG1y 1.0 1.8 2.7 792 707 A 82 ILE HA A 82 ILE HG1y 1.0 1.8 5.0 793 708 A 75 ILE HA A 75 ILE HG1y 1.0 1.8 5.0 794 709 A 75 ILE HG1y A 75 ILE HB 1.0 1.8 2.7 795 710 A 75 ILE HG2% A 75 ILE HG1y 1.0 1.8 3.5 796 711 A 24 PRO HDy A 23 GLN HBy 1.0 1.8 5.0 797 712 A 24 PRO HDx A 23 GLN HBy 1.0 1.8 5.0 798 713 A 24 PRO HDx A 23 GLN HBx 1.0 1.8 5.0 799 714 A 24 PRO HDy A 23 GLN HBx 1.0 1.8 3.5 800 715 A 24 PRO HGy A 24 PRO HDy 1.0 1.8 3.5 801 716 A 27 ARG HGx A 27 ARG HDy 1.0 1.8 3.5 802 717 A 23 GLN HA A 23 GLN HBx 1.0 1.8 2.7 803 718 A 19 ARG HBy A 19 ARG HG2 1.0 1.8 2.7 804 718 A 19 ARG HG3 A 19 ARG HBy 1.0 1.8 2.7 805 719 A 19 ARG HBx A 19 ARG HG2 1.0 1.8 2.7 806 719 A 19 ARG HG3 A 19 ARG HBx 1.0 1.8 2.7 807 720 A 19 ARG HBy A 19 ARG HBx 1.0 1.8 2.7 808 721 A 19 ARG H A 19 ARG HBy 1.0 1.8 3.5 809 722 A 37 ILE H A 37 ILE HA 1.0 1.8 3.5 810 723 A 56 GLN HGy A 56 GLN HA 1.0 1.8 5.0 811 724 A 17 TYR H A 17 TYR HBy 1.0 1.8 2.7 812 725 A 75 ILE HA A 75 ILE HG2% 1.0 1.8 3.5 813 726 A 72 MET HE% A 69 HIS HBy 1.0 1.8 5.0 814 727 A 18 VAL HGx% A 18 VAL HB 1.0 1.8 2.7 815 728 A 18 VAL HGx% A 19 ARG H 1.0 1.8 5.0 816 729 A 56 GLN H A 55 VAL HGy% 1.0 1.8 2.7 817 730 A 37 ILE HD1% A 37 ILE HG1x 1.0 1.8 2.7 818 731 A 37 ILE HB A 37 ILE HG1x 1.0 1.8 3.5 819 732 A 19 ARG H A 19 ARG HBx 1.0 1.8 3.5 820 733 A 17 TYR HA A 18 VAL H 1.0 1.8 3.5 821 734 A 26 MET H A 26 MET HB2 1.0 1.8 2.7 822 734 A 26 MET HB3 A 26 MET H 1.0 1.8 2.7 823 735 A 37 ILE HB A 37 ILE H 1.0 1.8 2.7 824 736 A 82 ILE H A 82 ILE HB 1.0 1.8 5.0 825 737 A 58 PHE H A 58 PHE HBx 1.0 1.8 3.5 826 738 A 30 MET H A 29 ARG HA 1.0 1.8 2.7 827 739 A 23 GLN HA A 23 GLN HBy 1.0 1.8 3.5 828 740 A 37 ILE HA A 37 ILE HG1x 1.0 1.8 5.0 829 741 A 17 TYR HD% A 17 TYR HA 1.0 1.8 3.5 830 742 A 76 LEU H A 77 GLY H 1.0 1.8 5.0 831 743 A 63 GLY H A 62 THR HB 1.0 1.8 5.0 832 744 A 64 ARG H A 64 ARG HG2 1.0 1.8 5.0 833 744 A 64 ARG H A 64 ARG HG3 1.0 1.8 5.0 834 745 A 67 TRP HA A 68 VAL HGy% 1.0 1.8 3.5 835 746 A 68 VAL HGy% A 66 TYR HA 1.0 1.8 5.0 836 747 A 57 VAL HGy% A 55 VAL HA 1.0 1.8 5.0 837 748 A 66 TYR HBx A 66 TYR HA 1.0 1.8 3.5 838 749 A 56 GLN H A 55 VAL HA 1.0 1.8 2.7 839 750 A 72 MET H A 72 MET HGx 1.0 1.8 5.0 840 751 A 69 HIS H A 72 MET HGx 1.0 1.8 5.0 841 752 A 15 ALA H A 17 TYR HBx 1.0 1.8 6.0 842 753 A 27 ARG HGx A 27 ARG HB2 1.0 1.8 2.7 843 753 A 27 ARG HGx A 27 ARG HB3 1.0 1.8 2.7 844 754 A 27 ARG HA A 27 ARG HB2 1.0 1.8 2.7 845 754 A 27 ARG HA A 27 ARG HB3 1.0 1.8 2.7 846 755 A 69 HIS HBy A 72 MET HGx 1.0 1.8 5.0 847 756 A 14 TYR HA A 17 TYR HBx 1.0 1.8 3.5 848 757 A 30 MET HA A 30 MET HB2 1.0 1.8 2.7 849 757 A 30 MET HB3 A 30 MET HA 1.0 1.8 2.7 850 758 A 20 ASP H A 19 ARG HG2 1.0 1.8 5.0 851 758 A 20 ASP H A 19 ARG HG3 1.0 1.8 5.0 852 759 A 23 GLN H A 23 GLN HA 1.0 1.8 3.5 853 760 A 36 GLU H A 36 GLU HA 1.0 1.8 2.7 854 761 A 57 VAL HGx% A 57 VAL HA 1.0 1.8 2.7 855 762 A 57 VAL HGy% A 57 VAL H 1.0 1.8 3.5 856 763 A 18 VAL HGx% A 17 TYR H 1.0 1.8 5.0 857 764 A 56 GLN HBx A 56 GLN HGy 1.0 1.8 2.7 858 765 A 17 TYR H A 16 LEU HDx% 1.0 1.8 5.0 859 766 A 60 GLU H A 61 SER H 1.0 1.8 2.7 860 767 A 47 GLN HB2 A 47 GLN HG2 1.0 1.8 2.7 861 767 A 47 GLN HB3 A 47 GLN HG2 1.0 1.8 2.7 862 767 A 47 GLN HG3 A 47 GLN HB2 1.0 1.8 2.7 863 767 A 47 GLN HB3 A 47 GLN HG3 1.0 1.8 2.7 864 768 A 47 GLN H A 47 GLN HG2 1.0 1.8 5.0 865 768 A 47 GLN H A 47 GLN HG3 1.0 1.8 5.0 866 769 A 19 ARG HA A 20 ASP H 1.0 1.8 3.5 867 770 A 79 GLU H A 80 GLU H 1.0 1.8 5.0 868 771 A 52 VAL H A 52 VAL HGx% 1.0 1.8 5.0 869 772 A 39 ALA H A 38 SER HA 1.0 1.8 2.7 870 773 A 66 TYR HBy A 66 TYR HA 1.0 1.8 2.7 871 774 A 82 ILE HA A 83 GLU HBy 1.0 1.8 6.0 872 775 A 63 GLY H A 62 THR HG2% 1.0 1.8 5.0 873 776 A 82 ILE HG2% A 82 ILE HG1x 1.0 1.8 3.5 874 777 A 29 ARG H A 29 ARG HBx 1.0 1.8 5.0 875 778 A 29 ARG H A 30 MET H 1.0 1.8 5.0 876 779 A 71 HIS HA A 72 MET H 1.0 1.8 3.5 877 780 A 29 ARG H A 29 ARG HA 1.0 1.8 3.5 878 781 A 36 GLU H A 35 GLU HB2 1.0 1.8 5.0 879 781 A 36 GLU H A 35 GLU HB3 1.0 1.8 5.0 880 782 A 57 VAL HGx% A 59 TRP HE1 1.0 1.8 5.0 881 783 A 18 VAL HGx% A 17 TYR HA 1.0 1.8 5.0 882 784 A 56 GLN HBy A 56 GLN HA 1.0 1.8 2.7 883 785 A 56 GLN HGx A 56 GLN HBy 1.0 1.8 3.5 884 786 A 67 TRP H A 66 TYR HD% 1.0 1.8 3.5 885 787 A 68 VAL HGy% A 66 TYR HD% 1.0 1.8 2.7 886 788 A 28 VAL H A 27 ARG HDy 1.0 1.8 6.0 887 789 A 76 LEU H A 75 ILE HA 1.0 1.8 2.7 888 790 A 20 ASP H A 18 VAL H 1.0 1.8 5.0 889 791 A 46 ARG HB3 A 47 GLN HB2 1.0 1.8 5.0 890 791 A 46 ARG HB2 A 47 GLN HB2 1.0 1.8 5.0 891 791 A 47 GLN HB3 A 46 ARG HB2 1.0 1.8 5.0 892 791 A 47 GLN HB3 A 46 ARG HB3 1.0 1.8 5.0 893 792 A 56 GLN HBx A 56 GLN HBy 1.0 1.8 2.7 894 793 A 25 GLY H A 26 MET H 1.0 1.8 2.7 895 794 A 24 PRO HA A 24 PRO HDy 1.0 1.8 5.0 896 795 A 24 PRO HDy A 24 PRO HBx 1.0 1.8 3.5 897 796 A 83 GLU HBy A 83 GLU H 1.0 1.8 3.5 898 797 A 82 ILE HD1% A 83 GLU HBy 1.0 1.8 6.0 899 798 A 66 TYR H A 66 TYR HA 1.0 1.8 3.5 900 799 A 71 HIS H A 69 HIS HBy 1.0 1.8 5.0 901 800 A 65 THR H A 64 ARG HA 1.0 1.8 2.7 902 801 A 47 GLN H A 46 ARG HA 1.0 1.8 3.5 903 802 A 47 GLN HE2y A 47 GLN HB2 1.0 1.8 5.0 904 802 A 47 GLN HB3 A 47 GLN HE2y 1.0 1.8 5.0 905 803 A 63 GLY H A 59 TRP HB2 1.0 1.8 5.0 906 803 A 59 TRP HB3 A 63 GLY H 1.0 1.8 5.0 907 804 A 56 GLN HGx A 56 GLN HE2y 1.0 1.8 5.0 908 805 A 56 GLN HGx A 56 GLN HE2x 1.0 1.8 3.5 909 806 A 56 GLN HGy A 56 GLN HE2x 1.0 1.8 3.5 910 807 A 56 GLN HGy A 56 GLN HE2y 1.0 1.8 5.0 911 808 A 28 VAL H A 28 VAL HA 1.0 1.8 3.5 912 809 A 47 GLN H A 48 SER H 1.0 1.8 5.0 913 810 A 30 MET HGy A 32 ASP H 1.0 1.8 5.0 914 811 A 32 ASP H A 31 LEU HDx% 1.0 1.8 6.0 915 812 A 30 MET HGx A 32 ASP H 1.0 1.8 3.5 916 813 A 32 ASP H A 31 LEU HG 1.0 1.8 6.0 917 814 A 21 THR H A 18 VAL HGx% 1.0 1.8 6.0 918 815 A 20 ASP H A 16 LEU HA 1.0 1.8 6.0 919 816 A 20 ASP H A 19 ARG HBx 1.0 1.8 5.0 920 817 A 72 MET H A 72 MET HGy 1.0 1.8 5.0 921 818 A 71 HIS HBy A 72 MET H 1.0 1.8 5.0 922 819 A 72 MET H A 69 HIS HBx 1.0 1.8 5.0 923 820 A 55 VAL H A 57 VAL HGy% 1.0 1.8 6.0 924 821 A 55 VAL H A 55 VAL HGy% 1.0 1.8 5.0 925 822 A 64 ARG H A 62 THR H 1.0 1.8 5.0 926 823 A 21 THR H A 19 ARG H 1.0 1.8 5.0 927 824 A 8 PHE HD% A 8 PHE H 1.0 1.8 3.5 928 825 A 19 ARG H A 19 ARG HDy 1.0 1.8 6.0 929 826 A 14 TYR HD% A 15 ALA H 1.0 1.8 5.0 930 827 A 17 TYR H A 16 LEU HDy% 1.0 1.8 5.0 931 828 A 82 ILE H A 82 ILE HG1x 1.0 1.8 6.0 932 829 A 37 ILE H A 36 GLU H 1.0 1.8 3.5 933 830 A 5 ARG H A 4 MET HBy 1.0 1.8 5.0 934 831 A 5 ARG H A 4 MET HBx 1.0 1.8 5.0 935 832 A 5 ARG H A 4 MET HA 1.0 1.8 2.7 936 833 A 36 GLU H A 35 GLU H 1.0 1.8 5.0 937 834 A 34 TYR HA A 35 GLU H 1.0 1.8 2.7 938 835 A 14 TYR H A 15 ALA H 1.0 1.8 2.7 939 836 A 37 ILE HB A 38 SER H 1.0 1.8 5.0 940 837 A 37 ILE HG1x A 38 SER H 1.0 1.8 6.0 941 838 A 34 TYR H A 34 TYR HD% 1.0 1.8 5.0 942 839 A 82 ILE H A 83 GLU H 1.0 1.8 5.0 943 840 A 45 PHE H A 45 PHE HA 1.0 1.8 3.5 944 841 A 74 GLU HBy A 75 ILE H 1.0 1.8 5.0 945 842 A 31 LEU H A 31 LEU HDx% 1.0 1.8 5.0 946 843 A 31 LEU H A 31 LEU HG 1.0 1.8 5.0 947 844 A 68 VAL H A 67 TRP H 1.0 1.8 5.0 948 845 A 66 TYR HE% A 67 TRP H 1.0 1.8 5.0 949 846 A 66 TYR HBy A 67 TRP H 1.0 1.8 5.0 950 847 A 56 GLN H A 55 VAL HGx% 1.0 1.8 5.0 951 848 A 56 GLN H A 55 VAL HB 1.0 1.8 5.0 952 849 A 59 TRP H A 58 PHE H 1.0 1.8 5.0 953 850 A 59 TRP H A 58 PHE HBy 1.0 1.8 5.0 954 851 A 59 TRP H A 58 PHE HBx 1.0 1.8 5.0 955 852 A 59 TRP H A 59 TRP HA 1.0 1.8 3.5 956 853 A 69 HIS H A 72 MET HGy 1.0 1.8 5.0 957 854 A 19 ARG H A 19 ARG HDx 1.0 1.8 6.0 958 855 A 15 ALA H A 14 TYR HA 1.0 1.8 3.5 959 856 A 15 ALA HA A 18 VAL H 1.0 1.8 5.0 960 857 A 34 TYR H A 35 GLU H 1.0 1.8 5.0 961 858 A 37 ILE H A 38 SER H 1.0 1.8 5.0 962 859 A 74 GLU H A 75 ILE H 1.0 1.8 5.0 963 860 A 56 GLN H A 55 VAL H 1.0 1.8 5.0 964 861 A 28 VAL HGy% A 29 ARG HA 1.0 1.8 5.0 965 862 A 37 ILE HD1% A 36 GLU HBx 1.0 1.8 5.0 966 863 A 24 PRO HBx A 24 PRO HBy 1.0 1.8 2.7 967 864 A 53 PRO HBy A 53 PRO HGy 1.0 1.8 3.5 968 865 A 4 MET HBx A 4 MET HGx 1.0 1.8 3.5 969 866 A 4 MET HA A 4 MET HGx 1.0 1.8 5.0 970 867 A 74 GLU HBy A 74 GLU HA 1.0 1.8 3.5 971 868 A 37 ILE HD1% A 38 SER H 1.0 1.8 5.0 972 869 A 85 MET HBx A 85 MET HA 1.0 1.8 3.5 973 870 A 24 PRO HDx A 23 GLN HGx 1.0 1.8 6.0 974 871 A 26 MET HE% A 23 GLN HGx 1.0 1.8 6.0 975 872 A 23 GLN HBx A 23 GLN HGx 1.0 1.8 3.5 976 873 A 24 PRO HDy A 23 GLN HGx 1.0 1.8 5.0 977 874 A 23 GLN HBy A 23 GLN HGx 1.0 1.8 3.5 978 875 A 72 MET HBy A 72 MET HGy 1.0 1.8 3.5 979 876 A 72 MET HA A 72 MET HGy 1.0 1.8 5.0 980 877 A 42 GLU HA A 42 GLU HBx 1.0 1.8 3.5 981 878 A 30 MET HGx A 30 MET HA 1.0 1.8 3.5 982 879 A 30 MET HGy A 30 MET HA 1.0 1.8 5.0 983 880 A 30 MET HGy A 30 MET HGx 1.0 1.8 2.7 984 881 A 30 MET HGx A 30 MET HB2 1.0 1.8 2.7 985 881 A 30 MET HB3 A 30 MET HGx 1.0 1.8 2.7 986 882 A 30 MET HGy A 30 MET HB2 1.0 1.8 2.7 987 882 A 30 MET HGy A 30 MET HB3 1.0 1.8 2.7 988 883 A 4 MET HBy A 4 MET HA 1.0 1.8 3.5 989 884 A 4 MET HBy A 4 MET HBx 1.0 1.8 2.7 990 885 A 4 MET HBx A 4 MET HA 1.0 1.8 3.5 991 886 A 4 MET HBy A 4 MET HGx 1.0 1.8 3.5 992 887 A 26 MET HA A 26 MET HB2 1.0 1.8 2.7 993 887 A 26 MET HB3 A 26 MET HA 1.0 1.8 2.7 994 888 A 34 TYR H A 34 TYR HA 1.0 1.8 3.5 995 889 A 53 PRO HA A 52 VAL HA 1.0 1.8 5.0 996 890 A 21 THR H A 19 ARG HA 1.0 1.8 5.0 997 891 A 37 ILE HA A 37 ILE HG1y 1.0 1.8 3.5 998 892 A 37 ILE HA A 38 SER H 1.0 1.8 2.7 999 893 A 56 GLN HGx A 56 GLN HA 1.0 1.8 3.5 1000 894 A 36 GLU HGy A 36 GLU HBx 1.0 1.8 3.5 1001 895 A 36 GLU HGy A 36 GLU HA 1.0 1.8 5.0 1002 896 A 32 ASP H A 31 LEU HB2 1.0 1.8 5.0 1003 896 A 32 ASP H A 31 LEU HB3 1.0 1.8 5.0 1004 897 A 82 ILE HD1% A 82 ILE HB 1.0 1.8 3.5 1005 898 A 42 GLU HGx A 42 GLU HBx 1.0 1.8 2.7 1006 899 A 42 GLU HA A 42 GLU HGx 1.0 1.8 3.5 1007 900 A 17 TYR HA A 17 TYR HBy 1.0 1.8 2.7 1008 901 A 37 ILE HG2% A 41 ASP HB2 1.0 1.8 2.7 1009 901 A 37 ILE HG2% A 41 ASP HB3 1.0 1.8 2.7 1010 902 A 26 MET HE% A 26 MET HA 1.0 1.8 5.0 1011 903 A 13 THR HA A 16 LEU HB2 1.0 1.8 5.0 1012 903 A 13 THR HA A 16 LEU HB3 1.0 1.8 5.0 1013 904 A 68 VAL HGx% A 69 HIS H 1.0 1.8 2.7 1014 905 A 68 VAL HGx% A 68 VAL HA 1.0 1.8 2.7 1015 906 A 68 VAL H A 68 VAL HGx% 1.0 1.8 5.0 1016 907 A 57 VAL HGx% A 58 PHE HBx 1.0 1.8 5.0 1017 908 A 28 VAL HGx% A 28 VAL H 1.0 1.8 3.5 1018 909 A 27 ARG HDx A 27 ARG HDy 1.0 1.8 2.7 1019 910 A 27 ARG HA A 27 ARG HDx 1.0 1.8 5.0 1020 911 A 72 MET HA A 72 MET HE% 1.0 1.8 6.0 1021 912 A 72 MET HE% A 72 MET HBy 1.0 1.8 5.0 1022 913 A 16 LEU HA A 19 ARG HDx 1.0 1.8 6.0 1023 914 A 64 ARG HBx A 64 ARG HDx 1.0 1.8 5.0 1024 915 A 64 ARG HA A 64 ARG HDx 1.0 1.8 6.0 1025 916 A 64 ARG HBy A 64 ARG HDx 1.0 1.8 5.0 1026 917 A 64 ARG HDx A 64 ARG HG2 1.0 1.8 2.7 1027 917 A 64 ARG HG3 A 64 ARG HDx 1.0 1.8 2.7 1028 918 A 62 THR HB A 64 ARG HDy 1.0 1.8 6.0 1029 919 A 5 ARG HDx A 5 ARG HBx 1.0 1.8 5.0 1030 920 A 5 ARG HDx A 5 ARG HBy 1.0 1.8 5.0 1031 921 A 77 GLY HAx A 75 ILE HG2% 1.0 1.8 6.0 1032 922 A 53 PRO HA A 52 VAL HGy% 1.0 1.8 6.0 1033 923 A 68 VAL HGy% A 68 VAL HA 1.0 1.8 2.7 1034 924 A 68 VAL HGy% A 69 HIS H 1.0 1.8 5.0 1035 925 A 57 VAL HGy% A 55 VAL HB 1.0 1.8 5.0 1036 926 A 13 THR HG2% A 13 THR HB 1.0 1.8 2.7 1037 927 A 28 VAL HGy% A 29 ARG HBx 1.0 1.8 6.0 1038 928 A 19 ARG HDy A 19 ARG HG2 1.0 1.8 2.7 1039 928 A 19 ARG HG3 A 19 ARG HDy 1.0 1.8 2.7 1040 929 A 19 ARG HDx A 19 ARG HG2 1.0 1.8 2.7 1041 929 A 19 ARG HG3 A 19 ARG HDx 1.0 1.8 2.7 1042 930 A 19 ARG HA A 19 ARG HG2 1.0 1.8 3.5 1043 930 A 19 ARG HA A 19 ARG HG3 1.0 1.8 3.5 1044 931 A 16 LEU HA A 19 ARG HG2 1.0 1.8 5.0 1045 931 A 19 ARG HG3 A 16 LEU HA 1.0 1.8 5.0 1046 932 A 5 ARG HGx A 5 ARG HBx 1.0 1.8 3.5 1047 933 A 5 ARG HGx A 5 ARG HBy 1.0 1.8 3.5 1048 934 A 5 ARG HDx A 5 ARG HGx 1.0 1.8 3.5 1049 935 A 5 ARG HDx A 5 ARG HGy 1.0 1.8 3.5 1050 936 A 35 GLU HGx A 35 GLU HB2 1.0 1.8 2.7 1051 936 A 35 GLU HB3 A 35 GLU HGx 1.0 1.8 2.7 1052 937 A 5 ARG HGx A 5 ARG HGy 1.0 1.8 2.7 1053 938 A 37 ILE HG2% A 37 ILE HG1y 1.0 1.8 3.5 1054 939 A 37 ILE HB A 37 ILE HG1y 1.0 1.8 2.7 1055 940 A 82 ILE HG1y A 82 ILE HB 1.0 1.8 3.5 1056 941 A 82 ILE HA A 82 ILE HG1x 1.0 1.8 5.0 1057 942 A 82 ILE HD1% A 82 ILE HG1x 1.0 1.8 2.7 1058 943 A 82 ILE HG1y A 82 ILE HG1x 1.0 1.8 2.7 1059 944 A 82 ILE HB A 82 ILE HG1x 1.0 1.8 3.5 1060 945 A 54 PRO HA A 54 PRO HDy 1.0 1.8 5.0 1061 946 A 54 PRO HA A 54 PRO HG2 1.0 1.8 3.5 1062 946 A 54 PRO HA A 54 PRO HG3 1.0 1.8 3.5 1063 947 A 24 PRO HA A 24 PRO HGy 1.0 1.8 3.5 1064 948 A 24 PRO HGy A 24 PRO HDx 1.0 1.8 2.7 1065 949 A 24 PRO HGy A 24 PRO HBx 1.0 1.8 3.5 1066 950 A 24 PRO HGy A 24 PRO HGx 1.0 1.8 2.7 1067 951 A 24 PRO HDy A 24 PRO HGx 1.0 1.8 2.7 1068 952 A 27 ARG HGx A 27 ARG HDx 1.0 1.8 3.5 1069 953 A 19 ARG HBx A 19 ARG HDx 1.0 1.8 5.0 1070 954 A 19 ARG HBx A 19 ARG HDy 1.0 1.8 5.0 1071 955 A 19 ARG HBy A 19 ARG HDy 1.0 1.8 5.0 1072 956 A 19 ARG HBy A 16 LEU HA 1.0 1.8 5.0 1073 957 A 19 ARG HA A 19 ARG HBx 1.0 1.8 3.5 1074 958 A 19 ARG HBx A 16 LEU HA 1.0 1.8 6.0 1075 959 A 19 ARG HBy A 19 ARG HDx 1.0 1.8 5.0 1076 960 A 19 ARG HA A 19 ARG HBy 1.0 1.8 3.5 1077 961 A 50 ASN HA A 51 GLY H 1.0 1.8 3.5 1078 962 A 74 GLU HA A 75 ILE H 1.0 1.8 2.7 1079 963 A 60 GLU H A 59 TRP HA 1.0 1.8 2.7 1080 964 A 59 TRP H A 58 PHE HA 1.0 1.8 2.7 1081 965 A 27 ARG H A 26 MET HA 1.0 1.8 2.7 1082 966 A 26 MET H A 26 MET HA 1.0 1.8 3.5 1083 967 A 29 ARG H A 28 VAL HA 1.0 1.8 2.7 1084 968 A 82 ILE HA A 83 GLU H 1.0 1.8 3.5 1085 969 A 13 THR HA A 13 THR H 1.0 1.8 2.7 1086 970 A 68 VAL H A 67 TRP HBy 1.0 1.8 5.0 1087 971 A 68 VAL H A 67 TRP HBx 1.0 1.8 5.0 1088 972 A 67 TRP HA A 67 TRP HBy 1.0 1.8 3.5 1089 973 A 67 TRP HA A 67 TRP HBx 1.0 1.8 2.7 1090 974 A 67 TRP HBy A 67 TRP HBx 1.0 1.8 2.7 1091 975 A 20 ASP H A 19 ARG HBy 1.0 1.8 5.0 1092 976 A 71 HIS H A 71 HIS HBy 1.0 1.8 3.5 1093 977 A 70 TRP H A 70 TRP HB2 1.0 1.8 2.7 1094 977 A 70 TRP H A 70 TRP HB3 1.0 1.8 2.7 1095 978 A 28 VAL HGy% A 28 VAL HB 1.0 1.8 2.7 1096 979 A 66 TYR HBy A 66 TYR HBx 1.0 1.8 2.7 1097 980 A 26 MET HE% A 26 MET HB2 1.0 1.8 3.5 1098 980 A 26 MET HE% A 26 MET HB3 1.0 1.8 3.5 1099 981 A 26 MET HE% A 23 GLN HBx 1.0 1.8 6.0 1100 982 A 26 MET HE% A 23 GLN HE2x 1.0 1.8 6.0 1101 983 A 26 MET HE% A 26 MET H 1.0 1.8 6.0 1102 984 A 28 VAL HGx% A 28 VAL HA 1.0 1.8 2.7 1103 985 A 28 VAL HGx% A 28 VAL HGy% 1.0 1.8 2.7 1104 986 A 72 MET HE% A 72 MET HGy 1.0 1.8 3.5 1105 987 A 72 MET H A 72 MET HE% 1.0 1.8 5.0 1106 988 A 30 MET HE% A 34 TYR H 1.0 1.8 5.0 1107 989 A 62 THR HG2% A 64 ARG HDy 1.0 1.8 6.0 1108 990 A 37 ILE HG1x A 37 ILE HG1y 1.0 1.8 2.7 1109 991 A 23 GLN H A 23 GLN HBx 1.0 1.8 3.5 1110 992 A 23 GLN H A 23 GLN HBy 1.0 1.8 3.5 1111 993 A 18 VAL HB A 18 VAL H 1.0 1.8 5.0 1112 994 A 70 TRP H A 70 TRP HA 1.0 1.8 2.7 1113 995 A 14 TYR H A 14 TYR HA 1.0 1.8 2.7 1114 996 A 14 TYR HD% A 14 TYR HA 1.0 1.8 3.5 1115 997 A 64 ARG H A 64 ARG HBx 1.0 1.8 5.0 1116 998 A 64 ARG H A 64 ARG HBy 1.0 1.8 5.0 1117 999 A 59 TRP HE1 A 57 VAL HB 1.0 1.8 3.5 1118 1000 A 29 ARG H A 28 VAL HB 1.0 1.8 2.7 1119 1001 A 43 GLY H A 42 GLU HA 1.0 1.8 2.7 1120 1002 A 37 ILE HD1% A 36 GLU HA 1.0 1.8 5.0 1121 1003 A 57 VAL HGx% A 58 PHE HBy 1.0 1.8 5.0 1122 1004 A 67 TRP HA A 68 VAL HA 1.0 1.8 5.0 1123 1005 A 58 PHE HA A 57 VAL HGx% 1.0 1.8 5.0 1124 1006 A 66 TYR HE% A 68 VAL HGy% 1.0 1.8 5.0 1125 1007 A 14 TYR HD% A 14 TYR HB2 1.0 1.8 2.7 1126 1007 A 14 TYR HD% A 14 TYR HB3 1.0 1.8 2.7 1127 1008 A 30 MET HE% A 34 TYR HD% 1.0 1.8 5.0 1128 1009 A 34 TYR HA A 34 TYR HD% 1.0 1.8 2.7 1129 1010 A 17 TYR HD% A 17 TYR HBy 1.0 1.8 2.7 1130 1011 A 87 GLU H A 86 VAL HGx% 1.0 1.8 5.0 1131 1011 A 87 GLU H A 86 VAL HGy% 1.0 1.8 5.0 1132 1012 A 69 HIS HA A 69 HIS H 1.0 1.8 3.5 1133 1013 A 37 ILE HG2% A 41 ASP H 1.0 1.8 5.0 1134 1014 A 57 VAL HGy% A 57 VAL HB 1.0 1.8 2.7 1135 1015 A 34 TYR HD% A 35 GLU HA 1.0 1.8 6.0 1136 1016 A 35 GLU HA A 35 GLU HB2 1.0 1.8 2.7 1137 1016 A 35 GLU HB3 A 35 GLU HA 1.0 1.8 2.7 1138 1017 A 52 VAL HGy% A 54 PRO HDx 1.0 1.8 5.0 1139 1018 A 55 VAL HGy% A 55 VAL HA 1.0 1.8 2.7 1140 1019 A 21 THR H A 21 THR HA 1.0 1.8 3.5 1141 1020 A 80 GLU H A 81 ASP H 1.0 1.8 5.0 1142 1021 A 17 TYR HA A 20 ASP H 1.0 1.8 5.0 1143 1022 A 72 MET H A 72 MET HBx 1.0 1.8 5.0 1144 1023 A 27 ARG H A 27 ARG HB2 1.0 1.8 2.7 1145 1023 A 27 ARG H A 27 ARG HB3 1.0 1.8 2.7 1146 1024 A 18 VAL H A 17 TYR HBx 1.0 1.8 3.5 1147 1025 A 69 HIS H A 72 MET HBx 1.0 1.8 6.0 1148 1026 A 27 ARG HDy A 27 ARG HB2 1.0 1.8 3.5 1149 1026 A 27 ARG HDy A 27 ARG HB3 1.0 1.8 3.5 1150 1027 A 72 MET HBy A 72 MET HBx 1.0 1.8 2.7 1151 1028 A 72 MET HA A 72 MET HBx 1.0 1.8 3.5 1152 1029 A 72 MET HGy A 72 MET HBx 1.0 1.8 3.5 1153 1030 A 72 MET HA A 72 MET HGx 1.0 1.8 5.0 1154 1031 A 72 MET HGx A 72 MET HGy 1.0 1.8 2.7 1155 1032 A 72 MET HBy A 72 MET HGx 1.0 1.8 3.5 1156 1033 A 17 TYR HBy A 17 TYR HBx 1.0 1.8 2.7 1157 1034 A 72 MET HE% A 72 MET HGx 1.0 1.8 3.5 1158 1035 A 17 TYR H A 17 TYR HBx 1.0 1.8 2.7 1159 1036 A 72 MET HE% A 72 MET HBx 1.0 1.8 5.0 1160 1037 A 30 MET H A 30 MET HB2 1.0 1.8 2.7 1161 1037 A 30 MET H A 30 MET HB3 1.0 1.8 2.7 1162 1038 A 37 ILE HD1% A 36 GLU H 1.0 1.8 6.0 1163 1039 A 36 GLU HA A 36 GLU HBy 1.0 1.8 3.5 1164 1040 A 36 GLU H A 36 GLU HBx 1.0 1.8 5.0 1165 1041 A 57 VAL H A 58 PHE H 1.0 1.8 5.0 1166 1042 A 56 GLN HBx A 56 GLN HA 1.0 1.8 3.5 1167 1043 A 18 VAL HGx% A 17 TYR HBy 1.0 1.8 6.0 1168 1044 A 15 ALA HA A 18 VAL HGx% 1.0 1.8 5.0 1169 1045 A 56 GLN HGx A 56 GLN HBx 1.0 1.8 3.5 1170 1046 A 77 GLY H A 77 GLY HAx 1.0 1.8 3.5 1171 1047 A 47 GLN HA A 46 ARG HB2 1.0 1.8 5.0 1172 1047 A 46 ARG HB3 A 47 GLN HA 1.0 1.8 5.0 1173 1048 A 47 GLN HE2y A 47 GLN HG2 1.0 1.8 3.5 1174 1048 A 47 GLN HE2y A 47 GLN HG3 1.0 1.8 3.5 1175 1049 A 47 GLN HA A 47 GLN HG2 1.0 1.8 3.5 1176 1049 A 47 GLN HA A 47 GLN HG3 1.0 1.8 3.5 1177 1050 A 60 GLU H A 60 GLU HA 1.0 1.8 2.7 1178 1051 A 15 ALA H A 14 TYR HB2 1.0 1.8 2.7 1179 1051 A 15 ALA H A 14 TYR HB3 1.0 1.8 2.7 1180 1052 A 46 ARG H A 45 PHE HA 1.0 1.8 2.7 1181 1053 A 27 ARG HA A 27 ARG HGy 1.0 1.8 5.0 1182 1054 A 27 ARG HGx A 27 ARG HGy 1.0 1.8 2.7 1183 1055 A 18 VAL HB A 19 ARG H 1.0 1.8 5.0 1184 1056 A 53 PRO HDy A 53 PRO HDx 1.0 1.8 2.7 1185 1057 A 82 ILE H A 83 GLU HA 1.0 1.8 6.0 1186 1058 A 82 ILE HA A 83 GLU HA 1.0 1.8 5.0 1187 1059 A 16 LEU H A 16 LEU HG 1.0 1.8 5.0 1188 1060 A 17 TYR H A 16 LEU HB2 1.0 1.8 3.5 1189 1060 A 17 TYR H A 16 LEU HB3 1.0 1.8 3.5 1190 1061 A 17 TYR HA A 16 LEU HG 1.0 1.8 5.0 1191 1062 A 16 LEU HG A 16 LEU HDx% 1.0 1.8 2.7 1192 1063 A 16 LEU HDy% A 16 LEU HB2 1.0 1.8 2.7 1193 1063 A 16 LEU HDy% A 16 LEU HB3 1.0 1.8 2.7 1194 1064 A 16 LEU HG A 16 LEU HDy% 1.0 1.8 2.7 1195 1065 A 5 ARG HA A 5 ARG HGx 1.0 1.8 5.0 1196 1066 A 75 ILE HA A 75 ILE HG1x 1.0 1.8 5.0 1197 1067 A 75 ILE HG1x A 75 ILE HB 1.0 1.8 3.5 1198 1068 A 75 ILE HG1y A 75 ILE HG1x 1.0 1.8 2.7 1199 1069 A 75 ILE HG2% A 75 ILE HG1x 1.0 1.8 3.5 1200 1070 A 57 VAL HGy% A 56 GLN HA 1.0 1.8 5.0 1201 1071 A 87 GLU H A 87 GLU HA 1.0 1.8 3.5 1202 1072 A 63 GLY H A 62 THR HA 1.0 1.8 3.5 1203 1073 A 45 PHE H A 45 PHE HBy 1.0 1.8 3.5 1204 1074 A 64 ARG H A 62 THR HA 1.0 1.8 5.0 1205 1075 A 71 HIS HA A 71 HIS H 1.0 1.8 3.5 1206 1076 A 29 ARG H A 29 ARG HBy 1.0 1.8 3.5 1207 1077 A 29 ARG HBy A 29 ARG HG2 1.0 1.8 2.7 1208 1077 A 29 ARG HG3 A 29 ARG HBy 1.0 1.8 2.7 1209 1078 A 29 ARG HBx A 29 ARG HG2 1.0 1.8 2.7 1210 1078 A 29 ARG HG3 A 29 ARG HBx 1.0 1.8 2.7 1211 1079 A 29 ARG HA A 29 ARG HG2 1.0 1.8 3.5 1212 1079 A 29 ARG HA A 29 ARG HG3 1.0 1.8 3.5 1213 1080 A 57 VAL H A 57 VAL HB 1.0 1.8 2.7 1214 1081 A 18 VAL HGy% A 18 VAL H 1.0 1.8 5.0 1215 1082 A 18 VAL HB A 18 VAL HGy% 1.0 1.8 2.7 1216 1083 A 18 VAL HGx% A 18 VAL HGy% 1.0 1.8 2.7 1217 1084 A 35 GLU H A 35 GLU HB2 1.0 1.8 3.5 1218 1084 A 35 GLU HB3 A 35 GLU H 1.0 1.8 3.5 1219 1085 A 52 VAL HGy% A 52 VAL HGx% 1.0 1.8 2.7 1220 1086 A 56 GLN HBy A 56 GLN HE2y 1.0 1.8 5.0 1221 1087 A 66 TYR H A 67 TRP H 1.0 1.8 5.0 1222 1088 A 56 GLN HBy A 56 GLN HE2x 1.0 1.8 5.0 1223 1089 A 82 ILE HD1% A 83 GLU HA 1.0 1.8 6.0 1224 1090 A 66 TYR H A 66 TYR HBy 1.0 1.8 3.5 1225 1091 A 66 TYR HA A 66 TYR HD% 1.0 1.8 2.7 1226 1092 A 66 TYR HBy A 66 TYR HD% 1.0 1.8 2.7 1227 1093 A 66 TYR HBx A 66 TYR HD% 1.0 1.8 2.7 1228 1094 A 14 TYR H A 16 LEU H 1.0 1.8 5.0 1229 1095 A 76 LEU H A 75 ILE HG1y 1.0 1.8 6.0 1230 1096 A 28 VAL H A 27 ARG HDx 1.0 1.8 5.0 1231 1097 A 76 LEU H A 75 ILE HB 1.0 1.8 5.0 1232 1098 A 71 HIS HD2 A 72 MET H 1.0 1.8 5.0 1233 1099 A 75 ILE HG1y A 75 ILE H 1.0 1.8 5.0 1234 1100 A 75 ILE HG2% A 75 ILE H 1.0 1.8 5.0 1235 1101 A 75 ILE HA A 75 ILE H 1.0 1.8 3.5 1236 1102 A 75 ILE HB A 75 ILE H 1.0 1.8 5.0 1237 1103 A 70 TRP H A 69 HIS HBy 1.0 1.8 5.0 1238 1104 A 36 GLU H A 34 TYR HD% 1.0 1.8 6.0 1239 1105 A 57 VAL H A 57 VAL HA 1.0 1.8 3.5 1240 1106 A 72 MET H A 73 LEU H 1.0 1.8 2.7 1241 1107 A 55 VAL HGy% A 57 VAL HB 1.0 1.8 6.0 1242 1108 A 46 ARG HA A 46 ARG HG2 1.0 1.8 3.5 1243 1108 A 46 ARG HG3 A 46 ARG HA 1.0 1.8 3.5 1244 1109 A 46 ARG HB3 A 46 ARG HG2 1.0 1.8 2.7 1245 1109 A 46 ARG HB2 A 46 ARG HG2 1.0 1.8 2.7 1246 1109 A 46 ARG HG3 A 46 ARG HB2 1.0 1.8 2.7 1247 1109 A 46 ARG HG3 A 46 ARG HB3 1.0 1.8 2.7 1248 1110 A 76 LEU H A 77 GLY HAx 1.0 1.8 5.0 1249 1111 A 75 ILE HD1% A 75 ILE HG2% 1.0 1.8 2.7 1250 1112 A 75 ILE HD1% A 75 ILE HB 1.0 1.8 3.5 1251 1113 A 75 ILE HD1% A 75 ILE HG1y 1.0 1.8 2.7 1252 1114 A 75 ILE HD1% A 75 ILE HA 1.0 1.8 5.0 1253 1115 A 25 GLY H A 24 PRO HA 1.0 1.8 3.5 1254 1116 A 24 PRO HDy A 24 PRO HBy 1.0 1.8 5.0 1255 1117 A 62 THR HG2% A 62 THR HA 1.0 1.8 3.5 1256 1118 A 56 GLN H A 57 VAL H 1.0 1.8 5.0 1257 1119 A 57 VAL H A 56 GLN HE2x 1.0 1.8 6.0 1258 1120 A 71 HIS H A 71 HIS HD2 1.0 1.8 5.0 1259 1121 A 71 HIS HBy A 71 HIS HD2 1.0 1.8 5.0 1260 1122 A 71 HIS H A 70 TRP HA 1.0 1.8 3.5 1261 1123 A 43 GLY H A 42 GLU HBy 1.0 1.8 5.0 1262 1124 A 43 GLY H A 42 GLU HGy 1.0 1.8 5.0 1263 1125 A 62 THR H A 62 THR HB 1.0 1.8 3.5 1264 1126 A 64 ARG H A 65 THR H 1.0 1.8 5.0 1265 1127 A 65 THR H A 64 ARG HG2 1.0 1.8 5.0 1266 1127 A 65 THR H A 64 ARG HG3 1.0 1.8 5.0 1267 1128 A 61 SER H A 59 TRP HB2 1.0 1.8 3.5 1268 1128 A 59 TRP HB3 A 61 SER H 1.0 1.8 3.5 1269 1129 A 47 GLN HE2x A 47 GLN HG2 1.0 1.8 2.7 1270 1129 A 47 GLN HE2x A 47 GLN HG3 1.0 1.8 2.7 1271 1130 A 47 GLN HE2x A 47 GLN HB2 1.0 1.8 5.0 1272 1130 A 47 GLN HB3 A 47 GLN HE2x 1.0 1.8 5.0 1273 1131 A 47 GLN H A 47 GLN HE2x 1.0 1.8 6.0 1274 1132 A 49 ASN HD2x A 49 ASN HBx 1.0 1.8 3.5 1275 1133 A 49 ASN HD2x A 49 ASN HBy 1.0 1.8 3.5 1276 1134 A 49 ASN HD2x A 49 ASN HA 1.0 1.8 5.0 1277 1135 A 49 ASN HD2x A 49 ASN HD2y 1.0 1.8 2.7 1278 1136 A 23 GLN HGy A 23 GLN HE2x 1.0 1.8 3.5 1279 1137 A 56 GLN HE2y A 56 GLN HE2x 1.0 1.8 2.7 1280 1138 A 68 VAL H A 67 TRP HD1 1.0 1.8 6.0 1281 1139 A 68 VAL H A 69 HIS H 1.0 1.8 5.0 1282 1140 A 37 ILE HG2% A 40 GLY H 1.0 1.8 6.0 1283 1141 A 13 THR HB A 13 THR H 1.0 1.8 3.5 1284 1142 A 13 THR HG2% A 13 THR H 1.0 1.8 5.0 1285 1143 A 13 THR H A 12 ASN HB2 1.0 1.8 5.0 1286 1143 A 13 THR H A 12 ASN HB3 1.0 1.8 5.0 1287 1144 A 28 VAL H A 28 VAL HB 1.0 1.8 5.0 1288 1145 A 48 SER H A 47 GLN HB2 1.0 1.8 3.5 1289 1145 A 47 GLN HB3 A 48 SER H 1.0 1.8 3.5 1290 1146 A 48 SER H A 47 GLN HG2 1.0 1.8 5.0 1291 1146 A 48 SER H A 47 GLN HG3 1.0 1.8 5.0 1292 1147 A 16 LEU H A 16 LEU HDy% 1.0 1.8 5.0 1293 1148 A 16 LEU H A 12 ASN HA 1.0 1.8 6.0 1294 1149 A 32 ASP H A 31 LEU HA 1.0 1.8 3.5 1295 1150 A 69 HIS H A 68 VAL HA 1.0 1.8 3.5 1296 1151 A 55 VAL H A 55 VAL HA 1.0 1.8 3.5 1297 1152 A 55 VAL H A 54 PRO HA 1.0 1.8 2.7 1298 1153 A 64 ARG H A 64 ARG HDx 1.0 1.8 6.0 1299 1154 A 33 ASP H A 32 ASP H 1.0 1.8 5.0 1300 1155 A 22 LEU HDx% A 26 MET H 1.0 1.8 6.0 1301 1156 A 15 ALA H A 12 ASN HA 1.0 1.8 3.5 1302 1157 A 15 ALA H A 15 ALA HA 1.0 1.8 2.7 1303 1158 A 28 VAL HGx% A 29 ARG H 1.0 1.8 5.0 1304 1159 A 8 PHE H A 7 GLU H 1.0 1.8 3.5 1305 1160 A 17 TYR H A 16 LEU HA 1.0 1.8 3.5 1306 1161 A 4 MET HGx A 4 MET H 1.0 1.8 5.0 1307 1162 A 4 MET HBy A 4 MET H 1.0 1.8 5.0 1308 1163 A 4 MET HBx A 4 MET H 1.0 1.8 5.0 1309 1164 A 27 ARG H A 26 MET H 1.0 1.8 5.0 1310 1165 A 27 ARG H A 26 MET HGy 1.0 1.8 6.0 1311 1166 A 27 ARG H A 27 ARG HDy 1.0 1.8 6.0 1312 1167 A 27 ARG H A 26 MET HB2 1.0 1.8 5.0 1313 1167 A 27 ARG H A 26 MET HB3 1.0 1.8 5.0 1314 1168 A 27 ARG H A 27 ARG HGx 1.0 1.8 5.0 1315 1169 A 78 PHE HA A 80 GLU H 1.0 1.8 5.0 1316 1170 A 37 ILE H A 36 GLU HBx 1.0 1.8 5.0 1317 1171 A 86 VAL H A 86 VAL HGx% 1.0 1.8 2.7 1318 1171 A 86 VAL HGy% A 86 VAL H 1.0 1.8 2.7 1319 1172 A 22 LEU H A 20 ASP H 1.0 1.8 5.0 1320 1173 A 22 LEU H A 21 THR HG2% 1.0 1.8 5.0 1321 1174 A 5 ARG H A 4 MET HGx 1.0 1.8 5.0 1322 1175 A 79 GLU H A 78 PHE HBy 1.0 1.8 5.0 1323 1176 A 79 GLU H A 78 PHE HBx 1.0 1.8 5.0 1324 1177 A 35 GLU H A 34 TYR HBx 1.0 1.8 5.0 1325 1178 A 60 GLU H A 60 GLU HG2 1.0 1.8 5.0 1326 1178 A 60 GLU H A 60 GLU HG3 1.0 1.8 5.0 1327 1179 A 34 TYR HBy A 35 GLU H 1.0 1.8 5.0 1328 1180 A 41 ASP H A 40 GLY HAy 1.0 1.8 3.5 1329 1181 A 41 ASP H A 38 SER H 1.0 1.8 5.0 1330 1182 A 40 GLY H A 41 ASP H 1.0 1.8 2.7 1331 1183 A 23 GLN H A 23 GLN HE2x 1.0 1.8 5.0 1332 1184 A 23 GLN H A 26 MET HB2 1.0 1.8 3.5 1333 1184 A 26 MET HB3 A 23 GLN H 1.0 1.8 3.5 1334 1185 A 13 THR HB A 14 TYR H 1.0 1.8 5.0 1335 1186 A 14 TYR H A 13 THR HA 1.0 1.8 3.5 1336 1187 A 14 TYR H A 13 THR H 1.0 1.8 3.5 1337 1188 A 34 TYR H A 38 SER HBx 1.0 1.8 6.0 1338 1189 A 13 THR HG2% A 14 TYR H 1.0 1.8 5.0 1339 1190 A 39 ALA H A 38 SER H 1.0 1.8 5.0 1340 1191 A 34 TYR H A 37 ILE HB 1.0 1.8 6.0 1341 1192 A 83 GLU H A 84 ASP H 1.0 1.8 5.0 1342 1193 A 57 VAL HGy% A 59 TRP HE1 1.0 1.8 5.0 1343 1194 A 57 VAL HGy% A 58 PHE H 1.0 1.8 5.0 1344 1195 A 58 PHE H A 57 VAL HB 1.0 1.8 5.0 1345 1196 A 30 MET H A 29 ARG HD2 1.0 1.8 5.0 1346 1196 A 30 MET H A 29 ARG HD3 1.0 1.8 5.0 1347 1197 A 28 VAL HGy% A 30 MET H 1.0 1.8 5.0 1348 1198 A 30 MET HGy A 30 MET H 1.0 1.8 5.0 1349 1199 A 45 PHE H A 46 ARG H 1.0 1.8 5.0 1350 1200 A 45 PHE H A 44 GLU HGy 1.0 1.8 3.5 1351 1201 A 74 GLU HGy A 75 ILE H 1.0 1.8 5.0 1352 1202 A 75 ILE H A 74 GLU HBx 1.0 1.8 5.0 1353 1203 A 74 GLU HGx A 75 ILE H 1.0 1.8 5.0 1354 1204 A 31 LEU H A 30 MET H 1.0 1.8 5.0 1355 1205 A 31 LEU H A 31 LEU HA 1.0 1.8 3.5 1356 1206 A 31 LEU H A 31 LEU HB2 1.0 1.8 3.5 1357 1206 A 31 LEU H A 31 LEU HB3 1.0 1.8 3.5 1358 1207 A 67 TRP H A 67 TRP HBy 1.0 1.8 3.5 1359 1208 A 56 GLN H A 56 GLN HGy 1.0 1.8 5.0 1360 1209 A 43 GLY H A 42 GLU HGx 1.0 1.8 5.0 1361 1210 A 43 GLY H A 42 GLU HBx 1.0 1.8 5.0 1362 1211 A 59 TRP H A 63 GLY H 1.0 1.8 5.0 1363 1212 A 60 GLU H A 63 GLY H 1.0 1.8 5.0 1364 1213 A 68 VAL H A 68 VAL HB 1.0 1.8 3.5 1365 1214 A 71 HIS HBx A 72 MET H 1.0 1.8 5.0 1366 1215 A 72 MET H A 70 TRP HB2 1.0 1.8 5.0 1367 1215 A 70 TRP HB3 A 72 MET H 1.0 1.8 5.0 1368 1216 A 17 TYR HA A 19 ARG H 1.0 1.8 5.0 1369 1217 A 49 ASN H A 49 ASN HD2x 1.0 1.8 5.0 1370 1218 A 15 ALA H A 17 TYR H 1.0 1.8 5.0 1371 1219 A 29 ARG H A 28 VAL H 1.0 1.8 5.0 1372 1220 A 14 TYR HA A 17 TYR H 1.0 1.8 5.0 1373 1221 A 5 ARG H A 4 MET H 1.0 1.8 5.0 1374 1222 A 22 LEU H A 19 ARG H 1.0 1.8 5.0 1375 1223 A 15 ALA H A 18 VAL H 1.0 1.8 5.0 1376 1224 A 60 GLU H A 62 THR H 1.0 1.8 5.0 1377 1225 A 37 ILE H A 35 GLU H 1.0 1.8 6.0 1378 1226 A 23 GLN H A 26 MET HGy 1.0 1.8 5.0 1379 1227 A 71 HIS HBx A 71 HIS HBy 1.0 1.8 2.7 1380 1228 A 83 GLU HBy A 82 ILE HG1y 1.0 1.8 6.0 1381 1229 A 82 ILE H A 81 ASP HA 1.0 1.8 3.5 1382 1230 A 47 GLN HE2y A 47 GLN HA 1.0 1.8 6.0 1383 1231 A 27 ARG HA A 27 ARG H 1.0 1.8 3.5 1384 1232 A 56 GLN HE2y A 56 GLN HA 1.0 1.8 6.0 1385 1233 A 53 PRO HBy A 53 PRO HGx 1.0 1.8 2.7 1386 1234 A 53 PRO HBx A 53 PRO HBy 1.0 1.8 2.7 1387 1235 A 46 ARG HDx A 46 ARG HB2 1.0 1.8 3.5 1388 1235 A 46 ARG HB3 A 46 ARG HDx 1.0 1.8 3.5 1389 1236 A 46 ARG HDy A 46 ARG HB2 1.0 1.8 3.5 1390 1236 A 46 ARG HDy A 46 ARG HB3 1.0 1.8 3.5 1391 1237 A 74 GLU HBy A 74 GLU HGy 1.0 1.8 3.5 1392 1238 A 74 GLU HBy A 74 GLU HGx 1.0 1.8 3.5 1393 1239 A 74 GLU HA A 74 GLU HBx 1.0 1.8 3.5 1394 1240 A 67 TRP HA A 67 TRP HD1 1.0 1.8 5.0 1395 1241 A 67 TRP HA A 68 VAL HGx% 1.0 1.8 6.0 1396 1242 A 90 GLU HA A 90 GLU HB2 1.0 1.8 2.7 1397 1242 A 90 GLU HA A 90 GLU HB3 1.0 1.8 2.7 1398 1243 A 42 GLU HA A 42 GLU HBy 1.0 1.8 3.5 1399 1244 A 42 GLU HBx A 42 GLU HBy 1.0 1.8 2.7 1400 1245 A 42 GLU HGx A 42 GLU HBy 1.0 1.8 3.5 1401 1246 A 30 MET HE% A 30 MET HGx 1.0 1.8 2.7 1402 1247 A 58 PHE HA A 58 PHE HBx 1.0 1.8 2.7 1403 1248 A 58 PHE HA A 58 PHE HBy 1.0 1.8 3.5 1404 1249 A 36 GLU H A 35 GLU HA 1.0 1.8 3.5 1405 1250 A 26 MET HA A 26 MET HGy 1.0 1.8 5.0 1406 1251 A 52 VAL H A 52 VAL HA 1.0 1.8 3.5 1407 1252 A 29 ARG HBx A 29 ARG HD2 1.0 1.8 3.5 1408 1252 A 29 ARG HBx A 29 ARG HD3 1.0 1.8 3.5 1409 1253 A 28 VAL HGy% A 29 ARG HBy 1.0 1.8 6.0 1410 1254 A 52 VAL HA A 52 VAL HB 1.0 1.8 3.5 1411 1255 A 35 GLU HA A 35 GLU HGx 1.0 1.8 5.0 1412 1256 A 37 ILE HD1% A 36 GLU HGy 1.0 1.8 6.0 1413 1257 A 68 VAL HB A 68 VAL HA 1.0 1.8 3.5 1414 1258 A 74 GLU HA A 74 GLU HGy 1.0 1.8 3.5 1415 1259 A 74 GLU HA A 74 GLU HGx 1.0 1.8 3.5 1416 1260 A 5 ARG HA A 5 ARG HGy 1.0 1.8 5.0 1417 1261 A 5 ARG HA A 5 ARG HBx 1.0 1.8 3.5 1418 1262 A 5 ARG HA A 5 ARG HBy 1.0 1.8 3.5 1419 1263 A 5 ARG HDx A 5 ARG HA 1.0 1.8 5.0 1420 1264 A 57 VAL HA A 57 VAL HB 1.0 1.8 3.5 1421 1265 A 66 TYR HE% A 66 TYR HA 1.0 1.8 5.0 1422 1266 A 44 GLU HA A 44 GLU HGy 1.0 1.8 3.5 1423 1267 A 42 GLU HGy A 42 GLU HBx 1.0 1.8 3.5 1424 1268 A 42 GLU HA A 42 GLU HGy 1.0 1.8 5.0 1425 1269 A 42 GLU HGx A 42 GLU HGy 1.0 1.8 2.7 1426 1270 A 42 GLU HGy A 42 GLU HBy 1.0 1.8 3.5 1427 1271 A 17 TYR HA A 17 TYR HBx 1.0 1.8 3.5 1428 1272 A 31 LEU HA A 31 LEU HB2 1.0 1.8 2.7 1429 1272 A 31 LEU HA A 31 LEU HB3 1.0 1.8 2.7 1430 1273 A 14 TYR HA A 14 TYR HB2 1.0 1.8 2.7 1431 1273 A 14 TYR HA A 14 TYR HB3 1.0 1.8 2.7 1432 1274 A 86 VAL HA A 86 VAL HGx% 1.0 1.8 2.7 1433 1274 A 86 VAL HGy% A 86 VAL HA 1.0 1.8 2.7 1434 1275 A 87 GLU H A 86 VAL HA 1.0 1.8 3.5 1435 1276 A 55 VAL HA A 55 VAL HB 1.0 1.8 2.7 1436 1277 A 49 ASN HBx A 49 ASN HBy 1.0 1.8 2.7 1437 1278 A 78 PHE HBy A 78 PHE HBx 1.0 1.8 2.7 1438 1279 A 30 MET HE% A 34 TYR HBx 1.0 1.8 3.5 1439 1280 A 34 TYR HA A 34 TYR HBx 1.0 1.8 2.7 1440 1281 A 24 PRO HA A 24 PRO HGx 1.0 1.8 5.0 1441 1282 A 24 PRO HA A 24 PRO HBy 1.0 1.8 2.7 1442 1283 A 40 GLY H A 39 ALA HB% 1.0 1.8 3.5 1443 1284 A 26 MET HE% A 22 LEU HDx% 1.0 1.8 6.0 1444 1285 A 54 PRO HA A 54 PRO HDx 1.0 1.8 5.0 1445 1286 A 54 PRO HBx A 54 PRO HA 1.0 1.8 2.7 1446 1287 A 68 VAL HGx% A 68 VAL HB 1.0 1.8 2.7 1447 1288 A 46 ARG HDy A 46 ARG HA 1.0 1.8 5.0 1448 1289 A 46 ARG HDx A 46 ARG HA 1.0 1.8 5.0 1449 1290 A 15 ALA HB% A 12 ASN HA 1.0 1.8 3.5 1450 1291 A 15 ALA HB% A 15 ALA H 1.0 1.8 2.7 1451 1292 A 18 VAL HA A 18 VAL HB 1.0 1.8 2.7 1452 1293 A 19 ARG HDy A 19 ARG HDx 1.0 1.8 2.7 1453 1294 A 16 LEU HA A 19 ARG HDy 1.0 1.8 6.0 1454 1295 A 29 ARG HA A 29 ARG HD2 1.0 1.8 5.0 1455 1295 A 29 ARG HA A 29 ARG HD3 1.0 1.8 5.0 1456 1296 A 29 ARG HBy A 29 ARG HD2 1.0 1.8 3.5 1457 1296 A 29 ARG HD3 A 29 ARG HBy 1.0 1.8 3.5 1458 1297 A 64 ARG HDy A 64 ARG HG2 1.0 1.8 2.7 1459 1297 A 64 ARG HG3 A 64 ARG HDy 1.0 1.8 2.7 1460 1298 A 64 ARG HBy A 64 ARG HDy 1.0 1.8 5.0 1461 1299 A 64 ARG HBx A 64 ARG HDy 1.0 1.8 5.0 1462 1300 A 64 ARG HA A 64 ARG HDy 1.0 1.8 6.0 1463 1301 A 64 ARG HDx A 64 ARG HDy 1.0 1.8 2.7 1464 1302 A 5 ARG HDx A 5 ARG HDy 1.0 1.8 2.7 1465 1303 A 5 ARG HDy A 5 ARG HBy 1.0 1.8 5.0 1466 1304 A 5 ARG HGx A 5 ARG HDy 1.0 1.8 3.5 1467 1305 A 5 ARG HDy A 5 ARG HBx 1.0 1.8 5.0 1468 1306 A 31 LEU HDx% A 31 LEU HA 1.0 1.8 5.0 1469 1307 A 13 THR HB A 13 THR HA 1.0 1.8 3.5 1470 1308 A 52 VAL HGy% A 52 VAL HA 1.0 1.8 3.5 1471 1309 A 52 VAL HGy% A 52 VAL HB 1.0 1.8 2.7 1472 1310 A 68 VAL HGy% A 68 VAL HB 1.0 1.8 2.7 1473 1311 A 57 VAL HGy% A 57 VAL HA 1.0 1.8 2.7 1474 1312 A 55 VAL HGy% A 55 VAL HB 1.0 1.8 2.7 1475 1313 A 31 LEU HDx% A 31 LEU HB2 1.0 1.8 2.7 1476 1313 A 31 LEU HDx% A 31 LEU HB3 1.0 1.8 2.7 1477 1314 A 16 LEU HG A 16 LEU HA 1.0 1.8 5.0 1478 1315 A 13 THR HG2% A 13 THR HA 1.0 1.8 3.5 1479 1316 A 31 LEU HG A 31 LEU HB2 1.0 1.8 2.7 1480 1316 A 31 LEU HB3 A 31 LEU HG 1.0 1.8 2.7 1481 1317 A 31 LEU HDx% A 31 LEU HG 1.0 1.8 2.7 1482 1318 A 16 LEU HDx% A 16 LEU HDy% 1.0 1.8 2.7 1483 1319 A 5 ARG HDy A 5 ARG HGy 1.0 1.8 3.5 1484 1320 A 53 PRO HDy A 53 PRO HGx 1.0 1.8 3.5 1485 1321 A 29 ARG HD2 A 29 ARG HG2 1.0 1.8 2.7 1486 1321 A 29 ARG HD3 A 29 ARG HG2 1.0 1.8 2.7 1487 1321 A 29 ARG HG3 A 29 ARG HD2 1.0 1.8 2.7 1488 1321 A 29 ARG HG3 A 29 ARG HD3 1.0 1.8 2.7 1489 1322 A 98 ARG HGy A 98 ARG HA 1.0 1.8 5.0 1490 1323 A 24 PRO HDx A 24 PRO HBx 1.0 1.8 5.0 1491 1324 A 24 PRO HDx A 24 PRO HGx 1.0 1.8 2.7 1492 1325 A 54 PRO HDy A 54 PRO HDx 1.0 1.8 2.7 1493 1326 A 54 PRO HDy A 52 VAL HGy% 1.0 1.8 5.0 1494 1327 A 54 PRO HDy A 52 VAL HA 1.0 1.8 5.0 1495 1328 A 53 PRO HA A 54 PRO HDy 1.0 1.8 5.0 1496 1329 A 53 PRO HA A 54 PRO HDx 1.0 1.8 5.0 1497 1330 A 54 PRO HDy A 54 PRO HG2 1.0 1.8 2.7 1498 1330 A 54 PRO HDy A 54 PRO HG3 1.0 1.8 2.7 1499 1331 A 54 PRO HBx A 54 PRO HG2 1.0 1.8 2.7 1500 1331 A 54 PRO HBx A 54 PRO HG3 1.0 1.8 2.7 1501 1332 A 24 PRO HGy A 23 GLN HA 1.0 1.8 5.0 1502 1333 A 28 VAL HGy% A 27 ARG HGx 1.0 1.8 6.0 1503 1334 A 49 ASN HBy A 49 ASN HA 1.0 1.8 3.5 1504 1335 A 49 ASN HBx A 49 ASN HA 1.0 1.8 2.7 1505 1336 A 65 THR H A 64 ARG HBy 1.0 1.8 5.0 1506 1337 A 66 TYR HE% A 66 TYR HBx 1.0 1.8 5.0 1507 1338 A 81 ASP H A 81 ASP HA 1.0 1.8 3.5 1508 1339 A 74 GLU H A 74 GLU HA 1.0 1.8 3.5 1509 1340 A 4 MET HA A 4 MET H 1.0 1.8 3.5 1510 1341 A 8 PHE HD% A 8 PHE HA 1.0 1.8 3.5 1511 1342 A 58 PHE HA A 58 PHE H 1.0 1.8 3.5 1512 1343 A 18 VAL HA A 18 VAL H 1.0 1.8 3.5 1513 1344 A 67 TRP H A 67 TRP HBx 1.0 1.8 5.0 1514 1345 A 48 SER HA A 49 ASN H 1.0 1.8 2.7 1515 1346 A 59 TRP HA A 59 TRP HB2 1.0 1.8 2.7 1516 1346 A 59 TRP HA A 59 TRP HB3 1.0 1.8 2.7 1517 1347 A 62 THR H A 59 TRP HB2 1.0 1.8 3.5 1518 1347 A 59 TRP HB3 A 62 THR H 1.0 1.8 3.5 1519 1348 A 52 VAL HA A 54 PRO HDx 1.0 1.8 6.0 1520 1349 A 71 HIS H A 71 HIS HBx 1.0 1.8 5.0 1521 1350 A 70 TRP HA A 70 TRP HB2 1.0 1.8 2.7 1522 1350 A 70 TRP HA A 70 TRP HB3 1.0 1.8 2.7 1523 1351 A 26 MET HGy A 26 MET HB2 1.0 1.8 2.7 1524 1351 A 26 MET HB3 A 26 MET HGy 1.0 1.8 2.7 1525 1352 A 28 VAL HA A 28 VAL HB 1.0 1.8 2.7 1526 1353 A 13 THR HA A 12 ASN HB2 1.0 1.8 5.0 1527 1353 A 13 THR HA A 12 ASN HB3 1.0 1.8 5.0 1528 1354 A 34 TYR H A 34 TYR HBx 1.0 1.8 3.5 1529 1355 A 34 TYR H A 34 TYR HBy 1.0 1.8 3.5 1530 1356 A 34 TYR HA A 34 TYR HBy 1.0 1.8 3.5 1531 1357 A 34 TYR HBy A 34 TYR HBx 1.0 1.8 2.7 1532 1358 A 30 MET HE% A 34 TYR HBy 1.0 1.8 3.5 1533 1359 A 66 TYR HE% A 66 TYR HBy 1.0 1.8 5.0 1534 1360 A 26 MET HE% A 26 MET HGy 1.0 1.8 3.5 1535 1361 A 26 MET HE% A 23 GLN HE2y 1.0 1.8 6.0 1536 1362 A 28 VAL HGx% A 28 VAL HB 1.0 1.8 2.7 1537 1363 A 72 MET HE% A 69 HIS HBx 1.0 1.8 6.0 1538 1364 A 55 VAL HGx% A 55 VAL H 1.0 1.8 2.7 1539 1365 A 55 VAL HGx% A 55 VAL HA 1.0 1.8 3.5 1540 1366 A 55 VAL HGx% A 55 VAL HGy% 1.0 1.8 2.7 1541 1367 A 55 VAL HGx% A 55 VAL HB 1.0 1.8 2.7 1542 1368 A 30 MET HE% A 30 MET HA 1.0 1.8 5.0 1543 1369 A 30 MET HE% A 34 TYR HA 1.0 1.8 5.0 1544 1370 A 30 MET HE% A 30 MET HGy 1.0 1.8 2.7 1545 1371 A 30 MET HE% A 30 MET HB2 1.0 1.8 5.0 1546 1371 A 30 MET HE% A 30 MET HB3 1.0 1.8 5.0 1547 1372 A 18 VAL HGx% A 18 VAL HA 1.0 1.8 3.5 1548 1373 A 18 VAL HGy% A 19 ARG H 1.0 1.8 3.5 1549 1374 A 37 ILE H A 36 GLU HA 1.0 1.8 3.5 1550 1375 A 55 VAL H A 55 VAL HB 1.0 1.8 3.5 1551 1376 A 74 GLU H A 74 GLU HBy 1.0 1.8 3.5 1552 1377 A 26 MET H A 26 MET HGy 1.0 1.8 5.0 1553 1378 A 30 MET H A 30 MET HGx 1.0 1.8 5.0 1554 1379 A 65 THR H A 64 ARG HBx 1.0 1.8 5.0 1555 1380 A 52 VAL H A 52 VAL HB 1.0 1.8 5.0 1556 1381 A 69 HIS H A 68 VAL HB 1.0 1.8 3.5 1557 1382 A 22 LEU H A 21 THR HA 1.0 1.8 3.5 1558 1383 A 14 TYR H A 14 TYR HB2 1.0 1.8 2.7 1559 1383 A 14 TYR H A 14 TYR HB3 1.0 1.8 2.7 1560 1384 A 22 LEU H A 21 THR HB 1.0 1.8 5.0 1561 1385 A 21 THR H A 21 THR HB 1.0 1.8 5.0 1562 1386 A 32 ASP H A 32 ASP HBy 1.0 1.8 5.0 1563 1387 A 32 ASP H A 32 ASP HBx 1.0 1.8 5.0 1564 1388 A 63 GLY HAx A 63 GLY H 1.0 1.8 2.7 1565 1389 A 64 ARG H A 63 GLY HAx 1.0 1.8 3.5 1566 1390 A 26 MET HE% A 27 ARG H 1.0 1.8 6.0 1567 1391 A 57 VAL HGx% A 59 TRP HD1 1.0 1.8 5.0 1568 1392 A 53 PRO HGy A 53 PRO HGx 1.0 1.8 2.7 1569 1393 A 24 PRO HBx A 24 PRO HGx 1.0 1.8 2.7 1570 1394 A 24 PRO HGy A 24 PRO HBy 1.0 1.8 2.7 1571 1395 A 74 GLU HBy A 74 GLU HBx 1.0 1.8 2.7 1572 1396 A 20 ASP H A 19 ARG HDx 1.0 1.8 6.0 1573 1397 A 31 LEU HA A 31 LEU HG 1.0 1.8 5.0 1574 1398 A 23 GLN HA A 24 PRO HGx 1.0 1.8 5.0 1575 1399 A 19 ARG HA A 19 ARG HDy 1.0 1.8 5.0 1576 1400 A 70 TRP HA A 72 MET H 1.0 1.8 5.0 1577 1401 A 53 PRO HA A 54 PRO HA 1.0 1.8 5.0 1578 1402 A 67 TRP H A 67 TRP HD1 1.0 1.8 6.0 1579 1403 A 67 TRP HBy A 67 TRP HD1 1.0 1.8 5.0 1580 1404 A 67 TRP HD1 A 67 TRP HBx 1.0 1.8 5.0 1581 1405 A 59 TRP H A 58 PHE HD% 1.0 1.8 5.0 1582 1406 A 34 TYR HD% A 34 TYR HBx 1.0 1.8 2.7 1583 1407 A 34 TYR HBy A 34 TYR HD% 1.0 1.8 2.7 1584 1408 A 17 TYR HD% A 17 TYR HBx 1.0 1.8 2.7 1585 1409 A 66 TYR HE% A 66 TYR HD% 1.0 1.8 2.7 1586 1410 A 25 GLY H A 24 PRO HBx 1.0 1.8 5.0 1587 1411 A 4 MET HBy A 6 SER H 1.0 1.8 5.0 1588 1412 A 70 TRP H A 69 HIS HBx 1.0 1.8 3.5 1589 1413 A 70 TRP H A 69 HIS HA 1.0 1.8 2.7 1590 1414 A 38 SER HA A 41 ASP H 1.0 1.8 6.0 1591 1415 A 38 SER HA A 38 SER H 1.0 1.8 3.5 1592 1416 A 39 ALA H A 37 ILE HG2% 1.0 1.8 5.0 1593 1417 A 98 ARG HGy A 98 ARG HBy 1.0 1.8 3.5 1594 1418 A 98 ARG HA A 98 ARG HBy 1.0 1.8 3.5 1595 1419 A 21 THR H A 23 GLN H 1.0 1.8 6.0 1596 1420 A 67 TRP HA A 66 TYR HBx 1.0 1.8 5.0 1597 1421 A 57 VAL HGx% A 59 TRP HZ2 1.0 1.8 5.0 1598 1422 A 28 VAL H A 27 ARG H 1.0 1.8 5.0 1599 1423 A 14 TYR H A 17 TYR HBx 1.0 1.8 6.0 1600 1424 A 27 ARG HDx A 27 ARG HB2 1.0 1.8 3.5 1601 1424 A 27 ARG HDx A 27 ARG HB3 1.0 1.8 3.5 1602 1425 A 98 ARG HA A 98 ARG HD2 1.0 1.8 5.0 1603 1425 A 98 ARG HA A 98 ARG HD3 1.0 1.8 5.0 1604 1426 A 44 GLU HB2 A 46 ARG HG2 1.0 1.8 5.0 1605 1426 A 44 GLU HB3 A 46 ARG HG2 1.0 1.8 5.0 1606 1426 A 46 ARG HG3 A 44 GLU HB2 1.0 1.8 5.0 1607 1426 A 44 GLU HB3 A 46 ARG HG3 1.0 1.8 5.0 1608 1427 A 98 ARG HGy A 98 ARG HD2 1.0 1.8 2.7 1609 1427 A 98 ARG HGy A 98 ARG HD3 1.0 1.8 2.7 1610 1428 A 69 HIS HBy A 72 MET HBx 1.0 1.8 6.0 1611 1429 A 36 GLU HBx A 36 GLU HBy 1.0 1.8 2.7 1612 1430 A 37 ILE HD1% A 36 GLU HBy 1.0 1.8 5.0 1613 1431 A 57 VAL HGx% A 57 VAL HB 1.0 1.8 2.7 1614 1432 A 57 VAL HGy% A 57 VAL HGx% 1.0 1.8 2.7 1615 1433 A 56 GLN H A 56 GLN HBx 1.0 1.8 2.7 1616 1434 A 56 GLN HBx A 56 GLN HE2x 1.0 1.8 5.0 1617 1435 A 35 GLU H A 35 GLU HGx 1.0 1.8 5.0 1618 1436 A 35 GLU HGx A 35 GLU HGy 1.0 1.8 2.7 1619 1437 A 35 GLU HGy A 35 GLU HB2 1.0 1.8 2.7 1620 1437 A 35 GLU HB3 A 35 GLU HGy 1.0 1.8 2.7 1621 1438 A 61 SER H A 62 THR H 1.0 1.8 2.7 1622 1439 A 61 SER H A 60 GLU HB2 1.0 1.8 5.0 1623 1439 A 61 SER H A 60 GLU HB3 1.0 1.8 5.0 1624 1440 A 61 SER H A 60 GLU HG2 1.0 1.8 5.0 1625 1440 A 60 GLU HG3 A 61 SER H 1.0 1.8 5.0 1626 1441 A 59 TRP HA A 61 SER H 1.0 1.8 5.0 1627 1442 A 47 GLN HE2y A 46 ARG HB2 1.0 1.8 6.0 1628 1442 A 47 GLN HE2y A 46 ARG HB3 1.0 1.8 6.0 1629 1443 A 60 GLU HA A 60 GLU HG2 1.0 1.8 3.5 1630 1443 A 60 GLU HG3 A 60 GLU HA 1.0 1.8 3.5 1631 1444 A 15 ALA HB% A 16 LEU H 1.0 1.8 3.5 1632 1445 A 60 GLU HA A 60 GLU HB2 1.0 1.8 2.7 1633 1445 A 60 GLU HB3 A 60 GLU HA 1.0 1.8 2.7 1634 1446 A 61 SER H A 61 SER HA 1.0 1.8 2.7 1635 1447 A 59 TRP HA A 60 GLU HA 1.0 1.8 5.0 1636 1448 A 21 THR H A 18 VAL HB 1.0 1.8 6.0 1637 1449 A 46 ARG H A 46 ARG HA 1.0 1.8 3.5 1638 1450 A 18 VAL HA A 20 ASP H 1.0 1.8 5.0 1639 1451 A 46 ARG HA A 47 GLN HB2 1.0 1.8 6.0 1640 1451 A 47 GLN HB3 A 46 ARG HA 1.0 1.8 6.0 1641 1452 A 18 VAL HGy% A 20 ASP H 1.0 1.8 5.0 1642 1453 A 46 ARG HDy A 46 ARG HG2 1.0 1.8 2.7 1643 1453 A 46 ARG HG3 A 46 ARG HDy 1.0 1.8 2.7 1644 1454 A 27 ARG HDx A 27 ARG HGy 1.0 1.8 3.5 1645 1455 A 27 ARG HDy A 27 ARG HGy 1.0 1.8 3.5 1646 1456 A 46 ARG H A 46 ARG HB2 1.0 1.8 2.7 1647 1456 A 46 ARG H A 46 ARG HB3 1.0 1.8 2.7 1648 1457 A 10 SER H A 9 ALA HB% 1.0 1.8 2.7 1649 1458 A 79 GLU H A 79 GLU HG2 1.0 1.8 5.0 1650 1458 A 79 GLU H A 79 GLU HG3 1.0 1.8 5.0 1651 1459 A 21 THR HB A 18 VAL HA 1.0 1.8 5.0 1652 1460 A 79 GLU H A 79 GLU HA 1.0 1.8 3.5 1653 1461 A 65 THR HA A 65 THR HB 1.0 1.8 3.5 1654 1462 A 65 THR HA A 66 TYR H 1.0 1.8 2.7 1655 1463 A 16 LEU H A 16 LEU HB2 1.0 1.8 2.7 1656 1463 A 16 LEU H A 16 LEU HB3 1.0 1.8 2.7 1657 1464 A 16 LEU HDx% A 16 LEU HB2 1.0 1.8 2.7 1658 1464 A 16 LEU HDx% A 16 LEU HB3 1.0 1.8 2.7 1659 1465 A 33 ASP HA A 33 ASP H 1.0 1.8 3.5 1660 1466 A 26 MET H A 24 PRO HBx 1.0 1.8 6.0 1661 1467 A 98 ARG HBy A 98 ARG HD2 1.0 1.8 3.5 1662 1467 A 98 ARG HBy A 98 ARG HD3 1.0 1.8 3.5 1663 1468 A 25 GLY H A 25 GLY HAx 1.0 1.8 3.5 1664 1469 A 51 GLY H A 51 GLY HAx 1.0 1.8 3.5 1665 1470 A 55 VAL HGy% A 56 GLN HA 1.0 1.8 5.0 1666 1471 A 82 ILE HG2% A 84 ASP H 1.0 1.8 6.0 1667 1472 A 81 ASP H A 80 GLU HG2 1.0 1.8 5.0 1668 1472 A 81 ASP H A 80 GLU HG3 1.0 1.8 5.0 1669 1473 A 71 HIS HA A 71 HIS HBy 1.0 1.8 2.7 1670 1474 A 71 HIS HA A 71 HIS HBx 1.0 1.8 2.7 1671 1475 A 71 HIS HBx A 71 HIS HD2 1.0 1.8 5.0 1672 1476 A 23 GLN H A 22 LEU HA 1.0 1.8 2.7 1673 1477 A 17 TYR HBx A 14 TYR HB2 1.0 1.8 5.0 1674 1477 A 14 TYR HB3 A 17 TYR HBx 1.0 1.8 5.0 1675 1478 A 18 VAL HA A 17 TYR HD% 1.0 1.8 5.0 1676 1479 A 18 VAL HA A 18 VAL HGy% 1.0 1.8 3.5 1677 1480 A 18 VAL HB A 17 TYR HD% 1.0 1.8 6.0 1678 1481 A 16 LEU H A 17 TYR HBy 1.0 1.8 5.0 1679 1482 A 66 TYR H A 68 VAL HGy% 1.0 1.8 5.0 1680 1483 A 66 TYR H A 66 TYR HBx 1.0 1.8 3.5 1681 1484 A 56 GLN H A 56 GLN HBy 1.0 1.8 3.5 1682 1485 A 77 GLY H A 75 ILE HA 1.0 1.8 6.0 1683 1486 A 83 GLU HA A 84 ASP H 1.0 1.8 3.5 1684 1487 A 71 HIS H A 73 LEU H 1.0 1.8 5.0 1685 1488 A 79 GLU HA A 79 GLU HG2 1.0 1.8 3.5 1686 1488 A 79 GLU HG3 A 79 GLU HA 1.0 1.8 3.5 1687 1489 A 51 GLY H A 50 ASN HBy 1.0 1.8 5.0 1688 1490 A 26 MET H A 24 PRO HA 1.0 1.8 5.0 1689 1491 A 25 GLY H A 24 PRO HBy 1.0 1.8 5.0 1690 1492 A 37 ILE HB A 34 TYR HD% 1.0 1.8 6.0 1691 1493 A 64 ARG H A 63 GLY HAy 1.0 1.8 3.5 1692 1494 A 63 GLY H A 63 GLY HAy 1.0 1.8 3.5 1693 1495 A 52 VAL H A 51 GLY H 1.0 1.8 3.5 1694 1496 A 22 LEU H A 18 VAL HGy% 1.0 1.8 5.0 1695 1497 A 81 ASP H A 80 GLU HA 1.0 1.8 3.5 1696 1498 A 77 GLY H A 76 LEU HA 1.0 1.8 3.5 1697 1499 A 71 HIS H A 69 HIS HBx 1.0 1.8 3.5 1698 1500 A 63 GLY HAx A 62 THR H 1.0 1.8 5.0 1699 1501 A 10 SER H A 9 ALA HA 1.0 1.8 3.5 1700 1502 A 47 GLN HE2x A 47 GLN HE2y 1.0 1.8 2.7 1701 1503 A 4 MET HBx A 6 SER H 1.0 1.8 5.0 1702 1504 A 23 GLN HGy A 23 GLN HE2y 1.0 1.8 5.0 1703 1505 A 49 ASN HBx A 49 ASN HD2y 1.0 1.8 5.0 1704 1506 A 49 ASN HBy A 49 ASN HD2y 1.0 1.8 5.0 1705 1507 A 48 SER H A 47 GLN HE2x 1.0 1.8 6.0 1706 1508 A 16 LEU H A 16 LEU HA 1.0 1.8 2.7 1707 1509 A 21 THR H A 20 ASP HB2 1.0 1.8 5.0 1708 1509 A 21 THR H A 20 ASP HB3 1.0 1.8 5.0 1709 1510 A 53 PRO HA A 52 VAL H 1.0 1.8 6.0 1710 1511 A 55 VAL H A 54 PRO HG2 1.0 1.8 5.0 1711 1511 A 55 VAL H A 54 PRO HG3 1.0 1.8 5.0 1712 1512 A 36 GLU H A 35 GLU HGx 1.0 1.8 6.0 1713 1513 A 70 TRP H A 69 HIS H 1.0 1.8 5.0 1714 1514 A 70 TRP H A 70 TRP HD1 1.0 1.8 3.5 1715 1515 A 44 GLU HA A 44 GLU H 1.0 1.8 3.5 1716 1516 A 45 PHE H A 44 GLU H 1.0 1.8 5.0 1717 1517 A 44 GLU H A 44 GLU HGy 1.0 1.8 5.0 1718 1518 A 8 PHE H A 7 GLU HA 1.0 1.8 3.5 1719 1519 A 8 PHE H A 7 GLU HG2 1.0 1.8 5.0 1720 1519 A 8 PHE H A 7 GLU HG3 1.0 1.8 5.0 1721 1520 A 8 PHE HBx A 8 PHE H 1.0 1.8 5.0 1722 1521 A 8 PHE HBy A 8 PHE H 1.0 1.8 3.5 1723 1522 A 8 PHE H A 8 PHE HA 1.0 1.8 3.5 1724 1523 A 8 PHE H A 7 GLU HB2 1.0 1.8 5.0 1725 1523 A 8 PHE H A 7 GLU HB3 1.0 1.8 5.0 1726 1524 A 26 MET H A 26 MET HGx 1.0 1.8 5.0 1727 1525 A 22 LEU HDy% A 26 MET H 1.0 1.8 6.0 1728 1526 A 49 ASN H A 49 ASN HBx 1.0 1.8 5.0 1729 1527 A 89 ASP H A 89 ASP HA 1.0 1.8 3.5 1730 1528 A 15 ALA H A 13 THR HA 1.0 1.8 5.0 1731 1529 A 7 GLU H A 7 GLU HG2 1.0 1.8 5.0 1732 1529 A 7 GLU H A 7 GLU HG3 1.0 1.8 5.0 1733 1530 A 17 TYR H A 19 ARG H 1.0 1.8 5.0 1734 1531 A 78 PHE H A 78 PHE HA 1.0 1.8 3.5 1735 1532 A 91 TYR H A 91 TYR HA 1.0 1.8 3.5 1736 1533 A 77 GLY H A 78 PHE H 1.0 1.8 5.0 1737 1534 A 80 GLU H A 78 PHE HBx 1.0 1.8 6.0 1738 1535 A 80 GLU H A 78 PHE HBy 1.0 1.8 6.0 1739 1536 A 82 ILE H A 81 ASP HBx 1.0 1.8 5.0 1740 1537 A 82 ILE H A 81 ASP HBy 1.0 1.8 5.0 1741 1538 A 82 ILE H A 81 ASP H 1.0 1.8 5.0 1742 1539 A 22 LEU H A 19 ARG HA 1.0 1.8 5.0 1743 1540 A 78 PHE HA A 79 GLU H 1.0 1.8 3.5 1744 1541 A 74 GLU H A 74 GLU HGy 1.0 1.8 5.0 1745 1542 A 39 ALA HB% A 41 ASP H 1.0 1.8 5.0 1746 1543 A 14 TYR HD% A 14 TYR H 1.0 1.8 5.0 1747 1544 A 34 TYR H A 35 GLU HA 1.0 1.8 6.0 1748 1545 A 38 SER H A 41 ASP HB2 1.0 1.8 3.5 1749 1545 A 38 SER H A 41 ASP HB3 1.0 1.8 3.5 1750 1546 A 58 PHE H A 58 PHE HD% 1.0 1.8 5.0 1751 1547 A 44 GLU HA A 45 PHE H 1.0 1.8 2.7 1752 1548 A 46 ARG H A 45 PHE HD% 1.0 1.8 5.0 1753 1549 A 46 ARG H A 45 PHE HBy 1.0 1.8 5.0 1754 1550 A 46 ARG H A 45 PHE HBx 1.0 1.8 5.0 1755 1551 A 47 GLN H A 46 ARG H 1.0 1.8 2.7 1756 1552 A 76 LEU H A 76 LEU HA 1.0 1.8 3.5 1757 1553 A 59 TRP H A 60 GLU H 1.0 1.8 5.0 1758 1554 A 59 TRP H A 60 GLU HA 1.0 1.8 6.0 1759 1555 A 51 GLY H A 50 ASN HBx 1.0 1.8 5.0 1760 1556 A 63 GLY H A 61 SER H 1.0 1.8 5.0 1761 1557 A 4 MET HA A 6 SER H 1.0 1.8 5.0 1762 1558 A 49 ASN HA A 49 ASN HD2y 1.0 1.8 5.0 1763 1559 A 37 ILE H A 34 TYR HBy 1.0 1.8 5.0 1764 1560 A 37 ILE H A 36 GLU HGy 1.0 1.8 6.0 1765 1561 A 5 ARG H A 6 SER H 1.0 1.8 3.5 1766 1562 A 23 GLN H A 26 MET HGx 1.0 1.8 5.0 1767 1563 A 87 GLU H A 86 VAL H 1.0 1.8 5.0 1768 1564 A 36 GLU HGy A 36 GLU HBy 1.0 1.8 3.5 1769 1565 A 79 GLU HBy A 79 GLU HG2 1.0 1.8 2.7 1770 1565 A 79 GLU HG3 A 79 GLU HBy 1.0 1.8 2.7 1771 1566 A 98 ARG HGy A 98 ARG HBx 1.0 1.8 3.5 1772 1567 A 98 ARG HBy A 98 ARG HBx 1.0 1.8 2.7 1773 1568 A 33 ASP HA A 34 TYR H 1.0 1.8 2.7 1774 1569 A 48 SER H A 47 GLN HA 1.0 1.8 2.7 1775 1570 A 15 ALA HA A 18 VAL HB 1.0 1.8 5.0 1776 1571 A 24 PRO HDx A 24 PRO HBy 1.0 1.8 5.0 1777 1572 A 42 GLU H A 41 ASP HA 1.0 1.8 2.7 1778 1573 A 85 MET HA A 85 MET HGy 1.0 1.8 5.0 1779 1574 A 15 ALA HA A 12 ASN HA 1.0 1.8 6.0 1780 1575 A 53 PRO HBx A 54 PRO HA 1.0 1.8 5.0 1781 1576 A 53 PRO HBy A 54 PRO HA 1.0 1.8 6.0 1782 1577 A 4 MET HBy A 4 MET HGy 1.0 1.8 3.5 1783 1578 A 4 MET HA A 4 MET HGy 1.0 1.8 5.0 1784 1579 A 4 MET HGx A 4 MET HGy 1.0 1.8 2.7 1785 1580 A 98 ARG HA A 98 ARG HBx 1.0 1.8 3.5 1786 1581 A 85 MET HA A 85 MET HBy 1.0 1.8 3.5 1787 1582 A 85 MET HBx A 85 MET HGy 1.0 1.8 3.5 1788 1583 A 86 VAL HB A 86 VAL HGx% 1.0 1.8 2.7 1789 1583 A 86 VAL HGy% A 86 VAL HB 1.0 1.8 2.7 1790 1584 A 59 TRP HA A 60 GLU HG2 1.0 1.8 6.0 1791 1584 A 59 TRP HA A 60 GLU HG3 1.0 1.8 6.0 1792 1585 A 57 VAL HGx% A 59 TRP HA 1.0 1.8 5.0 1793 1586 A 92 GLN HA A 92 GLN HG2 1.0 1.8 3.5 1794 1586 A 92 GLN HG3 A 92 GLN HA 1.0 1.8 3.5 1795 1587 A 26 MET HGx A 26 MET HB2 1.0 1.8 2.7 1796 1587 A 26 MET HB3 A 26 MET HGx 1.0 1.8 2.7 1797 1588 A 69 HIS HA A 69 HIS HBy 1.0 1.8 3.5 1798 1589 A 4 MET HBx A 4 MET HGy 1.0 1.8 3.5 1799 1590 A 26 MET HA A 26 MET HGx 1.0 1.8 5.0 1800 1591 A 54 PRO HBx A 54 PRO HBy 1.0 1.8 2.7 1801 1592 A 27 ARG HA A 28 VAL HA 1.0 1.8 5.0 1802 1593 A 58 PHE HE% A 60 GLU HA 1.0 1.8 3.5 1803 1594 A 36 GLU HA A 36 GLU HGx 1.0 1.8 5.0 1804 1595 A 36 GLU HBx A 36 GLU HGx 1.0 1.8 3.5 1805 1596 A 90 GLU HA A 90 GLU HGy 1.0 1.8 5.0 1806 1597 A 90 GLU HGy A 90 GLU HB2 1.0 1.8 2.7 1807 1597 A 90 GLU HB3 A 90 GLU HGy 1.0 1.8 2.7 1808 1598 A 74 GLU HGy A 74 GLU HGx 1.0 1.8 2.7 1809 1599 A 17 TYR HA A 16 LEU HDy% 1.0 1.8 6.0 1810 1600 A 7 GLU HA A 7 GLU HG2 1.0 1.8 3.5 1811 1600 A 7 GLU HA A 7 GLU HG3 1.0 1.8 3.5 1812 1601 A 53 PRO HA A 52 VAL HB 1.0 1.8 6.0 1813 1602 A 14 TYR HA A 17 TYR HBy 1.0 1.8 5.0 1814 1603 A 16 LEU HDy% A 12 ASN HB2 1.0 1.8 6.0 1815 1603 A 16 LEU HDy% A 12 ASN HB3 1.0 1.8 6.0 1816 1604 A 86 VAL HA A 86 VAL HB 1.0 1.8 3.5 1817 1605 A 45 PHE HA A 45 PHE HBx 1.0 1.8 3.5 1818 1606 A 45 PHE HA A 45 PHE HBy 1.0 1.8 2.7 1819 1607 A 45 PHE HBx A 45 PHE HBy 1.0 1.8 2.7 1820 1608 A 78 PHE HA A 78 PHE HBx 1.0 1.8 3.5 1821 1609 A 78 PHE HA A 78 PHE HBy 1.0 1.8 3.5 1822 1610 A 78 PHE HD% A 78 PHE HBy 1.0 1.8 2.7 1823 1611 A 58 PHE HBy A 58 PHE HD% 1.0 1.8 2.7 1824 1612 A 58 PHE HBx A 58 PHE HD% 1.0 1.8 2.7 1825 1613 A 8 PHE HBx A 8 PHE HA 1.0 1.8 2.7 1826 1614 A 8 PHE HBy A 8 PHE HA 1.0 1.8 3.5 1827 1615 A 8 PHE HBy A 8 PHE HBx 1.0 1.8 2.7 1828 1616 A 8 PHE HD% A 8 PHE HBy 1.0 1.8 2.7 1829 1617 A 8 PHE HD% A 8 PHE HBx 1.0 1.8 2.7 1830 1618 A 38 SER HA A 38 SER HBx 1.0 1.8 3.5 1831 1619 A 38 SER HA A 38 SER HBy 1.0 1.8 3.5 1832 1620 A 38 SER HBx A 38 SER HBy 1.0 1.8 2.7 1833 1621 A 33 ASP HA A 33 ASP HBx 1.0 1.8 3.5 1834 1622 A 39 ALA H A 39 ALA HB% 1.0 1.8 2.7 1835 1623 A 81 ASP HA A 81 ASP HBy 1.0 1.8 3.5 1836 1624 A 81 ASP HBx A 81 ASP HBy 1.0 1.8 2.7 1837 1625 A 81 ASP HA A 81 ASP HBx 1.0 1.8 3.5 1838 1626 A 10 SER HBx A 10 SER HA 1.0 1.8 3.5 1839 1627 A 54 PRO HA A 54 PRO HBy 1.0 1.8 3.5 1840 1628 A 13 THR HA A 16 LEU HA 1.0 1.8 6.0 1841 1629 A 75 ILE HG2% A 76 LEU HA 1.0 1.8 6.0 1842 1630 A 46 ARG HDy A 46 ARG HDx 1.0 1.8 2.7 1843 1631 A 9 ALA HB% A 10 SER HA 1.0 1.8 5.0 1844 1632 A 15 ALA HB% A 15 ALA HA 1.0 1.8 2.7 1845 1633 A 98 ARG HBx A 98 ARG HD2 1.0 1.8 3.5 1846 1633 A 98 ARG HD3 A 98 ARG HBx 1.0 1.8 3.5 1847 1634 A 51 GLY HAx A 51 GLY HAy 1.0 1.8 2.7 1848 1635 A 52 VAL HGx% A 52 VAL HB 1.0 1.8 2.7 1849 1636 A 52 VAL HGx% A 52 VAL HA 1.0 1.8 2.7 1850 1637 A 13 THR HB A 16 LEU HDy% 1.0 1.8 6.0 1851 1638 A 13 THR HB A 12 ASN HB2 1.0 1.8 6.0 1852 1638 A 13 THR HB A 12 ASN HB3 1.0 1.8 6.0 1853 1639 A 21 THR HG2% A 21 THR H 1.0 1.8 5.0 1854 1640 A 21 THR HG2% A 21 THR HA 1.0 1.8 3.5 1855 1641 A 32 ASP HBx A 32 ASP HBy 1.0 1.8 2.7 1856 1642 A 21 THR HB A 21 THR HA 1.0 1.8 3.5 1857 1643 A 21 THR HG2% A 21 THR HB 1.0 1.8 2.7 1858 1644 A 16 LEU HDx% A 16 LEU HA 1.0 1.8 3.5 1859 1645 A 62 THR HB A 62 THR HA 1.0 1.8 3.5 1860 1646 A 13 THR HG2% A 12 ASN HB2 1.0 1.8 6.0 1861 1646 A 13 THR HG2% A 12 ASN HB3 1.0 1.8 6.0 1862 1647 A 46 ARG HDx A 46 ARG HG2 1.0 1.8 2.7 1863 1647 A 46 ARG HG3 A 46 ARG HDx 1.0 1.8 2.7 1864 1648 A 53 PRO HDx A 53 PRO HGx 1.0 1.8 2.7 1865 1649 A 53 PRO HBy A 53 PRO HDx 1.0 1.8 5.0 1866 1650 A 53 PRO HBy A 53 PRO HDy 1.0 1.8 5.0 1867 1651 A 53 PRO HGy A 53 PRO HDy 1.0 1.8 2.7 1868 1652 A 53 PRO HGy A 53 PRO HDx 1.0 1.8 3.5 1869 1653 A 53 PRO HBx A 53 PRO HGy 1.0 1.8 2.7 1870 1654 A 24 PRO HDy A 23 GLN HE2x 1.0 1.8 5.0 1871 1655 A 24 PRO HDx A 23 GLN HE2x 1.0 1.8 5.0 1872 1656 A 54 PRO HBx A 54 PRO HDy 1.0 1.8 5.0 1873 1657 A 54 PRO HDy A 54 PRO HBy 1.0 1.8 5.0 1874 1658 A 54 PRO HDx A 54 PRO HG2 1.0 1.8 2.7 1875 1658 A 54 PRO HG3 A 54 PRO HDx 1.0 1.8 2.7 1876 1659 A 32 ASP HA A 32 ASP HBx 1.0 1.8 3.5 1877 1660 A 32 ASP HA A 32 ASP HBy 1.0 1.8 3.5 1878 1661 A 50 ASN HA A 50 ASN HBx 1.0 1.8 3.5 1879 1662 A 60 GLU HB2 A 60 GLU HG2 1.0 1.8 2.7 1880 1662 A 60 GLU HB3 A 60 GLU HG2 1.0 1.8 2.7 1881 1662 A 60 GLU HG3 A 60 GLU HB2 1.0 1.8 2.7 1882 1662 A 60 GLU HG3 A 60 GLU HB3 1.0 1.8 2.7 1883 1663 A 7 GLU HA A 7 GLU HB2 1.0 1.8 2.7 1884 1663 A 7 GLU HA A 7 GLU HB3 1.0 1.8 2.7 1885 1664 A 7 GLU HB3 A 7 GLU HG2 1.0 1.8 2.7 1886 1664 A 7 GLU HB2 A 7 GLU HG2 1.0 1.8 2.7 1887 1664 A 7 GLU HG3 A 7 GLU HB2 1.0 1.8 2.7 1888 1664 A 7 GLU HG3 A 7 GLU HB3 1.0 1.8 2.7 1889 1665 A 79 GLU H A 79 GLU HBy 1.0 1.8 5.0 1890 1666 A 78 PHE H A 78 PHE HBx 1.0 1.8 5.0 1891 1667 A 78 PHE H A 78 PHE HBy 1.0 1.8 5.0 1892 1668 A 81 ASP H A 81 ASP HBy 1.0 1.8 5.0 1893 1669 A 84 ASP H A 84 ASP HBx 1.0 1.8 5.0 1894 1670 A 40 GLY H A 40 GLY HAy 1.0 1.8 3.5 1895 1671 A 49 ASN H A 49 ASN HA 1.0 1.8 3.5 1896 1672 A 51 GLY H A 49 ASN HA 1.0 1.8 6.0 1897 1673 A 85 MET HA A 85 MET H 1.0 1.8 3.5 1898 1674 A 41 ASP H A 41 ASP HA 1.0 1.8 2.7 1899 1675 A 7 GLU H A 7 GLU HA 1.0 1.8 3.5 1900 1676 A 10 SER H A 10 SER HA 1.0 1.8 3.5 1901 1677 A 62 THR H A 61 SER HA 1.0 1.8 3.5 1902 1678 A 62 THR H A 62 THR HA 1.0 1.8 3.5 1903 1679 A 86 VAL H A 86 VAL HA 1.0 1.8 3.5 1904 1680 A 39 ALA H A 38 SER HBy 1.0 1.8 5.0 1905 1681 A 38 SER H A 38 SER HBy 1.0 1.8 5.0 1906 1682 A 48 SER HA A 48 SER HBx 1.0 1.8 3.5 1907 1683 A 102 ARG HBx A 102 ARG HA 1.0 1.8 3.5 1908 1684 A 102 ARG HBy A 102 ARG HG2 1.0 1.8 2.7 1909 1684 A 102 ARG HBy A 102 ARG HG3 1.0 1.8 2.7 1910 1685 A 70 TRP HD1 A 70 TRP HB2 1.0 1.8 2.7 1911 1685 A 70 TRP HB3 A 70 TRP HD1 1.0 1.8 2.7 1912 1686 A 71 HIS H A 70 TRP HB2 1.0 1.8 3.5 1913 1686 A 71 HIS H A 70 TRP HB3 1.0 1.8 3.5 1914 1687 A 69 HIS HA A 69 HIS HBx 1.0 1.8 2.7 1915 1688 A 69 HIS HBx A 69 HIS HBy 1.0 1.8 2.7 1916 1689 A 91 TYR H A 91 TYR HB2 1.0 1.8 3.5 1917 1689 A 91 TYR H A 91 TYR HB3 1.0 1.8 3.5 1918 1690 A 91 TYR HA A 91 TYR HB2 1.0 1.8 2.7 1919 1690 A 91 TYR HA A 91 TYR HB3 1.0 1.8 2.7 1920 1691 A 45 PHE H A 45 PHE HBx 1.0 1.8 2.7 1921 1692 A 78 PHE HD% A 78 PHE HBx 1.0 1.8 2.7 1922 1693 A 26 MET HE% A 22 LEU HDy% 1.0 1.8 6.0 1923 1694 A 27 ARG HA A 28 VAL HGx% 1.0 1.8 3.5 1924 1695 A 33 ASP HA A 30 MET HE% 1.0 1.8 5.0 1925 1696 A 30 MET HE% A 32 ASP HBy 1.0 1.8 6.0 1926 1697 A 65 THR HA A 65 THR HG2% 1.0 1.8 3.5 1927 1698 A 65 THR HB A 65 THR HG2% 1.0 1.8 2.7 1928 1699 A 65 THR HG2% A 65 THR H 1.0 1.8 5.0 1929 1700 A 62 THR HG2% A 62 THR H 1.0 1.8 5.0 1930 1701 A 62 THR HG2% A 62 THR HB 1.0 1.8 2.7 1931 1702 A 15 ALA HA A 18 VAL HGy% 1.0 1.8 5.0 1932 1703 A 48 SER HA A 48 SER H 1.0 1.8 3.5 1933 1704 A 59 TRP H A 59 TRP HB2 1.0 1.8 2.7 1934 1704 A 59 TRP H A 59 TRP HB3 1.0 1.8 2.7 1935 1705 A 60 GLU H A 59 TRP HB2 1.0 1.8 3.5 1936 1705 A 60 GLU H A 59 TRP HB3 1.0 1.8 3.5 1937 1706 A 60 GLU H A 60 GLU HB2 1.0 1.8 2.7 1938 1706 A 60 GLU H A 60 GLU HB3 1.0 1.8 2.7 1939 1707 A 7 GLU H A 7 GLU HB2 1.0 1.8 2.7 1940 1707 A 7 GLU H A 7 GLU HB3 1.0 1.8 2.7 1941 1708 A 74 GLU H A 74 GLU HBx 1.0 1.8 3.5 1942 1709 A 87 GLU H A 86 VAL HB 1.0 1.8 5.0 1943 1710 A 86 VAL H A 86 VAL HB 1.0 1.8 5.0 1944 1711 A 44 GLU H A 44 GLU HB2 1.0 1.8 2.7 1945 1711 A 44 GLU H A 44 GLU HB3 1.0 1.8 2.7 1946 1712 A 39 ALA H A 38 SER HBx 1.0 1.8 5.0 1947 1713 A 38 SER H A 38 SER HBx 1.0 1.8 5.0 1948 1714 A 83 GLU H A 82 ILE HB 1.0 1.8 5.0 1949 1715 A 49 ASN H A 49 ASN HBy 1.0 1.8 5.0 1950 1716 A 49 ASN H A 48 SER HBx 1.0 1.8 5.0 1951 1717 A 41 ASP H A 41 ASP HB2 1.0 1.8 2.7 1952 1717 A 41 ASP H A 41 ASP HB3 1.0 1.8 2.7 1953 1718 A 34 TYR H A 33 ASP HBx 1.0 1.8 5.0 1954 1719 A 81 ASP H A 81 ASP HBx 1.0 1.8 5.0 1955 1720 A 65 THR HB A 66 TYR H 1.0 1.8 5.0 1956 1721 A 33 ASP H A 32 ASP HBx 1.0 1.8 5.0 1957 1722 A 33 ASP H A 32 ASP HBy 1.0 1.8 5.0 1958 1723 A 32 ASP H A 32 ASP HA 1.0 1.8 3.5 1959 1724 A 33 ASP H A 32 ASP HA 1.0 1.8 2.7 1960 1725 A 42 GLU HA A 42 GLU H 1.0 1.8 3.5 1961 1726 A 15 ALA HB% A 14 TYR HD% 1.0 1.8 6.0 1962 1727 A 55 VAL HGx% A 57 VAL HB 1.0 1.8 5.0 1963 1728 A 52 VAL HGy% A 54 PRO HG2 1.0 1.8 5.0 1964 1728 A 54 PRO HG3 A 52 VAL HGy% 1.0 1.8 5.0 1965 1729 A 54 PRO HBy A 54 PRO HG2 1.0 1.8 2.7 1966 1729 A 54 PRO HG3 A 54 PRO HBy 1.0 1.8 2.7 1967 1730 A 85 MET HBx A 85 MET HBy 1.0 1.8 2.7 1968 1731 A 26 MET HE% A 26 MET HGx 1.0 1.8 3.5 1969 1732 A 74 GLU HGx A 74 GLU HBx 1.0 1.8 3.5 1970 1733 A 77 GLY HAx A 76 LEU HA 1.0 1.8 6.0 1971 1734 A 68 VAL HGx% A 66 TYR HBx 1.0 1.8 6.0 1972 1735 A 63 GLY HAx A 62 THR HB 1.0 1.8 6.0 1973 1736 A 46 ARG HA A 47 GLN HA 1.0 1.8 5.0 1974 1737 A 15 ALA HA A 16 LEU H 1.0 1.8 3.5 1975 1738 A 34 TYR HA A 35 GLU HA 1.0 1.8 5.0 1976 1739 A 52 VAL HA A 54 PRO HG2 1.0 1.8 6.0 1977 1739 A 54 PRO HG3 A 52 VAL HA 1.0 1.8 6.0 1978 1740 A 67 TRP HBx A 68 VAL HA 1.0 1.8 6.0 1979 1741 A 67 TRP HBy A 68 VAL HA 1.0 1.8 6.0 1980 1742 A 58 PHE HBy A 57 VAL HA 1.0 1.8 5.0 1981 1743 A 58 PHE HBx A 57 VAL HA 1.0 1.8 5.0 1982 1744 A 15 ALA HA A 14 TYR HA 1.0 1.8 5.0 1983 1745 A 24 PRO HA A 23 GLN HA 1.0 1.8 5.0 1984 1746 A 57 VAL HB A 59 TRP HZ2 1.0 1.8 5.0 1985 1747 A 57 VAL HGy% A 59 TRP HZ2 1.0 1.8 5.0 1986 1748 A 14 TYR HD% A 15 ALA HA 1.0 1.8 6.0 1987 1749 A 91 TYR HD% A 91 TYR HB2 1.0 1.8 2.7 1988 1749 A 91 TYR HB3 A 91 TYR HD% 1.0 1.8 2.7 1989 1750 A 21 THR HB A 18 VAL HGx% 1.0 1.8 6.0 1990 1751 A 80 GLU H A 80 GLU HA 1.0 1.8 3.5 1991 1752 A 83 GLU H A 83 GLU HBx 1.0 1.8 5.0 1992 1753 A 87 GLU HA A 86 VAL HGx% 1.0 1.8 5.0 1993 1753 A 86 VAL HGy% A 87 GLU HA 1.0 1.8 5.0 1994 1754 A 39 ALA H A 39 ALA HA 1.0 1.8 2.7 1995 1755 A 39 ALA HB% A 39 ALA HA 1.0 1.8 2.7 1996 1756 A 69 HIS H A 69 HIS HBy 1.0 1.8 3.5 1997 1757 A 69 HIS H A 69 HIS HBx 1.0 1.8 5.0 1998 1758 A 84 ASP H A 84 ASP HA 1.0 1.8 3.5 1999 1759 A 100 LEU H A 99 VAL HGx% 1.0 1.8 5.0 2000 1759 A 100 LEU H A 99 VAL HGy% 1.0 1.8 5.0 2001 1760 A 84 ASP HBx A 84 ASP HA 1.0 1.8 3.5 2002 1761 A 99 VAL HA A 99 VAL HB 1.0 1.8 3.5 2003 1762 A 99 VAL HA A 99 VAL HGx% 1.0 1.8 2.7 2004 1762 A 99 VAL HGy% A 99 VAL HA 1.0 1.8 2.7 2005 1763 A 99 VAL H A 99 VAL HGx% 1.0 1.8 2.7 2006 1763 A 99 VAL HGy% A 99 VAL H 1.0 1.8 2.7 2007 1764 A 34 TYR HE% A 35 GLU HB2 1.0 1.8 5.0 2008 1764 A 35 GLU HB3 A 34 TYR HE% 1.0 1.8 5.0 2009 1765 A 22 LEU H A 22 LEU HA 1.0 1.8 3.5 2010 1766 A 68 VAL HGx% A 72 MET H 1.0 1.8 5.0 2011 1767 A 44 GLU H A 46 ARG HG2 1.0 1.8 6.0 2012 1767 A 44 GLU H A 46 ARG HG3 1.0 1.8 6.0 2013 1768 A 28 VAL HGy% A 27 ARG HB2 1.0 1.8 5.0 2014 1768 A 28 VAL HGy% A 27 ARG HB3 1.0 1.8 5.0 2015 1769 A 68 VAL HGx% A 72 MET HGy 1.0 1.8 3.5 2016 1770 A 26 MET HE% A 22 LEU HA 1.0 1.8 5.0 2017 1771 A 57 VAL H A 59 TRP HE1 1.0 1.8 5.0 2018 1772 A 26 MET H A 24 PRO HBy 1.0 1.8 6.0 2019 1773 A 35 GLU HA A 35 GLU HGy 1.0 1.8 5.0 2020 1774 A 62 THR H A 60 GLU HA 1.0 1.8 5.0 2021 1775 A 60 GLU HA A 61 SER HA 1.0 1.8 5.0 2022 1776 A 37 ILE HG2% A 39 ALA HA 1.0 1.8 5.0 2023 1777 A 15 ALA HB% A 14 TYR HB2 1.0 1.8 5.0 2024 1777 A 15 ALA HB% A 14 TYR HB3 1.0 1.8 5.0 2025 1778 A 46 ARG H A 46 ARG HDy 1.0 1.8 5.0 2026 1779 A 28 VAL HGy% A 27 ARG HGy 1.0 1.8 6.0 2027 1780 A 18 VAL HB A 19 ARG HA 1.0 1.8 6.0 2028 1781 A 79 GLU HBy A 79 GLU HBx 1.0 1.8 2.7 2029 1782 A 79 GLU HBx A 79 GLU HG2 1.0 1.8 2.7 2030 1782 A 79 GLU HG3 A 79 GLU HBx 1.0 1.8 2.7 2031 1783 A 79 GLU HA A 79 GLU HBy 1.0 1.8 3.5 2032 1784 A 79 GLU H A 79 GLU HBx 1.0 1.8 3.5 2033 1785 A 83 GLU HBy A 84 ASP H 1.0 1.8 5.0 2034 1786 A 17 TYR HA A 16 LEU HB2 1.0 1.8 5.0 2035 1786 A 17 TYR HA A 16 LEU HB3 1.0 1.8 5.0 2036 1787 A 34 TYR H A 33 ASP HBy 1.0 1.8 5.0 2037 1788 A 34 TYR H A 33 ASP H 1.0 1.8 5.0 2038 1789 A 33 ASP HA A 33 ASP HBy 1.0 1.8 3.5 2039 1790 A 33 ASP HBx A 33 ASP HBy 1.0 1.8 2.7 2040 1791 A 33 ASP H A 33 ASP HBx 1.0 1.8 3.5 2041 1792 A 25 GLY HAx A 24 PRO HA 1.0 1.8 6.0 2042 1793 A 51 GLY H A 51 GLY HAy 1.0 1.8 3.5 2043 1794 A 70 TRP H A 71 HIS HBy 1.0 1.8 6.0 2044 1795 A 52 VAL HGx% A 51 GLY HAx 1.0 1.8 6.0 2045 1796 A 71 HIS HD2 A 69 HIS HBy 1.0 1.8 5.0 2046 1797 A 98 ARG HA A 98 ARG HGx 1.0 1.8 5.0 2047 1798 A 98 ARG HGy A 98 ARG HGx 1.0 1.8 2.7 2048 1799 A 45 PHE H A 44 GLU HGx 1.0 1.8 5.0 2049 1800 A 44 GLU HGy A 44 GLU HGx 1.0 1.8 2.7 2050 1801 A 57 VAL HGx% A 55 VAL HGy% 1.0 1.8 6.0 2051 1802 A 55 VAL HGx% A 57 VAL HA 1.0 1.8 6.0 2052 1803 A 59 TRP HD1 A 59 TRP HB2 1.0 1.8 2.7 2053 1803 A 59 TRP HD1 A 59 TRP HB3 1.0 1.8 2.7 2054 1804 A 25 GLY HAx A 24 PRO HBx 1.0 1.8 5.0 2055 1805 A 8 PHE HD% A 6 SER HA 1.0 1.8 6.0 2056 1806 A 87 GLU H A 87 GLU HBx 1.0 1.8 5.0 2057 1807 A 81 ASP H A 80 GLU HBy 1.0 1.8 5.0 2058 1808 A 75 ILE HD1% A 77 GLY HAx 1.0 1.8 6.0 2059 1809 A 84 ASP H A 83 GLU HBx 1.0 1.8 5.0 2060 1810 A 87 GLU HA A 87 GLU HBx 1.0 1.8 3.5 2061 1811 A 81 ASP H A 80 GLU HBx 1.0 1.8 5.0 2062 1812 A 30 MET HA A 29 ARG HG2 1.0 1.8 6.0 2063 1812 A 30 MET HA A 29 ARG HG3 1.0 1.8 6.0 2064 1813 A 80 GLU H A 80 GLU HBy 1.0 1.8 5.0 2065 1814 A 71 HIS HA A 73 LEU H 1.0 1.8 5.0 2066 1815 A 80 GLU H A 80 GLU HBx 1.0 1.8 5.0 2067 1816 A 52 VAL H A 53 PRO HDy 1.0 1.8 5.0 2068 1817 A 87 GLU HA A 87 GLU HBy 1.0 1.8 3.5 2069 1818 A 65 THR HA A 65 THR H 1.0 1.8 3.5 2070 1819 A 65 THR HB A 65 THR H 1.0 1.8 3.5 2071 1820 A 47 GLN H A 46 ARG HDx 1.0 1.8 6.0 2072 1821 A 23 GLN HGx A 23 GLN HE2y 1.0 1.8 5.0 2073 1822 A 23 GLN HA A 23 GLN HE2y 1.0 1.8 6.0 2074 1823 A 48 SER H A 48 SER HBx 1.0 1.8 5.0 2075 1824 A 32 ASP H A 31 LEU HDy% 1.0 1.8 6.0 2076 1825 A 21 THR H A 20 ASP HA 1.0 1.8 3.5 2077 1826 A 21 THR H A 22 LEU HB2 1.0 1.8 5.0 2078 1826 A 21 THR H A 22 LEU HB3 1.0 1.8 5.0 2079 1827 A 73 LEU H A 70 TRP HB2 1.0 1.8 6.0 2080 1827 A 70 TRP HB3 A 73 LEU H 1.0 1.8 6.0 2081 1828 A 72 MET HA A 73 LEU H 1.0 1.8 3.5 2082 1829 A 52 VAL H A 51 GLY HAx 1.0 1.8 3.5 2083 1830 A 20 ASP H A 20 ASP HA 1.0 1.8 3.5 2084 1831 A 55 VAL H A 54 PRO HDx 1.0 1.8 6.0 2085 1832 A 55 VAL H A 54 PRO HBx 1.0 1.8 5.0 2086 1833 A 36 GLU H A 36 GLU HGx 1.0 1.8 6.0 2087 1834 A 70 TRP H A 70 TRP HE1 1.0 1.8 5.0 2088 1835 A 70 TRP H A 70 TRP HE3 1.0 1.8 6.0 2089 1836 A 44 GLU H A 45 PHE HA 1.0 1.8 5.0 2090 1837 A 42 GLU H A 42 GLU HBx 1.0 1.8 5.0 2091 1838 A 42 GLU HGx A 42 GLU H 1.0 1.8 5.0 2092 1839 A 44 GLU H A 43 GLY HAy 1.0 1.8 2.7 2093 1840 A 26 MET H A 23 GLN HE2x 1.0 1.8 6.0 2094 1841 A 48 SER H A 49 ASN H 1.0 1.8 5.0 2095 1842 A 49 ASN H A 48 SER HBy 1.0 1.8 5.0 2096 1843 A 8 PHE HD% A 7 GLU H 1.0 1.8 5.0 2097 1844 A 91 TYR H A 91 TYR HD% 1.0 1.8 5.0 2098 1845 A 90 GLU HGy A 90 GLU H 1.0 1.8 5.0 2099 1846 A 90 GLU H A 89 ASP HB2 1.0 1.8 5.0 2100 1846 A 90 GLU H A 89 ASP HB3 1.0 1.8 5.0 2101 1847 A 89 ASP HA A 90 GLU H 1.0 1.8 3.5 2102 1848 A 78 PHE H A 78 PHE HD% 1.0 1.8 5.0 2103 1849 A 84 ASP HBx A 85 MET H 1.0 1.8 5.0 2104 1850 A 78 PHE HA A 81 ASP H 1.0 1.8 5.0 2105 1851 A 22 LEU H A 22 LEU HB2 1.0 1.8 3.5 2106 1851 A 22 LEU H A 22 LEU HB3 1.0 1.8 3.5 2107 1852 A 22 LEU H A 18 VAL HA 1.0 1.8 5.0 2108 1853 A 92 GLN H A 92 GLN HG2 1.0 1.8 5.0 2109 1853 A 92 GLN HG3 A 92 GLN H 1.0 1.8 5.0 2110 1854 A 22 LEU H A 22 LEU HDx% 1.0 1.8 5.0 2111 1855 A 22 LEU H A 22 LEU HDy% 1.0 1.8 5.0 2112 1856 A 5 ARG HGy A 5 ARG H 1.0 1.8 5.0 2113 1857 A 5 ARG HBx A 5 ARG H 1.0 1.8 3.5 2114 1858 A 78 PHE HD% A 79 GLU H 1.0 1.8 5.0 2115 1859 A 79 GLU H A 81 ASP H 1.0 1.8 6.0 2116 1860 A 74 GLU H A 73 LEU HA 1.0 1.8 2.7 2117 1861 A 18 VAL H A 16 LEU HDx% 1.0 1.8 6.0 2118 1862 A 41 ASP H A 42 GLU H 1.0 1.8 5.0 2119 1863 A 41 ASP H A 38 SER HBx 1.0 1.8 6.0 2120 1864 A 23 GLN H A 22 LEU HB2 1.0 1.8 5.0 2121 1864 A 23 GLN H A 22 LEU HB3 1.0 1.8 5.0 2122 1865 A 21 THR HG2% A 23 GLN H 1.0 1.8 6.0 2123 1866 A 23 GLN H A 22 LEU HDx% 1.0 1.8 6.0 2124 1867 A 22 LEU HDy% A 23 GLN H 1.0 1.8 6.0 2125 1868 A 39 ALA H A 40 GLY H 1.0 1.8 5.0 2126 1869 A 45 PHE H A 45 PHE HD% 1.0 1.8 5.0 2127 1870 A 31 LEU H A 31 LEU HDy% 1.0 1.8 5.0 2128 1871 A 59 TRP H A 59 TRP HD1 1.0 1.8 3.5 2129 1872 A 10 SER H A 10 SER HBx 1.0 1.8 5.0 2130 1873 A 47 GLN H A 45 PHE HD% 1.0 1.8 5.0 2131 1874 A 63 GLY H A 61 SER HA 1.0 1.8 6.0 2132 1875 A 48 SER HA A 49 ASN HD2x 1.0 1.8 6.0 2133 1876 A 13 THR H A 12 ASN HA 1.0 1.8 3.5 2134 1877 A 72 MET HBy A 73 LEU H 1.0 1.8 5.0 2135 1878 A 21 THR HB A 20 ASP H 1.0 1.8 6.0 2136 1879 A 37 ILE HG1y A 36 GLU H 1.0 1.8 6.0 2137 1880 A 91 TYR H A 90 GLU HB2 1.0 1.8 5.0 2138 1880 A 90 GLU HB3 A 91 TYR H 1.0 1.8 5.0 2139 1881 A 89 ASP H A 90 GLU H 1.0 1.8 5.0 2140 1882 A 84 ASP H A 85 MET H 1.0 1.8 5.0 2141 1883 A 31 LEU H A 32 ASP HBy 1.0 1.8 6.0 2142 1884 A 29 ARG HA A 28 VAL HB 1.0 1.8 5.0 2143 1885 A 40 GLY H A 39 ALA HA 1.0 1.8 2.7 2144 1886 A 9 ALA HA A 10 SER HA 1.0 1.8 5.0 2145 1887 A 87 GLU HBx A 86 VAL HGx% 1.0 1.8 5.0 2146 1887 A 86 VAL HGy% A 87 GLU HBx 1.0 1.8 5.0 2147 1888 A 85 MET H A 84 ASP HA 1.0 1.8 3.5 2148 1889 A 89 ASP HA A 89 ASP HB2 1.0 1.8 2.7 2149 1889 A 89 ASP HA A 89 ASP HB3 1.0 1.8 2.7 2150 1890 A 85 MET HA A 86 VAL HGx% 1.0 1.8 5.0 2151 1890 A 85 MET HA A 86 VAL HGy% 1.0 1.8 5.0 2152 1891 A 85 MET HA A 86 VAL H 1.0 1.8 3.5 2153 1892 A 13 THR HA A 12 ASN HA 1.0 1.8 5.0 2154 1893 A 37 ILE HG2% A 41 ASP HA 1.0 1.8 5.0 2155 1894 A 85 MET HBx A 85 MET HGx 1.0 1.8 3.5 2156 1895 A 85 MET HGy A 85 MET HGx 1.0 1.8 2.7 2157 1896 A 85 MET HA A 85 MET HGx 1.0 1.8 5.0 2158 1897 A 53 PRO HBx A 53 PRO HGx 1.0 1.8 3.5 2159 1898 A 68 VAL HGx% A 69 HIS HA 1.0 1.8 5.0 2160 1899 A 69 HIS HA A 72 MET HGx 1.0 1.8 6.0 2161 1900 A 85 MET HGy A 85 MET HBy 1.0 1.8 3.5 2162 1901 A 59 TRP HA A 59 TRP HD1 1.0 1.8 5.0 2163 1902 A 90 GLU HA A 91 TYR H 1.0 1.8 3.5 2164 1903 A 91 TYR HA A 92 GLN HG2 1.0 1.8 6.0 2165 1903 A 91 TYR HA A 92 GLN HG3 1.0 1.8 6.0 2166 1904 A 102 ARG HA A 102 ARG HBy 1.0 1.8 3.5 2167 1905 A 44 GLU HGy A 44 GLU HB2 1.0 1.8 2.7 2168 1905 A 44 GLU HGy A 44 GLU HB3 1.0 1.8 2.7 2169 1906 A 44 GLU HA A 44 GLU HB2 1.0 1.8 2.7 2170 1906 A 44 GLU HA A 44 GLU HB3 1.0 1.8 2.7 2171 1907 A 29 ARG HBx A 31 LEU HDy% 1.0 1.8 6.0 2172 1908 A 34 TYR HE% A 35 GLU HGx 1.0 1.8 6.0 2173 1909 A 34 TYR HE% A 35 GLU HGy 1.0 1.8 6.0 2174 1910 A 36 GLU HGy A 36 GLU HGx 1.0 1.8 2.7 2175 1911 A 90 GLU HGy A 90 GLU HGx 1.0 1.8 2.7 2176 1912 A 90 GLU HA A 90 GLU HGx 1.0 1.8 5.0 2177 1913 A 90 GLU HGx A 90 GLU HB2 1.0 1.8 2.7 2178 1913 A 90 GLU HB3 A 90 GLU HGx 1.0 1.8 2.7 2179 1914 A 61 SER HA A 60 GLU HB2 1.0 1.8 5.0 2180 1914 A 60 GLU HB3 A 61 SER HA 1.0 1.8 5.0 2181 1915 A 58 PHE HE% A 60 GLU HG2 1.0 1.8 6.0 2182 1915 A 60 GLU HG3 A 58 PHE HE% 1.0 1.8 6.0 2183 1916 A 44 GLU HA A 44 GLU HGx 1.0 1.8 5.0 2184 1917 A 53 PRO HBx A 53 PRO HA 1.0 1.8 3.5 2185 1918 A 53 PRO HBy A 53 PRO HA 1.0 1.8 2.7 2186 1919 A 50 ASN HBy A 50 ASN HBx 1.0 1.8 2.7 2187 1920 A 12 ASN HA A 12 ASN HB2 1.0 1.8 2.7 2188 1920 A 12 ASN HB3 A 12 ASN HA 1.0 1.8 2.7 2189 1921 A 20 ASP HA A 20 ASP HB2 1.0 1.8 2.7 2190 1921 A 20 ASP HB3 A 20 ASP HA 1.0 1.8 2.7 2191 1922 A 41 ASP HA A 41 ASP HB2 1.0 1.8 2.7 2192 1922 A 41 ASP HB3 A 41 ASP HA 1.0 1.8 2.7 2193 1923 A 13 THR HA A 17 TYR HBy 1.0 1.8 6.0 2194 1924 A 68 VAL HGx% A 66 TYR HD% 1.0 1.8 5.0 2195 1925 A 46 ARG HDy A 44 GLU HB2 1.0 1.8 6.0 2196 1925 A 44 GLU HB3 A 46 ARG HDy 1.0 1.8 6.0 2197 1926 A 17 TYR HD% A 16 LEU HG 1.0 1.8 6.0 2198 1927 A 96 ALA HB% A 96 ALA H 1.0 1.8 3.5 2199 1928 A 15 ALA HB% A 12 ASN HB2 1.0 1.8 3.5 2200 1928 A 15 ALA HB% A 12 ASN HB3 1.0 1.8 3.5 2201 1929 A 77 GLY HAx A 77 GLY HAy 1.0 1.8 2.7 2202 1930 A 13 THR HB A 16 LEU HB2 1.0 1.8 6.0 2203 1930 A 13 THR HB A 16 LEU HB3 1.0 1.8 6.0 2204 1931 A 13 THR HB A 14 TYR HA 1.0 1.8 6.0 2205 1932 A 40 GLY HAy A 40 GLY HAx 1.0 1.8 2.7 2206 1933 A 48 SER HA A 48 SER HBy 1.0 1.8 2.7 2207 1934 A 48 SER HBy A 48 SER HBx 1.0 1.8 2.7 2208 1935 A 43 GLY HAx A 43 GLY HAy 1.0 1.8 2.7 2209 1936 A 11 GLY HAx A 14 TYR HB2 1.0 1.8 6.0 2210 1936 A 11 GLY HAx A 14 TYR HB3 1.0 1.8 6.0 2211 1937 A 63 GLY HAx A 63 GLY HAy 1.0 1.8 2.7 2212 1938 A 30 MET HA A 31 LEU HG 1.0 1.8 6.0 2213 1939 A 22 LEU HDy% A 22 LEU HDx% 1.0 1.8 2.7 2214 1940 A 102 ARG HA A 102 ARG HG2 1.0 1.8 3.5 2215 1940 A 102 ARG HA A 102 ARG HG3 1.0 1.8 3.5 2216 1941 A 31 LEU HDy% A 29 ARG HG2 1.0 1.8 6.0 2217 1941 A 29 ARG HG3 A 31 LEU HDy% 1.0 1.8 6.0 2218 1942 A 54 PRO HA A 53 PRO HGy 1.0 1.8 6.0 2219 1943 A 54 PRO HDx A 53 PRO HGx 1.0 1.8 5.0 2220 1944 A 49 ASN HA A 50 ASN HBx 1.0 1.8 6.0 2221 1945 A 92 GLN HBy A 92 GLN HG2 1.0 1.8 2.7 2222 1945 A 92 GLN HG3 A 92 GLN HBy 1.0 1.8 2.7 2223 1946 A 92 GLN HA A 92 GLN HBy 1.0 1.8 3.5 2224 1947 A 92 GLN HBx A 92 GLN HG2 1.0 1.8 2.7 2225 1947 A 92 GLN HG3 A 92 GLN HBx 1.0 1.8 2.7 2226 1948 A 92 GLN HA A 92 GLN HBx 1.0 1.8 3.5 2227 1949 A 92 GLN HBy A 92 GLN HBx 1.0 1.8 2.7 2228 1950 A 50 ASN HA A 50 ASN HBy 1.0 1.8 3.5 2229 1951 A 58 PHE HE% A 60 GLU HB2 1.0 1.8 6.0 2230 1951 A 58 PHE HE% A 60 GLU HB3 1.0 1.8 6.0 2231 1952 A 5 ARG HBy A 5 ARG H 1.0 1.8 3.5 2232 1953 A 85 MET HBx A 85 MET H 1.0 1.8 5.0 2233 1954 A 85 MET HBy A 85 MET H 1.0 1.8 5.0 2234 1955 A 89 ASP H A 89 ASP HB2 1.0 1.8 3.5 2235 1955 A 89 ASP H A 89 ASP HB3 1.0 1.8 3.5 2236 1956 A 25 GLY H A 25 GLY HAy 1.0 1.8 3.5 2237 1957 A 41 ASP H A 40 GLY HAx 1.0 1.8 3.5 2238 1958 A 43 GLY H A 43 GLY HAy 1.0 1.8 3.5 2239 1959 A 90 GLU HA A 90 GLU H 1.0 1.8 3.5 2240 1960 A 58 PHE HD% A 60 GLU HA 1.0 1.8 5.0 2241 1961 A 70 TRP HA A 70 TRP HD1 1.0 1.8 5.0 2242 1962 A 100 LEU H A 99 VAL HA 1.0 1.8 3.5 2243 1963 A 99 VAL HA A 99 VAL H 1.0 1.8 3.5 2244 1964 A 102 ARG HBx A 102 ARG H 1.0 1.8 5.0 2245 1965 A 102 ARG HBx A 102 ARG HG2 1.0 1.8 2.7 2246 1965 A 102 ARG HBx A 102 ARG HG3 1.0 1.8 2.7 2247 1966 A 102 ARG HBx A 102 ARG HBy 1.0 1.8 2.7 2248 1967 A 70 TRP HE1 A 70 TRP HB2 1.0 1.8 5.0 2249 1967 A 70 TRP HB3 A 70 TRP HE1 1.0 1.8 5.0 2250 1968 A 70 TRP HA A 70 TRP HE3 1.0 1.8 5.0 2251 1969 A 10 SER HBx A 12 ASN HB2 1.0 1.8 5.0 2252 1969 A 12 ASN HB3 A 10 SER HBx 1.0 1.8 5.0 2253 1970 A 9 ALA HB% A 9 ALA HA 1.0 1.8 2.7 2254 1971 A 9 ALA HB% A 10 SER HBx 1.0 1.8 5.0 2255 1972 A 30 MET HE% A 32 ASP HA 1.0 1.8 5.0 2256 1973 A 65 THR HG2% A 66 TYR H 1.0 1.8 5.0 2257 1974 A 90 GLU H A 90 GLU HB2 1.0 1.8 3.5 2258 1974 A 90 GLU HB3 A 90 GLU H 1.0 1.8 3.5 2259 1975 A 14 TYR HE% A 14 TYR HA 1.0 1.8 5.0 2260 1976 A 95 VAL HA A 95 VAL H 1.0 1.8 3.5 2261 1977 A 42 GLU H A 41 ASP HB2 1.0 1.8 3.5 2262 1977 A 42 GLU H A 41 ASP HB3 1.0 1.8 3.5 2263 1978 A 20 ASP H A 20 ASP HB2 1.0 1.8 2.7 2264 1978 A 20 ASP H A 20 ASP HB3 1.0 1.8 2.7 2265 1979 A 78 PHE H A 77 GLY HAx 1.0 1.8 3.5 2266 1980 A 77 GLY H A 77 GLY HAy 1.0 1.8 3.5 2267 1981 A 78 PHE H A 77 GLY HAy 1.0 1.8 3.5 2268 1982 A 40 GLY H A 40 GLY HAx 1.0 1.8 2.7 2269 1983 A 18 VAL HGx% A 19 ARG HA 1.0 1.8 6.0 2270 1984 A 68 VAL HGy% A 69 HIS HA 1.0 1.8 6.0 2271 1985 A 13 THR HG2% A 14 TYR HA 1.0 1.8 5.0 2272 1986 A 31 LEU HDx% A 31 LEU HDy% 1.0 1.8 2.7 2273 1987 A 62 THR HB A 59 TRP HB2 1.0 1.8 5.0 2274 1987 A 59 TRP HB3 A 62 THR HB 1.0 1.8 5.0 2275 1988 A 23 GLN HBy A 26 MET HGy 1.0 1.8 6.0 2276 1989 A 37 ILE HA A 41 ASP HB2 1.0 1.8 5.0 2277 1989 A 37 ILE HA A 41 ASP HB3 1.0 1.8 5.0 2278 1990 A 39 ALA HB% A 40 GLY HAy 1.0 1.8 5.0 2279 1991 A 94 ALA HB% A 93 GLY HA2 1.0 1.8 5.0 2280 1991 A 93 GLY HA3 A 94 ALA HB% 1.0 1.8 5.0 2281 1992 A 50 ASN HA A 49 ASN HA 1.0 1.8 5.0 2282 1993 A 50 ASN HA A 51 GLY HAx 1.0 1.8 6.0 2283 1994 A 50 ASN HA A 51 GLY HAy 1.0 1.8 5.0 2284 1995 A 36 GLU HA A 35 GLU HB2 1.0 1.8 5.0 2285 1995 A 35 GLU HB3 A 36 GLU HA 1.0 1.8 5.0 2286 1996 A 58 PHE HA A 59 TRP HA 1.0 1.8 5.0 2287 1997 A 45 PHE HA A 45 PHE HD% 1.0 1.8 3.5 2288 1998 A 71 HIS HA A 70 TRP HA 1.0 1.8 5.0 2289 1999 A 28 VAL HA A 29 ARG HBx 1.0 1.8 6.0 2290 2000 A 17 TYR HA A 16 LEU HA 1.0 1.8 5.0 2291 2001 A 87 GLU HA A 86 VAL HA 1.0 1.8 5.0 2292 2002 A 14 TYR HE% A 14 TYR HB2 1.0 1.8 5.0 2293 2002 A 14 TYR HE% A 14 TYR HB3 1.0 1.8 5.0 2294 2003 A 70 TRP HE3 A 70 TRP HB2 1.0 1.8 2.7 2295 2003 A 70 TRP HB3 A 70 TRP HE3 1.0 1.8 2.7 2296 2004 A 70 TRP HE1 A 70 TRP HD1 1.0 1.8 2.7 2297 2005 A 59 TRP HD1 A 57 VAL HB 1.0 1.8 5.0 2298 2006 A 14 TYR HD% A 14 TYR HE% 1.0 1.8 2.7 2299 2007 A 91 TYR HA A 91 TYR HD% 1.0 1.8 5.0 2300 2008 A 69 HIS HBy A 71 HIS HE1 1.0 1.8 6.0 2301 2009 A 69 HIS HBx A 71 HIS HE1 1.0 1.8 6.0 2302 2010 A 83 GLU H A 83 GLU HG2 1.0 1.8 5.0 2303 2010 A 83 GLU H A 83 GLU HG3 1.0 1.8 5.0 2304 2011 A 63 GLY H A 64 ARG HA 1.0 1.8 6.0 2305 2012 A 14 TYR HD% A 18 VAL HGx% 1.0 1.8 5.0 2306 2013 A 87 GLU H A 87 GLU HG2 1.0 1.8 5.0 2307 2013 A 87 GLU H A 87 GLU HG3 1.0 1.8 5.0 2308 2014 A 14 TYR H A 11 GLY HAx 1.0 1.8 6.0 2309 2015 A 38 SER HA A 39 ALA HB% 1.0 1.8 5.0 2310 2016 A 11 GLY HAy A 14 TYR HB2 1.0 1.8 5.0 2311 2016 A 14 TYR HB3 A 11 GLY HAy 1.0 1.8 5.0 2312 2017 A 89 ASP H A 88 ALA HB% 1.0 1.8 5.0 2313 2018 A 84 ASP HBx A 84 ASP HBy 1.0 1.8 2.7 2314 2019 A 84 ASP H A 84 ASP HBy 1.0 1.8 5.0 2315 2020 A 100 LEU H A 99 VAL HB 1.0 1.8 5.0 2316 2021 A 99 VAL HB A 99 VAL H 1.0 1.8 5.0 2317 2022 A 54 PRO HDx A 53 PRO HDy 1.0 1.8 5.0 2318 2023 A 3 HIS HA A 3 HIS HBy 1.0 1.8 3.5 2319 2024 A 72 MET HE% A 68 VAL HA 1.0 1.8 6.0 2320 2025 A 36 GLU HBy A 35 GLU HB2 1.0 1.8 5.0 2321 2025 A 35 GLU HB3 A 36 GLU HBy 1.0 1.8 5.0 2322 2026 A 74 GLU H A 73 LEU H 1.0 1.8 5.0 2323 2027 A 73 LEU HA A 73 LEU H 1.0 1.8 3.5 2324 2028 A 74 GLU H A 73 LEU HDx% 1.0 1.8 5.0 2325 2029 A 73 LEU HDx% A 73 LEU HA 1.0 1.8 5.0 2326 2030 A 77 GLY H A 76 LEU HB2 1.0 1.8 5.0 2327 2030 A 77 GLY H A 76 LEU HB3 1.0 1.8 5.0 2328 2031 A 76 LEU H A 76 LEU HB2 1.0 1.8 2.7 2329 2031 A 76 LEU H A 76 LEU HB3 1.0 1.8 2.7 2330 2032 A 45 PHE HA A 46 ARG HG2 1.0 1.8 5.0 2331 2032 A 45 PHE HA A 46 ARG HG3 1.0 1.8 5.0 2332 2033 A 8 PHE HBy A 10 SER H 1.0 1.8 5.0 2333 2034 A 8 PHE HA A 9 ALA HB% 1.0 1.8 5.0 2334 2035 A 80 GLU H A 79 GLU HA 1.0 1.8 3.5 2335 2036 A 65 THR HB A 66 TYR HA 1.0 1.8 6.0 2336 2037 A 65 THR HA A 66 TYR HBy 1.0 1.8 5.0 2337 2038 A 56 GLN HGx A 58 PHE H 1.0 1.8 6.0 2338 2039 A 25 GLY HAy A 26 MET H 1.0 1.8 3.5 2339 2040 A 25 GLY HAy A 25 GLY HAx 1.0 1.8 2.7 2340 2041 A 95 VAL H A 95 VAL HB 1.0 1.8 5.0 2341 2042 A 95 VAL HA A 95 VAL HGx% 1.0 1.8 2.7 2342 2042 A 95 VAL HA A 95 VAL HGy% 1.0 1.8 2.7 2343 2043 A 95 VAL HA A 95 VAL HB 1.0 1.8 3.5 2344 2044 A 95 VAL H A 95 VAL HGx% 1.0 1.8 3.5 2345 2044 A 95 VAL H A 95 VAL HGy% 1.0 1.8 3.5 2346 2045 A 52 VAL HGx% A 51 GLY HAy 1.0 1.8 6.0 2347 2046 A 44 GLU HGy A 45 PHE HBy 1.0 1.8 6.0 2348 2047 A 29 ARG H A 30 MET HA 1.0 1.8 5.0 2349 2048 A 87 GLU HBy A 88 ALA H 1.0 1.8 5.0 2350 2049 A 82 ILE HD1% A 83 GLU HG2 1.0 1.8 6.0 2351 2049 A 82 ILE HD1% A 83 GLU HG3 1.0 1.8 6.0 2352 2050 A 88 ALA H A 87 GLU HG2 1.0 1.8 5.0 2353 2050 A 87 GLU HG3 A 88 ALA H 1.0 1.8 5.0 2354 2051 A 6 SER HA A 6 SER H 1.0 1.8 3.5 2355 2052 A 48 SER HA A 49 ASN HD2y 1.0 1.8 6.0 2356 2053 A 23 GLN HE2x A 23 GLN HE2y 1.0 1.8 2.7 2357 2054 A 40 GLY H A 41 ASP HB2 1.0 1.8 5.0 2358 2054 A 40 GLY H A 41 ASP HB3 1.0 1.8 5.0 2359 2055 A 13 THR H A 14 TYR HB2 1.0 1.8 5.0 2360 2055 A 14 TYR HB3 A 13 THR H 1.0 1.8 5.0 2361 2056 A 8 PHE HE% A 8 PHE H 1.0 1.8 5.0 2362 2057 A 11 GLY HAx A 7 GLU H 1.0 1.8 6.0 2363 2058 A 86 VAL H A 85 MET H 1.0 1.8 5.0 2364 2059 A 91 TYR HA A 92 GLN H 1.0 1.8 3.5 2365 2060 A 74 GLU H A 76 LEU HDx% 1.0 1.8 6.0 2366 2060 A 74 GLU H A 76 LEU HDy% 1.0 1.8 6.0 2367 2061 A 94 ALA HB% A 94 ALA H 1.0 1.8 3.5 2368 2062 A 59 TRP HE1 A 59 TRP HH2 1.0 1.8 5.0 2369 2063 A 102 ARG HA A 102 ARG H 1.0 1.8 3.5 2370 2064 A 102 ARG H A 101 GLY HA2 1.0 1.8 3.5 2371 2064 A 102 ARG H A 101 GLY HA3 1.0 1.8 3.5 2372 2065 A 100 LEU H A 100 LEU HBx 1.0 1.8 5.0 2373 2066 A 100 LEU H A 100 LEU HBy 1.0 1.8 3.5 2374 2067 A 70 TRP HE1 A 70 TRP HH2 1.0 1.8 5.0 2375 2068 A 25 GLY H A 26 MET HB2 1.0 1.8 5.0 2376 2068 A 26 MET HB3 A 25 GLY H 1.0 1.8 5.0 2377 2069 A 13 THR H A 10 SER HBx 1.0 1.8 6.0 2378 2070 A 33 ASP HA A 32 ASP H 1.0 1.8 5.0 2379 2071 A 94 ALA H A 93 GLY HA2 1.0 1.8 3.5 2380 2071 A 93 GLY HA3 A 94 ALA H 1.0 1.8 3.5 2381 2072 A 75 ILE H A 76 LEU HDx% 1.0 1.8 6.0 2382 2072 A 76 LEU HDy% A 75 ILE H 1.0 1.8 6.0 2383 2073 A 81 ASP HA A 80 GLU HG2 1.0 1.8 6.0 2384 2073 A 81 ASP HA A 80 GLU HG3 1.0 1.8 6.0 2385 2074 A 3 HIS HBy A 3 HIS HBx 1.0 1.8 2.7 2386 2075 A 102 ARG HBy A 102 ARG HD2 1.0 1.8 3.5 2387 2075 A 102 ARG HBy A 102 ARG HD3 1.0 1.8 3.5 2388 2076 A 92 GLN HA A 92 GLN H 1.0 1.8 3.5 2389 2077 A 98 ARG HA A 99 VAL H 1.0 1.8 3.5 2390 2078 A 85 MET HBx A 86 VAL HGx% 1.0 1.8 6.0 2391 2078 A 85 MET HBx A 86 VAL HGy% 1.0 1.8 6.0 2392 2079 A 59 TRP HA A 59 TRP HZ3 1.0 1.8 6.0 2393 2080 A 91 TYR HB2 A 92 GLN HG2 1.0 1.8 6.0 2394 2080 A 91 TYR HB3 A 92 GLN HG2 1.0 1.8 6.0 2395 2080 A 92 GLN HG3 A 91 TYR HB2 1.0 1.8 6.0 2396 2080 A 92 GLN HG3 A 91 TYR HB3 1.0 1.8 6.0 2397 2081 A 6 SER HA A 7 GLU H 1.0 1.8 3.5 2398 2082 A 4 MET HA A 7 GLU HG2 1.0 1.8 6.0 2399 2082 A 4 MET HA A 7 GLU HG3 1.0 1.8 6.0 2400 2083 A 82 ILE HA A 81 ASP HA 1.0 1.8 5.0 2401 2084 A 61 SER HA A 61 SER HB2 1.0 1.8 2.7 2402 2084 A 61 SER HA A 61 SER HB3 1.0 1.8 2.7 2403 2085 A 6 SER HA A 6 SER HB2 1.0 1.8 2.7 2404 2085 A 6 SER HA A 6 SER HB3 1.0 1.8 2.7 2405 2086 A 17 TYR HA A 20 ASP HB2 1.0 1.8 6.0 2406 2086 A 17 TYR HA A 20 ASP HB3 1.0 1.8 6.0 2407 2087 A 21 THR HA A 20 ASP HB2 1.0 1.8 5.0 2408 2087 A 21 THR HA A 20 ASP HB3 1.0 1.8 5.0 2409 2088 A 10 SER HA A 10 SER HBy 1.0 1.8 3.5 2410 2089 A 10 SER HBx A 10 SER HBy 1.0 1.8 2.7 2411 2090 A 10 SER HBy A 12 ASN HB2 1.0 1.8 6.0 2412 2090 A 12 ASN HB3 A 10 SER HBy 1.0 1.8 6.0 2413 2091 A 100 LEU HBx A 100 LEU HBy 1.0 1.8 2.7 2414 2092 A 8 PHE HD% A 9 ALA HB% 1.0 1.8 5.0 2415 2093 A 103 ALA HB% A 105 PRO HDx 1.0 1.8 6.0 2416 2094 A 103 ALA HB% A 104 LEU HA 1.0 1.8 5.0 2417 2095 A 15 ALA HB% A 16 LEU HDx% 1.0 1.8 6.0 2418 2096 A 102 ARG HD2 A 102 ARG HG2 1.0 1.8 2.7 2419 2096 A 102 ARG HD3 A 102 ARG HG2 1.0 1.8 2.7 2420 2096 A 102 ARG HG3 A 102 ARG HD2 1.0 1.8 2.7 2421 2096 A 102 ARG HG3 A 102 ARG HD3 1.0 1.8 2.7 2422 2097 A 65 THR HG2% A 64 ARG HA 1.0 1.8 6.0 2423 2098 A 54 PRO HDy A 53 PRO HGx 1.0 1.8 5.0 2424 2099 A 96 ALA HB% A 96 ALA HA 1.0 1.8 2.7 2425 2100 A 96 ALA H A 96 ALA HA 1.0 1.8 3.5 2426 2101 A 59 TRP HB2 A 61 SER HB2 1.0 1.8 5.0 2427 2101 A 59 TRP HB3 A 61 SER HB2 1.0 1.8 5.0 2428 2101 A 61 SER HB3 A 59 TRP HB2 1.0 1.8 5.0 2429 2101 A 59 TRP HB3 A 61 SER HB3 1.0 1.8 5.0 2430 2102 A 44 GLU H A 43 GLY HAx 1.0 1.8 2.7 2431 2103 A 43 GLY H A 43 GLY HAx 1.0 1.8 2.7 2432 2104 A 100 LEU H A 100 LEU HA 1.0 1.8 3.5 2433 2105 A 96 ALA H A 95 VAL HA 1.0 1.8 3.5 2434 2106 A 3 HIS HA A 3 HIS HBx 1.0 1.8 3.5 2435 2107 A 47 GLN H A 48 SER HA 1.0 1.8 5.0 2436 2108 A 61 SER H A 61 SER HB2 1.0 1.8 2.7 2437 2108 A 61 SER H A 61 SER HB3 1.0 1.8 2.7 2438 2109 A 6 SER H A 6 SER HB2 1.0 1.8 2.7 2439 2109 A 6 SER HB3 A 6 SER H 1.0 1.8 2.7 2440 2110 A 51 GLY H A 49 ASN HBy 1.0 1.8 6.0 2441 2111 A 94 ALA HB% A 94 ALA HA 1.0 1.8 2.7 2442 2112 A 100 LEU HA A 99 VAL HGx% 1.0 1.8 5.0 2443 2112 A 99 VAL HGy% A 100 LEU HA 1.0 1.8 5.0 2444 2113 A 18 VAL HGx% A 22 LEU HB2 1.0 1.8 6.0 2445 2113 A 18 VAL HGx% A 22 LEU HB3 1.0 1.8 6.0 2446 2114 A 55 VAL HGy% A 54 PRO HA 1.0 1.8 6.0 2447 2115 A 32 ASP HBx A 31 LEU HB2 1.0 1.8 5.0 2448 2115 A 32 ASP HBx A 31 LEU HB3 1.0 1.8 5.0 2449 2116 A 102 ARG HBx A 101 GLY HA2 1.0 1.8 6.0 2450 2116 A 102 ARG HBx A 101 GLY HA3 1.0 1.8 6.0 2451 2117 A 43 GLY HAy A 44 GLU HB2 1.0 1.8 5.0 2452 2117 A 43 GLY HAy A 44 GLU HB3 1.0 1.8 5.0 2453 2118 A 94 ALA HA A 93 GLY HA2 1.0 1.8 5.0 2454 2118 A 93 GLY HA3 A 94 ALA HA 1.0 1.8 5.0 2455 2119 A 8 PHE HBy A 9 ALA HA 1.0 1.8 6.0 2456 2120 A 89 ASP HA A 88 ALA HB% 1.0 1.8 5.0 2457 2121 A 42 GLU HA A 41 ASP HA 1.0 1.8 5.0 2458 2122 A 42 GLU HA A 43 GLY HAy 1.0 1.8 5.0 2459 2123 A 45 PHE HD% A 47 GLN HA 1.0 1.8 6.0 2460 2124 A 40 GLY HAy A 41 ASP HA 1.0 1.8 5.0 2461 2125 A 98 ARG HA A 99 VAL HGx% 1.0 1.8 5.0 2462 2125 A 98 ARG HA A 99 VAL HGy% 1.0 1.8 5.0 2463 2126 A 105 PRO HDx A 104 LEU HA 1.0 1.8 5.0 2464 2127 A 69 HIS HA A 70 TRP HA 1.0 1.8 5.0 2465 2128 A 90 GLU HA A 91 TYR HB2 1.0 1.8 6.0 2466 2128 A 90 GLU HA A 91 TYR HB3 1.0 1.8 6.0 2467 2129 A 26 MET HA A 27 ARG HB2 1.0 1.8 5.0 2468 2129 A 27 ARG HB3 A 26 MET HA 1.0 1.8 5.0 2469 2130 A 91 TYR HA A 90 GLU HB2 1.0 1.8 5.0 2470 2130 A 90 GLU HB3 A 91 TYR HA 1.0 1.8 5.0 2471 2131 A 96 ALA HB% A 95 VAL HA 1.0 1.8 5.0 2472 2132 A 59 TRP HE1 A 59 TRP HZ2 1.0 1.8 2.7 2473 2133 A 70 TRP HZ2 A 70 TRP HE1 1.0 1.8 2.7 2474 2134 A 72 MET HE% A 69 HIS HD2 1.0 1.8 6.0 2475 2135 A 66 TYR HE% A 69 HIS H 1.0 1.8 6.0 2476 2136 A 91 TYR HE% A 91 TYR HB2 1.0 1.8 5.0 2477 2136 A 91 TYR HB3 A 91 TYR HE% 1.0 1.8 5.0 2478 2137 A 30 MET HE% A 34 TYR HE% 1.0 1.8 6.0 2479 2138 A 59 TRP HZ3 A 59 TRP HB2 1.0 1.8 5.0 2480 2138 A 59 TRP HB3 A 59 TRP HZ3 1.0 1.8 5.0 2481 2139 A 59 TRP HZ2 A 59 TRP HH2 1.0 1.8 2.7 2482 2140 A 70 TRP HZ2 A 70 TRP HH2 1.0 1.8 2.7 2483 2141 A 8 PHE HD% A 8 PHE HE% 1.0 1.8 2.7 2484 2142 A 91 TYR HD% A 91 TYR HE% 1.0 1.8 2.7 2485 2143 A 62 THR HG2% A 61 SER HB2 1.0 1.8 6.0 2486 2143 A 62 THR HG2% A 61 SER HB3 1.0 1.8 6.0 2487 2144 A 62 THR HG2% A 61 SER HB2 1.0 1.8 6.0 2488 2144 A 62 THR HG2% A 61 SER HB3 1.0 1.8 6.0 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 1 GLY C A 2 SER N A 2 SER CA A 2 SER C 1.0 -116.8 -51.7 PHI 2 2 A 2 SER N A 2 SER CA A 2 SER C A 3 HIS N 1.0 108.1 147.9 PSI 3 3 A 3 HIS C A 4 MET N A 4 MET CA A 4 MET C 1.0 -152.4 -35.8 PHI 4 4 A 4 MET N A 4 MET CA A 4 MET C A 5 ARG N 1.0 122.3 188.4 PSI 5 5 A 4 MET C A 5 ARG N A 5 ARG CA A 5 ARG C 1.0 -65.5 -45.5 PHI 6 6 A 5 ARG N A 5 ARG CA A 5 ARG C A 6 SER N 1.0 -54.0 -30.6 PSI 7 7 A 5 ARG C A 6 SER N A 6 SER CA A 6 SER C 1.0 -91.7 -45.8 PHI 8 8 A 6 SER N A 6 SER CA A 6 SER C A 7 GLU N 1.0 -55.6 11.5 PSI 9 9 A 6 SER C A 7 GLU N A 7 GLU CA A 7 GLU C 1.0 -109.0 -53.0 PHI 10 10 A 7 GLU N A 7 GLU CA A 7 GLU C A 8 PHE N 1.0 -74.0 14.0 PSI 11 11 A 8 PHE C A 9 ALA N A 9 ALA CA A 9 ALA C 1.0 -83.0 -47.0 PHI 12 12 A 9 ALA N A 9 ALA CA A 9 ALA C A 10 SER N 1.0 -46.0 -6.0 PSI 13 13 A 9 ALA C A 10 SER N A 10 SER CA A 10 SER C 1.0 -133.0 -70.8 PHI 14 14 A 10 SER N A 10 SER CA A 10 SER C A 11 GLY N 1.0 -35.4 40.4 PSI 15 15 A 11 GLY C A 12 ASN N A 12 ASN CA A 12 ASN C 1.0 -77.4 -57.4 PHI 16 16 A 12 ASN N A 12 ASN CA A 12 ASN C A 13 THR N 1.0 -49.1 -28.4 PSI 17 17 A 12 ASN C A 13 THR N A 13 THR CA A 13 THR C 1.0 -78.5 -52.3 PHI 18 18 A 13 THR N A 13 THR CA A 13 THR C A 14 TYR N 1.0 -57.2 -25.7 PSI 19 19 A 13 THR C A 14 TYR N A 14 TYR CA A 14 TYR C 1.0 -78.9 -47.9 PHI 20 20 A 14 TYR N A 14 TYR CA A 14 TYR C A 15 ALA N 1.0 -56.4 -33.8 PSI 21 21 A 14 TYR C A 15 ALA N A 15 ALA CA A 15 ALA C 1.0 -72.3 -52.1 PHI 22 22 A 15 ALA N A 15 ALA CA A 15 ALA C A 16 LEU N 1.0 -66.2 -10.6 PSI 23 23 A 15 ALA C A 16 LEU N A 16 LEU CA A 16 LEU C 1.0 -73.7 -53.5 PHI 24 24 A 16 LEU N A 16 LEU CA A 16 LEU C A 17 TYR N 1.0 -52.8 -27.2 PSI 25 25 A 16 LEU C A 17 TYR N A 17 TYR CA A 17 TYR C 1.0 -80.1 -55.1 PHI 26 26 A 17 TYR N A 17 TYR CA A 17 TYR C A 18 VAL N 1.0 -53.9 -24.6 PSI 27 27 A 17 TYR C A 18 VAL N A 18 VAL CA A 18 VAL C 1.0 -74.7 -54.7 PHI 28 28 A 18 VAL N A 18 VAL CA A 18 VAL C A 19 ARG N 1.0 -58.3 -28.9 PSI 29 29 A 18 VAL C A 19 ARG N A 19 ARG CA A 19 ARG C 1.0 -70.0 -50.0 PHI 30 30 A 19 ARG N A 19 ARG CA A 19 ARG C A 20 ASP N 1.0 -62.8 -14.1 PSI 31 31 A 19 ARG C A 20 ASP N A 20 ASP CA A 20 ASP C 1.0 -85.8 -46.1 PHI 32 32 A 20 ASP N A 20 ASP CA A 20 ASP C A 21 THR N 1.0 -56.8 -12.0 PSI 33 33 A 22 LEU C A 23 GLN N A 23 GLN CA A 23 GLN C 1.0 -118.5 -66.7 PHI 34 34 A 23 GLN N A 23 GLN CA A 23 GLN C A 24 PRO N 1.0 89.0 174.5 PSI 35 35 A 27 ARG C A 28 VAL N A 28 VAL CA A 28 VAL C 1.0 -152.4 -109.2 PHI 36 36 A 28 VAL N A 28 VAL CA A 28 VAL C A 29 ARG N 1.0 147.7 178.6 PSI 37 37 A 28 VAL C A 29 ARG N A 29 ARG CA A 29 ARG C 1.0 -171.2 -102.8 PHI 38 38 A 29 ARG N A 29 ARG CA A 29 ARG C A 30 MET N 1.0 106.0 170.6 PSI 39 39 A 29 ARG C A 30 MET N A 30 MET CA A 30 MET C 1.0 -116.5 -44.6 PHI 40 40 A 30 MET N A 30 MET CA A 30 MET C A 31 LEU N 1.0 105.5 149.5 PSI 41 41 A 31 LEU C A 32 ASP N A 32 ASP CA A 32 ASP C 1.0 -161.7 -115.1 PHI 42 42 A 32 ASP N A 32 ASP CA A 32 ASP C A 33 ASP N 1.0 134.1 182.9 PSI 43 43 A 32 ASP C A 33 ASP N A 33 ASP CA A 33 ASP C 1.0 -122.0 -38.1 PHI 44 44 A 33 ASP N A 33 ASP CA A 33 ASP C A 34 TYR N 1.0 115.7 150.7 PSI 45 45 A 33 ASP C A 34 TYR N A 34 TYR CA A 34 TYR C 1.0 -166.3 -37.7 PHI 46 46 A 34 TYR N A 34 TYR CA A 34 TYR C A 35 GLU N 1.0 92.6 174.5 PSI 47 47 A 36 GLU C A 37 ILE N A 37 ILE CA A 37 ILE C 1.0 -168.6 -58.6 PHI 48 48 A 37 ILE N A 37 ILE CA A 37 ILE C A 38 SER N 1.0 69.0 185.0 PSI 49 49 A 38 SER C A 39 ALA N A 39 ALA CA A 39 ALA C 1.0 -95.5 -34.3 PHI 50 50 A 39 ALA N A 39 ALA CA A 39 ALA C A 40 GLY N 1.0 123.7 149.8 PSI 51 51 A 39 ALA C A 40 GLY N A 40 GLY CA A 40 GLY C 1.0 84.6 105.0 PHI 52 52 A 40 GLY N A 40 GLY CA A 40 GLY C A 41 ASP N 1.0 -28.6 -0.3 PSI 53 53 A 40 GLY C A 41 ASP N A 41 ASP CA A 41 ASP C 1.0 -93.0 -49.0 PHI 54 54 A 41 ASP N A 41 ASP CA A 41 ASP C A 42 GLU N 1.0 131.0 155.0 PSI 55 55 A 42 GLU C A 43 GLY N A 43 GLY CA A 43 GLY C 1.0 -195.0 -111.0 PHI 56 56 A 43 GLY N A 43 GLY CA A 43 GLY C A 44 GLU N 1.0 132.0 188.0 PSI 57 57 A 43 GLY C A 44 GLU N A 44 GLU CA A 44 GLU C 1.0 -151.1 -79.5 PHI 58 58 A 44 GLU N A 44 GLU CA A 44 GLU C A 45 PHE N 1.0 111.0 169.3 PSI 59 59 A 44 GLU C A 45 PHE N A 45 PHE CA A 45 PHE C 1.0 -103.6 -54.7 PHI 60 60 A 45 PHE N A 45 PHE CA A 45 PHE C A 46 ARG N 1.0 115.8 147.2 PSI 61 61 A 46 ARG C A 47 GLN N A 47 GLN CA A 47 GLN C 1.0 -209.0 -89.0 PHI 62 62 A 47 GLN N A 47 GLN CA A 47 GLN C A 48 SER N 1.0 150.0 170.0 PSI 63 63 A 45 PHE C A 46 ARG N A 46 ARG CA A 46 ARG C 1.0 -119.5 -72.9 PHI 64 64 A 46 ARG N A 46 ARG CA A 46 ARG C A 47 GLN N 1.0 -56.2 -13.4 PSI 65 65 A 47 GLN C A 48 SER N A 48 SER CA A 48 SER C 1.0 -167.7 -94.9 PHI 66 66 A 48 SER N A 48 SER CA A 48 SER C A 49 ASN N 1.0 129.9 182.1 PSI 67 67 A 48 SER C A 49 ASN N A 49 ASN CA A 49 ASN C 1.0 -173.6 -84.1 PHI 68 68 A 49 ASN N A 49 ASN CA A 49 ASN C A 50 ASN N 1.0 107.0 186.3 PSI 69 69 A 51 GLY C A 52 VAL N A 52 VAL CA A 52 VAL C 1.0 -169.5 -60.4 PHI 70 70 A 52 VAL N A 52 VAL CA A 52 VAL C A 53 PRO N 1.0 80.3 204.7 PSI 71 71 A 54 PRO C A 55 VAL N A 55 VAL CA A 55 VAL C 1.0 -129.0 -61.0 PHI 72 72 A 55 VAL N A 55 VAL CA A 55 VAL C A 56 GLN N 1.0 115.0 139.0 PSI 73 73 A 55 VAL C A 56 GLN N A 56 GLN CA A 56 GLN C 1.0 -106.2 -51.8 PHI 74 74 A 56 GLN N A 56 GLN CA A 56 GLN C A 57 VAL N 1.0 108.4 150.2 PSI 75 75 A 56 GLN C A 57 VAL N A 57 VAL CA A 57 VAL C 1.0 -155.7 -93.1 PHI 76 76 A 57 VAL N A 57 VAL CA A 57 VAL C A 58 PHE N 1.0 100.8 173.1 PSI 77 77 A 57 VAL C A 58 PHE N A 58 PHE CA A 58 PHE C 1.0 -147.8 -47.6 PHI 78 78 A 58 PHE N A 58 PHE CA A 58 PHE C A 59 TRP N 1.0 97.5 144.2 PSI 79 79 A 59 TRP C A 60 GLU N A 60 GLU CA A 60 GLU C 1.0 -83.1 -43.9 PHI 80 80 A 60 GLU N A 60 GLU CA A 60 GLU C A 61 SER N 1.0 -51.0 -13.1 PSI 81 81 A 60 GLU C A 61 SER N A 61 SER CA A 61 SER C 1.0 -93.6 -54.8 PHI 82 82 A 61 SER N A 61 SER CA A 61 SER C A 62 THR N 1.0 -53.7 4.2 PSI 83 83 A 63 GLY C A 64 ARG N A 64 ARG CA A 64 ARG C 1.0 -165.4 -78.7 PHI 84 84 A 64 ARG N A 64 ARG CA A 64 ARG C A 65 THR N 1.0 143.0 176.1 PSI 85 85 A 64 ARG C A 65 THR N A 65 THR CA A 65 THR C 1.0 -159.1 -62.6 PHI 86 86 A 65 THR N A 65 THR CA A 65 THR C A 66 TYR N 1.0 85.0 181.1 PSI 87 87 A 65 THR C A 66 TYR N A 66 TYR CA A 66 TYR C 1.0 -182.0 -114.6 PHI 88 88 A 66 TYR N A 66 TYR CA A 66 TYR C A 67 TRP N 1.0 111.7 172.0 PSI 89 89 A 66 TYR C A 67 TRP N A 67 TRP CA A 67 TRP C 1.0 -136.0 -76.0 PHI 90 90 A 67 TRP N A 67 TRP CA A 67 TRP C A 68 VAL N 1.0 117.0 145.0 PSI 91 91 A 67 TRP C A 68 VAL N A 68 VAL CA A 68 VAL C 1.0 -170.5 -81.9 PHI 92 92 A 68 VAL N A 68 VAL CA A 68 VAL C A 69 HIS N 1.0 122.4 194.5 PSI 93 93 A 68 VAL C A 69 HIS N A 69 HIS CA A 69 HIS C 1.0 -134.6 -44.6 PHI 94 94 A 69 HIS N A 69 HIS CA A 69 HIS C A 70 TRP N 1.0 137.5 179.4 PSI 95 95 A 69 HIS C A 70 TRP N A 70 TRP CA A 70 TRP C 1.0 -92.4 -40.0 PHI 96 96 A 70 TRP N A 70 TRP CA A 70 TRP C A 71 HIS N 1.0 -52.8 -23.5 PSI 97 97 A 70 TRP C A 71 HIS N A 71 HIS CA A 71 HIS C 1.0 -120.9 -35.3 PHI 98 98 A 71 HIS N A 71 HIS CA A 71 HIS C A 72 MET N 1.0 -62.2 18.4 PSI 99 99 A 72 MET C A 73 LEU N A 73 LEU CA A 73 LEU C 1.0 -156.5 -65.6 PHI 100 100 A 73 LEU N A 73 LEU CA A 73 LEU C A 74 GLU N 1.0 121.1 171.7 PSI 101 101 A 73 LEU C A 74 GLU N A 74 GLU CA A 74 GLU C 1.0 -168.3 -86.0 PHI 102 102 A 74 GLU N A 74 GLU CA A 74 GLU C A 75 ILE N 1.0 89.0 187.1 PSI 103 103 A 74 GLU C A 75 ILE N A 75 ILE CA A 75 ILE C 1.0 -107.0 -51.9 PHI 104 104 A 75 ILE N A 75 ILE CA A 75 ILE C A 76 LEU N 1.0 109.5 146.5 PSI stop_ save_ save_CNS/XPLOR_dipolar_coupling_4 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_4 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 13 THR N A 13 THR H 1.0 . . . 2 2 A 15 ALA N A 15 ALA H 1.0 . . . 3 3 A 16 LEU N A 16 LEU H 1.0 . . . 4 4 A 17 TYR N A 17 TYR H 1.0 . . . 5 5 A 18 VAL N A 18 VAL H 1.0 . . . 6 6 A 19 ARG N A 19 ARG H 1.0 . . . 7 7 A 26 MET N A 26 MET H 1.0 . . . 8 8 A 27 ARG N A 27 ARG H 1.0 . . . 9 9 A 28 VAL N A 28 VAL H 1.0 . . . 10 10 A 29 ARG N A 29 ARG H 1.0 . . . 11 11 A 30 MET N A 30 MET H 1.0 . . . 12 12 A 31 LEU N A 31 LEU H 1.0 . . . 13 13 A 32 ASP N A 32 ASP H 1.0 . . . 14 14 A 33 ASP N A 33 ASP H 1.0 . . . 15 15 A 34 TYR N A 34 TYR H 1.0 . . . 16 16 A 35 GLU N A 35 GLU H 1.0 . . . 17 17 A 36 GLU N A 36 GLU H 1.0 . . . 18 18 A 37 ILE N A 37 ILE H 1.0 . . . 19 19 A 38 SER N A 38 SER H 1.0 . . . 20 20 A 40 GLY N A 40 GLY H 1.0 . . . 21 21 A 41 ASP N A 41 ASP H 1.0 . . . 22 22 A 42 GLU N A 42 GLU H 1.0 . . . 23 23 A 43 GLY N A 43 GLY H 1.0 . . . 24 24 A 44 GLU N A 44 GLU H 1.0 . . . 25 25 A 45 PHE N A 45 PHE H 1.0 . . . 26 26 A 46 ARG N A 46 ARG H 1.0 . . . 27 27 A 47 GLN N A 47 GLN H 1.0 . . . 28 28 A 48 SER N A 48 SER H 1.0 . . . 29 29 A 49 ASN N A 49 ASN H 1.0 . . . 30 30 A 51 GLY N A 51 GLY H 1.0 . . . 31 31 A 52 VAL N A 52 VAL H 1.0 . . . 32 32 A 55 VAL N A 55 VAL H 1.0 . . . 33 33 A 56 GLN N A 56 GLN H 1.0 . . . 34 34 A 57 VAL N A 57 VAL H 1.0 . . . 35 35 A 58 PHE N A 58 PHE H 1.0 . . . 36 36 A 59 TRP N A 59 TRP H 1.0 . . . 37 37 A 60 GLU N A 60 GLU H 1.0 . . . 38 38 A 61 SER N A 61 SER H 1.0 . . . 39 39 A 62 THR N A 62 THR H 1.0 . . . 40 40 A 63 GLY N A 63 GLY H 1.0 . . . 41 41 A 64 ARG N A 64 ARG H 1.0 . . . 42 42 A 65 THR N A 65 THR H 1.0 . . . 43 43 A 66 TYR N A 66 TYR H 1.0 . . . 44 44 A 67 TRP N A 67 TRP H 1.0 . . . 45 45 A 68 VAL N A 68 VAL H 1.0 . . . 46 46 A 69 HIS N A 69 HIS H 1.0 . . . 47 47 A 70 TRP N A 70 TRP H 1.0 . . . 48 48 A 71 HIS N A 71 HIS H 1.0 . . . 49 49 A 72 MET N A 72 MET H 1.0 . . . 50 50 A 74 GLU N A 74 GLU H 1.0 . . . 51 51 A 75 ILE N A 75 ILE H 1.0 . . . stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 3521.7 2 1H 6202.51 3 1H 4862.29 stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 15N 1419.34 2 1H 6202.51 3 1H 2509.79 stop_ save_ save_spectral_peak_list_3 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_3 _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 3522.1 2 1H 7002.8 3 1H 6202.5 stop_ save_