data_nef_c16277_2kij 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 -4 GLY start . false 2 A -3 SER middle . . 3 A -2 PHE middle . . 4 A -1 THR middle . . 5 A 0 MET middle . . 6 A 1 SER middle . . 7 A 2 GLU middle . . 8 A 3 ALA middle . . 9 A 4 LEU middle . . 10 A 5 ALA middle . . 11 A 6 LYS middle . . 12 A 7 LEU middle . . 13 A 8 ILE middle . . 14 A 9 SER middle . . 15 A 10 LEU middle . . 16 A 11 GLN middle . . 17 A 12 ALA middle . . 18 A 13 THR middle . . 19 A 14 GLU middle . . 20 A 15 ALA middle . . 21 A 16 THR middle . . 22 A 17 ILE middle . . 23 A 18 VAL middle . . 24 A 19 THR middle . . 25 A 20 LEU middle . . 26 A 21 ASP middle . . 27 A 22 SER middle . . 28 A 23 ASP middle . . 29 A 24 ASN middle . . 30 A 25 ILE middle . . 31 A 26 LEU middle . . 32 A 27 LEU middle . . 33 A 28 SER middle . . 34 A 29 GLU middle . . 35 A 30 GLU middle . . 36 A 31 GLN middle . . 37 A 32 VAL middle . . 38 A 33 ASP middle . . 39 A 34 VAL middle . . 40 A 35 GLU middle . . 41 A 36 LEU middle . . 42 A 37 VAL middle . . 43 A 38 GLN middle . . 44 A 39 ARG middle . . 45 A 40 GLY middle . false 46 A 41 ASP middle . . 47 A 42 ILE middle . . 48 A 43 ILE middle . . 49 A 44 LYS middle . . 50 A 45 VAL middle . . 51 A 46 VAL middle . . 52 A 47 PRO middle . false 53 A 48 GLY middle . false 54 A 49 GLY middle . false 55 A 50 LYS middle . . 56 A 51 PHE middle . . 57 A 52 PRO middle . false 58 A 53 VAL middle . . 59 A 54 ASP middle . . 60 A 55 GLY middle . false 61 A 56 ARG middle . . 62 A 57 VAL middle . . 63 A 58 ILE middle . . 64 A 59 GLU middle . . 65 A 60 GLY middle . false 66 A 61 HIS middle . . 67 A 62 SER middle . . 68 A 63 MET middle . . 69 A 64 VAL middle . . 70 A 65 ASP middle . . 71 A 66 GLU middle . . 72 A 67 SER middle . . 73 A 68 LEU middle . . 74 A 69 ILE middle . . 75 A 70 THR middle . . 76 A 71 GLY middle . false 77 A 72 GLU middle . . 78 A 73 ALA middle . . 79 A 74 MET middle . . 80 A 75 PRO middle . false 81 A 76 VAL middle . . 82 A 77 ALA middle . . 83 A 78 LYS middle . . 84 A 79 LYS middle . . 85 A 80 PRO middle . false 86 A 81 GLY middle . false 87 A 82 SER middle . . 88 A 83 THR middle . . 89 A 84 VAL middle . . 90 A 85 ILE middle . . 91 A 86 ALA middle . . 92 A 87 GLY middle . false 93 A 88 SER middle . . 94 A 89 ILE middle . . 95 A 90 ASN middle . . 96 A 91 GLN middle . . 97 A 92 ASN middle . . 98 A 93 GLY middle . false 99 A 94 SER middle . . 100 A 95 LEU middle . . 101 A 96 LEU middle . . 102 A 97 ILE middle . . 103 A 98 CYS middle . . 104 A 99 ALA middle . . 105 A 100 THR middle . . 106 A 101 HIS middle . . 107 A 102 VAL middle . . 108 A 103 GLY middle . false 109 A 104 ALA middle . . 110 A 105 ASP middle . . 111 A 106 THR middle . . 112 A 107 THR middle . . 113 A 108 LEU middle . . 114 A 109 SER middle . . 115 A 110 GLN middle . . 116 A 111 ILE middle . . 117 A 112 VAL middle . . 118 A 113 LYS middle . . 119 A 114 LEU middle . . 120 A 115 VAL middle . . 121 A 116 GLU middle . . 122 A 117 GLU middle . . 123 A 118 ALA middle . . 124 A 119 GLN end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 SER H H 1 8.193 0.020 A 1 SER HA H 1 4.172 0.020 A 1 SER HBy H 1 3.914 0.020 A 1 SER HBx H 1 3.796 0.020 A 1 SER C C 13 174.617 0.400 A 1 SER CA C 13 58.978 0.400 A 1 SER CB C 13 63.227 0.400 A 1 SER N N 15 117.300 0.400 A 2 GLU C C 13 178.316 0.400 A 3 ALA H H 1 8.106 0.020 A 3 ALA HA H 1 3.929 0.020 A 3 ALA HB% H 1 1.295 0.020 A 3 ALA C C 13 179.482 0.400 A 3 ALA CA C 13 54.265 0.400 A 3 ALA CB C 13 17.999 0.400 A 3 ALA N N 15 121.667 0.400 A 4 LEU H H 1 7.795 0.020 A 4 LEU HA H 1 3.933 0.020 A 4 LEU HBx H 1 1.437 0.020 A 4 LEU HBy H 1 1.732 0.020 A 4 LEU HDx% H 1 0.822 0.020 A 4 LEU HDy% H 1 0.854 0.020 A 4 LEU HG H 1 1.551 0.020 A 4 LEU C C 13 177.610 0.400 A 4 LEU CA C 13 57.318 0.400 A 4 LEU CB C 13 41.216 0.400 A 4 LEU CD1 C 13 25.036 0.400 A 4 LEU CD2 C 13 23.879 0.400 A 4 LEU CG C 13 26.606 0.400 A 4 LEU N N 15 118.712 0.400 A 5 ALA H H 1 7.899 0.020 A 5 ALA HA H 1 3.912 0.020 A 5 ALA HB% H 1 1.321 0.020 A 5 ALA C C 13 180.516 0.400 A 5 ALA CA C 13 54.689 0.400 A 5 ALA CB C 13 17.579 0.400 A 5 ALA N N 15 120.093 0.400 A 6 LYS H H 1 7.729 0.020 A 6 LYS HA H 1 3.944 0.020 A 6 LYS HBx H 1 1.740 0.020 A 6 LYS HBy H 1 1.740 0.020 A 6 LYS HDx H 1 1.500 0.020 A 6 LYS HDy H 1 1.500 0.020 A 6 LYS HEx H 1 2.773 0.020 A 6 LYS HEy H 1 2.773 0.020 A 6 LYS HGy H 1 1.384 0.020 A 6 LYS HGx H 1 1.316 0.020 A 6 LYS C C 13 178.732 0.400 A 6 LYS CA C 13 58.268 0.400 A 6 LYS CB C 13 31.645 0.400 A 6 LYS CD C 13 28.595 0.400 A 6 LYS CE C 13 41.716 0.400 A 6 LYS CG C 13 24.502 0.400 A 6 LYS N N 15 117.655 0.400 A 7 LEU H H 1 7.691 0.020 A 7 LEU HA H 1 3.891 0.020 A 7 LEU HBx H 1 1.340 0.020 A 7 LEU HBy H 1 1.770 0.020 A 7 LEU HDx% H 1 0.713 0.020 A 7 LEU HDy% H 1 0.674 0.020 A 7 LEU HG H 1 1.629 0.020 A 7 LEU C C 13 178.732 0.400 A 7 LEU CA C 13 57.663 0.400 A 7 LEU CB C 13 41.903 0.400 A 7 LEU CD1 C 13 25.172 0.400 A 7 LEU CD2 C 13 22.976 0.400 A 7 LEU CG C 13 26.352 0.400 A 7 LEU N N 15 120.319 0.400 A 8 ILE H H 1 8.202 0.020 A 8 ILE HA H 1 3.601 0.020 A 8 ILE HB H 1 1.749 0.020 A 8 ILE HD1% H 1 0.682 0.020 A 8 ILE HG1y H 1 1.481 0.020 A 8 ILE HG1x H 1 1.089 0.020 A 8 ILE HG2% H 1 0.767 0.020 A 8 ILE C C 13 178.867 0.400 A 8 ILE CA C 13 64.110 0.400 A 8 ILE CB C 13 37.664 0.400 A 8 ILE CD1 C 13 12.808 0.400 A 8 ILE CG1 C 13 28.823 0.400 A 8 ILE CG2 C 13 16.977 0.400 A 8 ILE N N 15 117.477 0.400 A 9 SER H H 1 7.619 0.020 A 9 SER HA H 1 4.247 0.020 A 9 SER HBy H 1 3.916 0.020 A 9 SER HBx H 1 3.860 0.020 A 9 SER C C 13 174.401 0.400 A 9 SER CA C 13 60.172 0.400 A 9 SER CB C 13 62.994 0.400 A 9 SER N N 15 115.519 0.400 A 10 LEU H H 1 7.503 0.020 A 10 LEU HA H 1 4.082 0.020 A 10 LEU HBy H 1 1.864 0.020 A 10 LEU HBx H 1 1.527 0.020 A 10 LEU HDx% H 1 0.783 0.020 A 10 LEU HDy% H 1 0.737 0.020 A 10 LEU HG H 1 1.851 0.020 A 10 LEU C C 13 177.150 0.400 A 10 LEU CA C 13 54.993 0.400 A 10 LEU CB C 13 41.414 0.400 A 10 LEU CD1 C 13 23.282 0.400 A 10 LEU CD2 C 13 21.873 0.400 A 10 LEU CG C 13 25.311 0.400 A 10 LEU N N 15 120.898 0.400 A 11 GLN H H 1 7.292 0.020 A 11 GLN HA H 1 4.033 0.020 A 11 GLN HBy H 1 1.990 0.020 A 11 GLN HBx H 1 1.947 0.020 A 11 GLN HE2y H 1 7.284 0.020 A 11 GLN HE2x H 1 6.692 0.020 A 11 GLN HGy H 1 2.325 0.020 A 11 GLN HGx H 1 2.209 0.020 A 11 GLN C C 13 175.784 0.400 A 11 GLN CA C 13 55.923 0.400 A 11 GLN CB C 13 28.584 0.400 A 11 GLN CG C 13 33.590 0.400 A 11 GLN N N 15 117.254 0.400 A 11 GLN NE2 N 15 110.691 0.400 A 12 ALA H H 1 8.578 0.020 A 12 ALA HA H 1 4.430 0.020 A 12 ALA HB% H 1 1.416 0.020 A 12 ALA C C 13 176.327 0.400 A 12 ALA CA C 13 51.651 0.400 A 12 ALA CB C 13 19.610 0.400 A 12 ALA N N 15 126.746 0.400 A 13 THR H H 1 8.553 0.020 A 13 THR HA H 1 4.344 0.020 A 13 THR HB H 1 4.301 0.020 A 13 THR HG2% H 1 1.094 0.020 A 13 THR C C 13 174.805 0.400 A 13 THR CA C 13 61.751 0.400 A 13 THR CB C 13 69.120 0.400 A 13 THR CG2 C 13 21.580 0.400 A 13 THR N N 15 109.604 0.400 A 14 GLU H H 1 7.746 0.020 A 14 GLU HA H 1 5.076 0.020 A 14 GLU HBx H 1 1.741 0.020 A 14 GLU HBy H 1 1.875 0.020 A 14 GLU HGx H 1 1.979 0.020 A 14 GLU HGy H 1 1.979 0.020 A 14 GLU C C 13 173.722 0.400 A 14 GLU CA C 13 54.249 0.400 A 14 GLU CB C 13 33.301 0.400 A 14 GLU CG C 13 35.492 0.400 A 14 GLU N N 15 121.194 0.400 A 15 ALA H H 1 9.090 0.020 A 15 ALA HA H 1 4.601 0.020 A 15 ALA HB% H 1 1.090 0.020 A 15 ALA C C 13 174.561 0.400 A 15 ALA CA C 13 49.820 0.400 A 15 ALA CB C 13 23.263 0.400 A 15 ALA N N 15 121.910 0.400 A 16 THR H H 1 9.011 0.020 A 16 THR HA H 1 4.746 0.020 A 16 THR HB H 1 4.257 0.020 A 16 THR HG2% H 1 0.971 0.020 A 16 THR C C 13 173.530 0.400 A 16 THR CA C 13 61.463 0.400 A 16 THR CB C 13 68.513 0.400 A 16 THR CG2 C 13 20.703 0.400 A 16 THR N N 15 118.977 0.400 A 17 ILE H H 1 8.913 0.020 A 17 ILE HA H 1 4.763 0.020 A 17 ILE HB H 1 1.609 0.020 A 17 ILE HD1% H 1 0.670 0.020 A 17 ILE HG1y H 1 1.450 0.020 A 17 ILE HG1x H 1 0.957 0.020 A 17 ILE HG2% H 1 0.788 0.020 A 17 ILE C C 13 176.441 0.400 A 17 ILE CA C 13 59.488 0.400 A 17 ILE CB C 13 39.009 0.400 A 17 ILE CD1 C 13 13.421 0.400 A 17 ILE CG1 C 13 27.540 0.400 A 17 ILE CG2 C 13 16.886 0.400 A 17 ILE N N 15 127.267 0.400 A 18 VAL H H 1 8.743 0.020 A 18 VAL HA H 1 5.016 0.020 A 18 VAL HB H 1 1.969 0.020 A 18 VAL HGx% H 1 0.769 0.020 A 18 VAL HGy% H 1 0.601 0.020 A 18 VAL C C 13 174.367 0.400 A 18 VAL CA C 13 58.900 0.400 A 18 VAL CB C 13 34.019 0.400 A 18 VAL CG1 C 13 22.384 0.400 A 18 VAL CG2 C 13 20.610 0.400 A 18 VAL N N 15 123.365 0.400 A 19 THR H H 1 7.922 0.020 A 19 THR HA H 1 4.496 0.020 A 19 THR HB H 1 3.973 0.020 A 19 THR HG2% H 1 1.013 0.020 A 19 THR C C 13 173.099 0.400 A 19 THR CA C 13 60.649 0.400 A 19 THR CB C 13 70.692 0.400 A 19 THR CG2 C 13 20.858 0.400 A 19 THR N N 15 114.064 0.400 A 20 LEU H H 1 8.636 0.020 A 20 LEU HA H 1 5.088 0.020 A 20 LEU HBy H 1 1.563 0.020 A 20 LEU HBx H 1 1.339 0.020 A 20 LEU HDx% H 1 0.667 0.020 A 20 LEU HDy% H 1 0.510 0.020 A 20 LEU HG H 1 1.343 0.020 A 20 LEU C C 13 176.983 0.400 A 20 LEU CA C 13 53.076 0.400 A 20 LEU CB C 13 45.484 0.400 A 20 LEU CD1 C 13 25.235 0.400 A 20 LEU CD2 C 13 23.387 0.400 A 20 LEU CG C 13 26.660 0.400 A 20 LEU N N 15 124.451 0.400 A 21 ASP H H 1 8.562 0.020 A 21 ASP HA H 1 4.639 0.020 A 21 ASP HBx H 1 2.562 0.020 A 21 ASP HBy H 1 3.195 0.020 A 21 ASP C C 13 178.315 0.400 A 21 ASP CA C 13 51.794 0.400 A 21 ASP CB C 13 41.179 0.400 A 21 ASP N N 15 121.488 0.400 A 22 SER H H 1 8.228 0.020 A 22 SER HA H 1 4.055 0.020 A 22 SER HBx H 1 3.776 0.020 A 22 SER HBy H 1 3.832 0.020 A 22 SER C C 13 174.432 0.400 A 22 SER CA C 13 60.729 0.400 A 22 SER CB C 13 62.495 0.400 A 22 SER N N 15 113.018 0.400 A 23 ASP H H 1 8.276 0.020 A 23 ASP HA H 1 4.700 0.020 A 23 ASP HBx H 1 2.481 0.020 A 23 ASP HBy H 1 2.757 0.020 A 23 ASP C C 13 174.563 0.400 A 23 ASP CA C 13 54.062 0.400 A 23 ASP CB C 13 41.230 0.400 A 23 ASP N N 15 121.848 0.400 A 24 ASN H H 1 8.119 0.020 A 24 ASN HA H 1 4.047 0.020 A 24 ASN HBy H 1 2.940 0.020 A 24 ASN HBx H 1 2.880 0.020 A 24 ASN HD2x H 1 6.547 0.020 A 24 ASN HD2y H 1 7.509 0.020 A 24 ASN C C 13 172.970 0.400 A 24 ASN CA C 13 54.566 0.400 A 24 ASN CB C 13 35.739 0.400 A 24 ASN N N 15 113.177 0.400 A 24 ASN ND2 N 15 112.004 0.400 A 25 ILE H H 1 8.113 0.020 A 25 ILE HA H 1 3.873 0.020 A 25 ILE HB H 1 1.937 0.020 A 25 ILE HD1% H 1 0.670 0.020 A 25 ILE HG1y H 1 1.285 0.020 A 25 ILE HG1x H 1 1.085 0.020 A 25 ILE HG2% H 1 0.716 0.020 A 25 ILE C C 13 175.983 0.400 A 25 ILE CA C 13 59.831 0.400 A 25 ILE CB C 13 36.029 0.400 A 25 ILE CD1 C 13 10.890 0.400 A 25 ILE CG1 C 13 27.374 0.400 A 25 ILE CG2 C 13 16.934 0.400 A 25 ILE N N 15 120.772 0.400 A 26 LEU H H 1 8.075 0.020 A 26 LEU HA H 1 4.103 0.020 A 26 LEU HBx H 1 1.441 0.020 A 26 LEU HBy H 1 1.441 0.020 A 26 LEU HDx% H 1 0.775 0.020 A 26 LEU HDy% H 1 0.639 0.020 A 26 LEU HG H 1 1.433 0.020 A 26 LEU C C 13 176.561 0.400 A 26 LEU CA C 13 56.837 0.400 A 26 LEU CB C 13 41.673 0.400 A 26 LEU CD1 C 13 25.609 0.400 A 26 LEU CD2 C 13 24.870 0.400 A 26 LEU CG C 13 27.504 0.400 A 26 LEU N N 15 126.920 0.400 A 27 LEU H H 1 9.056 0.020 A 27 LEU HA H 1 4.312 0.020 A 27 LEU HBy H 1 1.558 0.020 A 27 LEU HBx H 1 1.288 0.020 A 27 LEU HDx% H 1 0.679 0.020 A 27 LEU HDy% H 1 0.692 0.020 A 27 LEU HG H 1 1.504 0.020 A 27 LEU C C 13 176.983 0.400 A 27 LEU CA C 13 55.173 0.400 A 27 LEU CB C 13 43.238 0.400 A 27 LEU CD1 C 13 24.792 0.400 A 27 LEU CD2 C 13 22.546 0.400 A 27 LEU CG C 13 26.092 0.400 A 27 LEU N N 15 126.858 0.400 A 28 SER H H 1 7.511 0.020 A 28 SER HA H 1 4.475 0.020 A 28 SER HBy H 1 3.746 0.020 A 28 SER HBx H 1 3.639 0.020 A 28 SER C C 13 171.326 0.400 A 28 SER CA C 13 57.377 0.400 A 28 SER CB C 13 65.081 0.400 A 28 SER N N 15 111.266 0.400 A 29 GLU H H 1 8.152 0.020 A 29 GLU HA H 1 4.989 0.020 A 29 GLU HBx H 1 1.743 0.020 A 29 GLU HBy H 1 1.743 0.020 A 29 GLU HGx H 1 1.886 0.020 A 29 GLU HGy H 1 1.886 0.020 A 29 GLU C C 13 174.337 0.400 A 29 GLU CA C 13 54.956 0.400 A 29 GLU CB C 13 32.691 0.400 A 29 GLU CG C 13 35.523 0.400 A 29 GLU N N 15 118.697 0.400 A 30 GLU H H 1 8.715 0.020 A 30 GLU HA H 1 4.565 0.020 A 30 GLU HBy H 1 1.834 0.020 A 30 GLU HBx H 1 1.732 0.020 A 30 GLU HGx H 1 2.016 0.020 A 30 GLU HGy H 1 2.016 0.020 A 30 GLU C C 13 173.442 0.400 A 30 GLU CA C 13 54.770 0.400 A 30 GLU CB C 13 33.236 0.400 A 30 GLU CG C 13 35.273 0.400 A 30 GLU N N 15 122.456 0.400 A 31 GLN H H 1 8.533 0.020 A 31 GLN HA H 1 4.969 0.020 A 31 GLN HBy H 1 1.904 0.020 A 31 GLN HBx H 1 1.743 0.020 A 31 GLN HE2y H 1 7.676 0.020 A 31 GLN HE2x H 1 6.885 0.020 A 31 GLN HGy H 1 2.190 0.020 A 31 GLN HGx H 1 2.139 0.020 A 31 GLN C C 13 175.920 0.400 A 31 GLN CA C 13 54.772 0.400 A 31 GLN CB C 13 29.826 0.400 A 31 GLN CG C 13 34.213 0.400 A 31 GLN N N 15 122.401 0.400 A 31 GLN NE2 N 15 111.878 0.400 A 32 VAL H H 1 9.081 0.020 A 32 VAL HA H 1 4.577 0.020 A 32 VAL HB H 1 2.014 0.020 A 32 VAL HGx% H 1 0.744 0.020 A 32 VAL HGy% H 1 0.635 0.020 A 32 VAL C C 13 174.369 0.400 A 32 VAL CA C 13 58.826 0.400 A 32 VAL CB C 13 35.966 0.400 A 32 VAL CG1 C 13 21.089 0.400 A 32 VAL CG2 C 13 18.913 0.400 A 32 VAL N N 15 120.128 0.400 A 33 ASP H H 1 8.147 0.020 A 33 ASP HA H 1 4.567 0.020 A 33 ASP HBy H 1 2.719 0.020 A 33 ASP HBx H 1 2.462 0.020 A 33 ASP C C 13 177.893 0.400 A 33 ASP CA C 13 54.807 0.400 A 33 ASP CB C 13 41.235 0.400 A 33 ASP N N 15 123.050 0.400 A 34 VAL H H 1 7.784 0.020 A 34 VAL HA H 1 3.549 0.020 A 34 VAL HB H 1 1.576 0.020 A 34 VAL HGx% H 1 0.820 0.020 A 34 VAL HGy% H 1 0.836 0.020 A 34 VAL C C 13 176.438 0.400 A 34 VAL CA C 13 65.097 0.400 A 34 VAL CB C 13 31.677 0.400 A 34 VAL CG1 C 13 22.105 0.400 A 34 VAL CG2 C 13 19.992 0.400 A 34 VAL N N 15 124.142 0.400 A 35 GLU H H 1 8.913 0.020 A 35 GLU HA H 1 4.000 0.020 A 35 GLU HBy H 1 1.911 0.020 A 35 GLU HBx H 1 1.857 0.020 A 35 GLU HGx H 1 2.187 0.020 A 35 GLU HGy H 1 2.187 0.020 A 35 GLU C C 13 176.823 0.400 A 35 GLU CA C 13 58.305 0.400 A 35 GLU CB C 13 28.514 0.400 A 35 GLU CG C 13 36.303 0.400 A 35 GLU N N 15 120.229 0.400 A 36 LEU H H 1 7.966 0.020 A 36 LEU HA H 1 4.195 0.020 A 36 LEU HBy H 1 1.738 0.020 A 36 LEU HBx H 1 1.506 0.020 A 36 LEU HDx% H 1 0.878 0.020 A 36 LEU HDy% H 1 0.734 0.020 A 36 LEU HG H 1 1.501 0.020 A 36 LEU C C 13 177.865 0.400 A 36 LEU CA C 13 54.472 0.400 A 36 LEU CB C 13 41.439 0.400 A 36 LEU CD1 C 13 25.046 0.400 A 36 LEU CD2 C 13 22.323 0.400 A 36 LEU CG C 13 27.302 0.400 A 36 LEU N N 15 117.624 0.400 A 37 VAL H H 1 7.290 0.020 A 37 VAL HA H 1 3.602 0.020 A 37 VAL HB H 1 1.948 0.020 A 37 VAL HGx% H 1 0.774 0.020 A 37 VAL HGy% H 1 0.802 0.020 A 37 VAL C C 13 174.243 0.400 A 37 VAL CA C 13 63.589 0.400 A 37 VAL CB C 13 30.999 0.400 A 37 VAL CG1 C 13 23.273 0.400 A 37 VAL CG2 C 13 22.439 0.400 A 37 VAL N N 15 121.513 0.400 A 38 GLN H H 1 9.100 0.020 A 38 GLN HA H 1 4.480 0.020 A 38 GLN HBy H 1 1.935 0.020 A 38 GLN HBx H 1 1.677 0.020 A 38 GLN HE2y H 1 7.383 0.020 A 38 GLN HE2x H 1 6.680 0.020 A 38 GLN HGy H 1 2.284 0.020 A 38 GLN HGx H 1 2.182 0.020 A 38 GLN C C 13 175.447 0.400 A 38 GLN CA C 13 52.998 0.400 A 38 GLN CB C 13 31.386 0.400 A 38 GLN CG C 13 33.499 0.400 A 38 GLN N N 15 126.333 0.400 A 38 GLN NE2 N 15 113.094 0.400 A 39 ARG H H 1 8.509 0.020 A 39 ARG HA H 1 3.377 0.020 A 39 ARG HBx H 1 1.521 0.020 A 39 ARG HBy H 1 1.521 0.020 A 39 ARG HDy H 1 3.093 0.020 A 39 ARG HDx H 1 3.068 0.020 A 39 ARG HGy H 1 1.543 0.020 A 39 ARG HGx H 1 1.197 0.020 A 39 ARG C C 13 177.151 0.400 A 39 ARG CA C 13 58.084 0.400 A 39 ARG CB C 13 28.919 0.400 A 39 ARG CD C 13 43.278 0.400 A 39 ARG CG C 13 27.294 0.400 A 39 ARG N N 15 120.157 0.400 A 40 GLY H H 1 8.982 0.020 A 40 GLY HAy H 1 4.266 0.020 A 40 GLY HAx H 1 3.368 0.020 A 40 GLY C C 13 173.717 0.400 A 40 GLY CA C 13 44.719 0.400 A 40 GLY N N 15 113.854 0.400 A 41 ASP H H 1 7.819 0.020 A 41 ASP HA H 1 4.395 0.020 A 41 ASP HBy H 1 2.697 0.020 A 41 ASP HBx H 1 2.326 0.020 A 41 ASP C C 13 174.239 0.400 A 41 ASP CA C 13 55.365 0.400 A 41 ASP CB C 13 41.172 0.400 A 41 ASP N N 15 121.677 0.400 A 42 ILE H H 1 8.814 0.020 A 42 ILE HA H 1 4.904 0.020 A 42 ILE HB H 1 2.048 0.020 A 42 ILE HD1% H 1 0.650 0.020 A 42 ILE HG1y H 1 1.438 0.020 A 42 ILE HG1x H 1 1.252 0.020 A 42 ILE HG2% H 1 0.579 0.020 A 42 ILE C C 13 174.716 0.400 A 42 ILE CA C 13 58.528 0.400 A 42 ILE CB C 13 35.211 0.400 A 42 ILE CD1 C 13 10.657 0.400 A 42 ILE CG1 C 13 26.802 0.400 A 42 ILE CG2 C 13 18.354 0.400 A 42 ILE N N 15 121.108 0.400 A 43 ILE H H 1 9.128 0.020 A 43 ILE HA H 1 5.253 0.020 A 43 ILE HB H 1 1.620 0.020 A 43 ILE HD1% H 1 0.652 0.020 A 43 ILE HG1x H 1 1.162 0.020 A 43 ILE HG1y H 1 1.162 0.020 A 43 ILE HG2% H 1 0.774 0.020 A 43 ILE C C 13 174.909 0.400 A 43 ILE CA C 13 56.778 0.400 A 43 ILE CB C 13 40.586 0.400 A 43 ILE CD1 C 13 14.057 0.400 A 43 ILE CG1 C 13 27.746 0.400 A 43 ILE CG2 C 13 18.656 0.400 A 43 ILE N N 15 125.495 0.400 A 44 LYS H H 1 8.278 0.020 A 44 LYS HA H 1 5.054 0.020 A 44 LYS HBx H 1 1.332 0.020 A 44 LYS HBy H 1 1.332 0.020 A 44 LYS HDx H 1 1.361 0.020 A 44 LYS HDy H 1 1.361 0.020 A 44 LYS HEy H 1 2.602 0.020 A 44 LYS HEx H 1 2.542 0.020 A 44 LYS HGx H 1 1.101 0.020 A 44 LYS HGy H 1 1.101 0.020 A 44 LYS C C 13 175.210 0.400 A 44 LYS CA C 13 53.976 0.400 A 44 LYS CB C 13 35.667 0.400 A 44 LYS CD C 13 29.508 0.400 A 44 LYS CE C 13 41.180 0.400 A 44 LYS CG C 13 24.174 0.400 A 44 LYS N N 15 126.213 0.400 A 45 VAL H H 1 8.851 0.020 A 45 VAL HA H 1 4.244 0.020 A 45 VAL HB H 1 1.419 0.020 A 45 VAL HGx% H 1 0.656 0.020 A 45 VAL HGy% H 1 -0.012 0.020 A 45 VAL C C 13 174.501 0.400 A 45 VAL CA C 13 60.926 0.400 A 45 VAL CB C 13 33.156 0.400 A 45 VAL CG1 C 13 21.006 0.400 A 45 VAL CG2 C 13 19.739 0.400 A 45 VAL N N 15 129.163 0.400 A 46 VAL H H 1 7.632 0.020 A 46 VAL HA H 1 4.468 0.020 A 46 VAL HB H 1 2.370 0.020 A 46 VAL HGx% H 1 0.842 0.020 A 46 VAL HGy% H 1 0.659 0.020 A 46 VAL C C 13 176.667 0.400 A 46 VAL CA C 13 59.831 0.400 A 46 VAL CB C 13 29.168 0.400 A 46 VAL CG1 C 13 21.450 0.400 A 46 VAL CG2 C 13 16.486 0.400 A 46 VAL N N 15 119.280 0.400 A 47 PRO HA H 1 3.690 0.020 A 47 PRO HBx H 1 2.170 0.020 A 47 PRO HBy H 1 2.170 0.020 A 47 PRO HGx H 1 1.665 0.020 A 47 PRO HGy H 1 1.665 0.020 A 47 PRO C C 13 177.100 0.400 A 47 PRO CA C 13 64.691 0.400 A 47 PRO CB C 13 31.578 0.400 A 47 PRO CG C 13 30.460 0.400 A 48 GLY H H 1 8.262 0.020 A 48 GLY HAy H 1 4.058 0.020 A 48 GLY HAx H 1 3.695 0.020 A 48 GLY C C 13 174.170 0.400 A 48 GLY CA C 13 45.168 0.400 A 48 GLY N N 15 115.153 0.400 A 49 GLY H H 1 8.255 0.020 A 49 GLY HAy H 1 3.940 0.020 A 49 GLY HAx H 1 3.359 0.020 A 49 GLY C C 13 171.377 0.400 A 49 GLY CA C 13 44.359 0.400 A 49 GLY N N 15 107.843 0.400 A 50 LYS H H 1 8.143 0.020 A 50 LYS HA H 1 4.854 0.020 A 50 LYS HBx H 1 1.543 0.020 A 50 LYS HBy H 1 1.543 0.020 A 50 LYS HDx H 1 1.549 0.020 A 50 LYS HDy H 1 1.549 0.020 A 50 LYS HEx H 1 2.852 0.020 A 50 LYS HEy H 1 2.852 0.020 A 50 LYS HGy H 1 1.370 0.020 A 50 LYS HGx H 1 1.265 0.020 A 50 LYS C C 13 177.635 0.400 A 50 LYS CA C 13 54.095 0.400 A 50 LYS CB C 13 33.627 0.400 A 50 LYS CD C 13 29.042 0.400 A 50 LYS CE C 13 41.571 0.400 A 50 LYS CG C 13 24.573 0.400 A 50 LYS N N 15 119.299 0.400 A 51 PHE H H 1 8.286 0.020 A 51 PHE HA H 1 4.276 0.020 A 51 PHE HBy H 1 3.155 0.020 A 51 PHE HBx H 1 2.831 0.020 A 51 PHE HD1 H 1 7.246 0.020 A 51 PHE HD2 H 1 7.246 0.020 A 51 PHE HE1 H 1 6.928 0.020 A 51 PHE HE2 H 1 6.928 0.020 A 51 PHE C C 13 175.743 0.400 A 51 PHE CA C 13 57.162 0.400 A 51 PHE CB C 13 38.285 0.400 A 51 PHE N N 15 122.123 0.400 A 52 PRO HA H 1 4.304 0.020 A 52 PRO HBy H 1 2.175 0.020 A 52 PRO HBx H 1 1.833 0.020 A 52 PRO HDy H 1 3.718 0.020 A 52 PRO HDx H 1 3.516 0.020 A 52 PRO HGy H 1 1.945 0.020 A 52 PRO HGx H 1 1.889 0.020 A 52 PRO C C 13 174.237 0.400 A 52 PRO CA C 13 63.699 0.400 A 52 PRO CB C 13 31.788 0.400 A 52 PRO CD C 13 50.534 0.400 A 52 PRO CG C 13 26.938 0.400 A 53 VAL H H 1 7.002 0.020 A 53 VAL HA H 1 4.437 0.020 A 53 VAL HB H 1 2.614 0.020 A 53 VAL HGx% H 1 0.774 0.020 A 53 VAL HGy% H 1 0.445 0.020 A 53 VAL C C 13 173.201 0.400 A 53 VAL CA C 13 58.028 0.400 A 53 VAL CB C 13 34.537 0.400 A 53 VAL CG2 C 13 17.810 0.400 A 53 VAL N N 15 107.090 0.400 A 54 ASP H H 1 7.650 0.020 A 54 ASP HA H 1 5.098 0.020 A 54 ASP HBy H 1 2.849 0.020 A 54 ASP HBx H 1 2.688 0.020 A 54 ASP C C 13 177.285 0.400 A 54 ASP CA C 13 52.938 0.400 A 54 ASP CB C 13 40.764 0.400 A 54 ASP N N 15 117.968 0.400 A 55 GLY H H 1 8.236 0.020 A 55 GLY HAy H 1 4.865 0.020 A 55 GLY HAx H 1 3.888 0.020 A 55 GLY C C 13 170.908 0.400 A 55 GLY CA C 13 46.738 0.400 A 55 GLY N N 15 107.374 0.400 A 56 ARG H H 1 8.218 0.020 A 56 ARG HA H 1 5.078 0.020 A 56 ARG HBx H 1 1.489 0.020 A 56 ARG HBy H 1 1.489 0.020 A 56 ARG HDx H 1 3.002 0.020 A 56 ARG HDy H 1 3.002 0.020 A 56 ARG HGy H 1 1.333 0.020 A 56 ARG HGx H 1 1.283 0.020 A 56 ARG C C 13 175.749 0.400 A 56 ARG CA C 13 52.891 0.400 A 56 ARG CB C 13 33.283 0.400 A 56 ARG CD C 13 42.699 0.400 A 56 ARG CG C 13 26.894 0.400 A 56 ARG N N 15 119.242 0.400 A 57 VAL H H 1 9.151 0.020 A 57 VAL HA H 1 3.779 0.020 A 57 VAL HB H 1 2.161 0.020 A 57 VAL HGx% H 1 0.534 0.020 A 57 VAL HGy% H 1 0.589 0.020 A 57 VAL C C 13 172.917 0.400 A 57 VAL CA C 13 63.680 0.400 A 57 VAL CB C 13 31.296 0.400 A 57 VAL CG1 C 13 22.566 0.400 A 57 VAL CG2 C 13 22.669 0.400 A 57 VAL N N 15 125.295 0.400 A 58 ILE H H 1 9.298 0.020 A 58 ILE HA H 1 4.410 0.020 A 58 ILE HB H 1 1.758 0.020 A 58 ILE HD1% H 1 0.658 0.020 A 58 ILE HG1y H 1 1.190 0.020 A 58 ILE HG1x H 1 0.784 0.020 A 58 ILE HG2% H 1 0.760 0.020 A 58 ILE C C 13 174.432 0.400 A 58 ILE CA C 13 60.867 0.400 A 58 ILE CB C 13 39.244 0.400 A 58 ILE CD1 C 13 13.402 0.400 A 58 ILE CG1 C 13 26.779 0.400 A 58 ILE CG2 C 13 17.467 0.400 A 58 ILE N N 15 125.065 0.400 A 59 GLU H H 1 7.486 0.020 A 59 GLU HA H 1 4.292 0.020 A 59 GLU HBy H 1 1.876 0.020 A 59 GLU HBx H 1 1.698 0.020 A 59 GLU HGy H 1 2.142 0.020 A 59 GLU HGx H 1 2.101 0.020 A 59 GLU C C 13 173.266 0.400 A 59 GLU CA C 13 56.345 0.400 A 59 GLU CB C 13 33.559 0.400 A 59 GLU CG C 13 35.678 0.400 A 59 GLU N N 15 121.487 0.400 A 60 GLY H H 1 8.282 0.020 A 60 GLY HAx H 1 3.616 0.020 A 60 GLY HAy H 1 4.624 0.020 A 60 GLY C C 13 169.877 0.400 A 60 GLY CA C 13 44.007 0.400 A 60 GLY N N 15 114.110 0.400 A 61 HIS H H 1 7.318 0.020 A 61 HIS HA H 1 5.095 0.020 A 61 HIS HBy H 1 3.059 0.020 A 61 HIS HBx H 1 2.849 0.020 A 61 HIS HD2 H 1 6.956 0.020 A 61 HIS HE1 H 1 6.678 0.020 A 61 HIS C C 13 174.816 0.400 A 61 HIS CA C 13 54.430 0.400 A 61 HIS CB C 13 32.447 0.400 A 61 HIS N N 15 112.363 0.400 A 62 SER H H 1 8.250 0.020 A 62 SER HA H 1 4.515 0.020 A 62 SER HBy H 1 3.705 0.020 A 62 SER HBx H 1 3.254 0.020 A 62 SER C C 13 173.245 0.400 A 62 SER CA C 13 55.773 0.400 A 62 SER CB C 13 64.727 0.400 A 62 SER N N 15 114.275 0.400 A 63 MET H H 1 8.465 0.020 A 63 MET HA H 1 5.198 0.020 A 63 MET HBx H 1 1.632 0.020 A 63 MET HBy H 1 2.041 0.020 A 63 MET HE% H 1 1.869 0.020 A 63 MET HGx H 1 2.505 0.020 A 63 MET HGy H 1 2.595 0.020 A 63 MET C C 13 174.981 0.400 A 63 MET CA C 13 53.169 0.400 A 63 MET CB C 13 32.824 0.400 A 63 MET CE C 13 16.326 0.400 A 63 MET CG C 13 31.672 0.400 A 63 MET N N 15 121.909 0.400 A 64 VAL H H 1 8.960 0.020 A 64 VAL HA H 1 4.776 0.020 A 64 VAL HB H 1 1.805 0.020 A 64 VAL HGx% H 1 1.009 0.020 A 64 VAL HGy% H 1 0.981 0.020 A 64 VAL C C 13 174.306 0.400 A 64 VAL CA C 13 60.910 0.400 A 64 VAL CB C 13 35.541 0.400 A 64 VAL CG1 C 13 23.754 0.400 A 64 VAL CG2 C 13 22.140 0.400 A 64 VAL N N 15 118.843 0.400 A 65 ASP H H 1 9.008 0.020 A 65 ASP HA H 1 4.806 0.020 A 65 ASP HBy H 1 2.973 0.020 A 65 ASP HBx H 1 2.537 0.020 A 65 ASP C C 13 176.762 0.400 A 65 ASP CA C 13 52.760 0.400 A 65 ASP CB C 13 41.257 0.400 A 65 ASP N N 15 124.642 0.400 A 66 GLU H H 1 9.149 0.020 A 66 GLU HA H 1 4.241 0.020 A 66 GLU HBx H 1 1.838 0.020 A 66 GLU HBy H 1 1.838 0.020 A 66 GLU HGx H 1 2.237 0.020 A 66 GLU HGy H 1 2.237 0.020 A 66 GLU C C 13 177.018 0.400 A 66 GLU CA C 13 55.148 0.400 A 66 GLU CB C 13 29.581 0.400 A 66 GLU CG C 13 36.959 0.400 A 66 GLU N N 15 128.381 0.400 A 67 SER H H 1 8.498 0.020 A 67 SER HA H 1 4.012 0.020 A 67 SER HBy H 1 3.702 0.020 A 67 SER HBx H 1 3.418 0.020 A 67 SER C C 13 176.954 0.400 A 67 SER CA C 13 62.561 0.400 A 67 SER CB C 13 70.725 0.400 A 67 SER N N 15 119.224 0.400 A 68 LEU H H 1 8.257 0.020 A 68 LEU HA H 1 4.018 0.020 A 68 LEU HBy H 1 1.566 0.020 A 68 LEU HBx H 1 1.343 0.020 A 68 LEU HDx% H 1 0.778 0.020 A 68 LEU HDy% H 1 0.727 0.020 A 68 LEU HG H 1 1.550 0.020 A 68 LEU C C 13 175.859 0.400 A 68 LEU CA C 13 56.851 0.400 A 68 LEU CB C 13 41.072 0.400 A 68 LEU CD1 C 13 25.116 0.400 A 68 LEU CD2 C 13 23.273 0.400 A 68 LEU CG C 13 26.799 0.400 A 68 LEU N N 15 122.731 0.400 A 69 ILE H H 1 7.631 0.020 A 69 ILE HA H 1 3.969 0.020 A 69 ILE HB H 1 1.612 0.020 A 69 ILE HD1% H 1 0.638 0.020 A 69 ILE HG1y H 1 1.221 0.020 A 69 ILE HG1x H 1 0.975 0.020 A 69 ILE HG2% H 1 0.713 0.020 A 69 ILE C C 13 176.444 0.400 A 69 ILE CA C 13 61.703 0.400 A 69 ILE CB C 13 38.926 0.400 A 69 ILE CD1 C 13 12.675 0.400 A 69 ILE CG1 C 13 27.477 0.400 A 69 ILE CG2 C 13 17.738 0.400 A 69 ILE N N 15 114.638 0.400 A 70 THR H H 1 8.155 0.020 A 70 THR HA H 1 4.258 0.020 A 70 THR HB H 1 4.319 0.020 A 70 THR HG2% H 1 1.031 0.020 A 70 THR C C 13 176.334 0.400 A 70 THR CA C 13 61.160 0.400 A 70 THR CB C 13 70.754 0.400 A 70 THR CG2 C 13 21.008 0.400 A 70 THR N N 15 106.618 0.400 A 71 GLY H H 1 7.612 0.020 A 71 GLY HAy H 1 4.061 0.020 A 71 GLY HAx H 1 3.667 0.020 A 71 GLY C C 13 173.612 0.400 A 71 GLY CA C 13 44.982 0.400 A 71 GLY N N 15 109.820 0.400 A 72 GLU H H 1 7.497 0.020 A 72 GLU HA H 1 4.044 0.020 A 72 GLU HBy H 1 1.776 0.020 A 72 GLU HBx H 1 1.673 0.020 A 72 GLU HGy H 1 2.204 0.020 A 72 GLU HGx H 1 2.143 0.020 A 72 GLU C C 13 175.598 0.400 A 72 GLU CA C 13 55.960 0.400 A 72 GLU CB C 13 28.875 0.400 A 72 GLU CG C 13 35.008 0.400 A 72 GLU N N 15 122.359 0.400 A 73 ALA H H 1 8.375 0.020 A 73 ALA HA H 1 3.925 0.020 A 73 ALA HB% H 1 1.301 0.020 A 73 ALA C C 13 178.767 0.400 A 73 ALA CA C 13 54.054 0.400 A 73 ALA CB C 13 19.277 0.400 A 73 ALA N N 15 128.862 0.400 A 74 MET H H 1 8.150 0.020 A 74 MET HA H 1 4.730 0.020 A 74 MET HBy H 1 2.613 0.020 A 74 MET HBx H 1 2.464 0.020 A 74 MET HGx H 1 1.932 0.020 A 74 MET HGy H 1 1.932 0.020 A 74 MET C C 13 174.357 0.400 A 74 MET CA C 13 52.596 0.400 A 74 MET CB C 13 31.844 0.400 A 74 MET CG C 13 31.296 0.400 A 74 MET N N 15 117.777 0.400 A 75 PRO HA H 1 4.515 0.020 A 75 PRO HBx H 1 1.907 0.020 A 75 PRO HBy H 1 1.907 0.020 A 75 PRO HDy H 1 3.838 0.020 A 75 PRO HDx H 1 3.551 0.020 A 75 PRO HGx H 1 1.909 0.020 A 75 PRO HGy H 1 1.909 0.020 A 75 PRO C C 13 175.108 0.400 A 75 PRO CA C 13 62.402 0.400 A 75 PRO CB C 13 32.100 0.400 A 75 PRO CD C 13 50.276 0.400 A 75 PRO CG C 13 27.363 0.400 A 76 VAL H H 1 9.128 0.020 A 76 VAL HA H 1 4.120 0.020 A 76 VAL HB H 1 1.815 0.020 A 76 VAL HGx% H 1 0.843 0.020 A 76 VAL HGy% H 1 0.885 0.020 A 76 VAL C C 13 175.672 0.400 A 76 VAL CA C 13 60.836 0.400 A 76 VAL CB C 13 34.430 0.400 A 76 VAL CG1 C 13 21.448 0.400 A 76 VAL CG2 C 13 20.149 0.400 A 76 VAL N N 15 121.714 0.400 A 77 ALA H H 1 8.660 0.020 A 77 ALA HA H 1 4.814 0.020 A 77 ALA HB% H 1 1.296 0.020 A 77 ALA C C 13 177.408 0.400 A 77 ALA CA C 13 52.901 0.400 A 77 ALA CB C 13 19.017 0.400 A 77 ALA N N 15 129.769 0.400 A 78 LYS H H 1 8.847 0.020 A 78 LYS HA H 1 4.670 0.020 A 78 LYS HBy H 1 1.691 0.020 A 78 LYS HBx H 1 1.284 0.020 A 78 LYS HDx H 1 1.637 0.020 A 78 LYS HDy H 1 1.637 0.020 A 78 LYS HEx H 1 2.689 0.020 A 78 LYS HEy H 1 2.689 0.020 A 78 LYS HGx H 1 0.992 0.020 A 78 LYS HGy H 1 1.258 0.020 A 78 LYS C C 13 174.251 0.400 A 78 LYS CA C 13 52.564 0.400 A 78 LYS CB C 13 34.500 0.400 A 78 LYS CD C 13 28.678 0.400 A 78 LYS CE C 13 41.329 0.400 A 78 LYS CG C 13 25.513 0.400 A 78 LYS N N 15 120.310 0.400 A 79 LYS H H 1 8.362 0.020 A 79 LYS HA H 1 4.996 0.020 A 79 LYS HBx H 1 1.667 0.020 A 79 LYS HBy H 1 1.667 0.020 A 79 LYS HDx H 1 1.536 0.020 A 79 LYS HDy H 1 1.536 0.020 A 79 LYS HEx H 1 2.839 0.020 A 79 LYS HEy H 1 2.839 0.020 A 79 LYS HGy H 1 1.165 0.020 A 79 LYS HGx H 1 1.029 0.020 A 79 LYS C C 13 172.165 0.400 A 79 LYS CA C 13 53.334 0.400 A 79 LYS CB C 13 32.701 0.400 A 79 LYS CD C 13 29.134 0.400 A 79 LYS CE C 13 41.790 0.400 A 79 LYS CG C 13 22.286 0.400 A 79 LYS N N 15 121.408 0.400 A 80 PRO HA H 1 3.683 0.020 A 80 PRO HBx H 1 2.159 0.020 A 80 PRO HBy H 1 2.159 0.020 A 80 PRO HDx H 1 4.130 0.020 A 80 PRO HDy H 1 4.130 0.020 A 80 PRO HGy H 1 1.858 0.020 A 80 PRO HGx H 1 1.598 0.020 A 80 PRO C C 13 176.773 0.400 A 80 PRO CA C 13 64.530 0.400 A 80 PRO CB C 13 30.511 0.400 A 80 PRO CD C 13 55.868 0.400 A 80 PRO CG C 13 30.946 0.400 A 81 GLY H H 1 9.008 0.020 A 81 GLY HAy H 1 4.478 0.020 A 81 GLY HAx H 1 3.441 0.020 A 81 GLY C C 13 175.142 0.400 A 81 GLY CA C 13 44.641 0.400 A 81 GLY N N 15 114.048 0.400 A 82 SER H H 1 8.810 0.020 A 82 SER HA H 1 4.487 0.020 A 82 SER HBy H 1 4.016 0.020 A 82 SER HBx H 1 3.666 0.020 A 82 SER C C 13 172.748 0.400 A 82 SER CA C 13 59.950 0.400 A 82 SER CB C 13 64.604 0.400 A 82 SER N N 15 118.040 0.400 A 83 THR H H 1 8.806 0.020 A 83 THR HA H 1 4.924 0.020 A 83 THR HB H 1 4.105 0.020 A 83 THR HG2% H 1 1.021 0.020 A 83 THR C C 13 173.811 0.400 A 83 THR CA C 13 61.147 0.400 A 83 THR CB C 13 69.511 0.400 A 83 THR CG2 C 13 21.549 0.400 A 83 THR N N 15 116.759 0.400 A 84 VAL H H 1 8.601 0.020 A 84 VAL HA H 1 4.439 0.020 A 84 VAL HB H 1 0.584 0.020 A 84 VAL HGx% H 1 0.075 0.020 A 84 VAL HGy% H 1 0.242 0.020 A 84 VAL C C 13 175.099 0.400 A 84 VAL CA C 13 57.970 0.400 A 84 VAL CB C 13 33.961 0.400 A 84 VAL CG1 C 13 21.201 0.400 A 84 VAL CG2 C 13 18.437 0.400 A 84 VAL N N 15 115.418 0.400 A 85 ILE H H 1 8.882 0.020 A 85 ILE HA H 1 4.637 0.020 A 85 ILE HB H 1 1.633 0.020 A 85 ILE HD1% H 1 0.613 0.020 A 85 ILE HG1x H 1 1.241 0.020 A 85 ILE HG1y H 1 1.241 0.020 A 85 ILE HG2% H 1 0.729 0.020 A 85 ILE C C 13 175.790 0.400 A 85 ILE CA C 13 58.119 0.400 A 85 ILE CB C 13 40.444 0.400 A 85 ILE CD1 C 13 13.576 0.400 A 85 ILE CG1 C 13 26.613 0.400 A 85 ILE CG2 C 13 17.432 0.400 A 85 ILE N N 15 118.120 0.400 A 86 ALA H H 1 9.698 0.020 A 86 ALA HA H 1 3.734 0.020 A 86 ALA HB% H 1 1.096 0.020 A 86 ALA C C 13 176.661 0.400 A 86 ALA CA C 13 52.856 0.400 A 86 ALA CB C 13 16.817 0.400 A 86 ALA N N 15 131.335 0.400 A 87 GLY H H 1 8.669 0.020 A 87 GLY HAy H 1 4.301 0.020 A 87 GLY HAx H 1 3.500 0.020 A 87 GLY C C 13 173.335 0.400 A 87 GLY CA C 13 44.833 0.400 A 87 GLY N N 15 106.594 0.400 A 88 SER H H 1 7.750 0.020 A 88 SER HA H 1 4.477 0.020 A 88 SER HBx H 1 3.673 0.020 A 88 SER HBy H 1 3.673 0.020 A 88 SER C C 13 172.684 0.400 A 88 SER CA C 13 57.811 0.400 A 88 SER CB C 13 64.540 0.400 A 88 SER N N 15 111.527 0.400 A 89 ILE H H 1 7.940 0.020 A 89 ILE HA H 1 4.497 0.020 A 89 ILE HB H 1 1.828 0.020 A 89 ILE HD1% H 1 0.737 0.020 A 89 ILE HG1x H 1 1.478 0.020 A 89 ILE HG1y H 1 1.478 0.020 A 89 ILE HG2% H 1 0.714 0.020 A 89 ILE C C 13 175.575 0.400 A 89 ILE CA C 13 60.538 0.400 A 89 ILE CB C 13 40.065 0.400 A 89 ILE CD1 C 13 12.144 0.400 A 89 ILE CG1 C 13 27.123 0.400 A 89 ILE CG2 C 13 16.959 0.400 A 89 ILE N N 15 117.726 0.400 A 90 ASN H H 1 9.112 0.020 A 90 ASN HA H 1 4.788 0.020 A 90 ASN HBy H 1 2.651 0.020 A 90 ASN HBx H 1 2.174 0.020 A 90 ASN HD2x H 1 5.792 0.020 A 90 ASN HD2y H 1 7.694 0.020 A 90 ASN C C 13 175.532 0.400 A 90 ASN CA C 13 53.431 0.400 A 90 ASN CB C 13 39.853 0.400 A 90 ASN N N 15 127.855 0.400 A 90 ASN ND2 N 15 112.909 0.400 A 91 GLN H H 1 8.791 0.020 A 91 GLN HA H 1 4.518 0.020 A 91 GLN HBx H 1 2.190 0.020 A 91 GLN HBy H 1 2.190 0.020 A 91 GLN HE2x H 1 6.705 0.020 A 91 GLN HE2y H 1 6.923 0.020 A 91 GLN HGx H 1 1.855 0.020 A 91 GLN HGy H 1 1.855 0.020 A 91 GLN C C 13 176.897 0.400 A 91 GLN CA C 13 57.222 0.400 A 91 GLN CB C 13 28.155 0.400 A 91 GLN CG C 13 33.748 0.400 A 91 GLN N N 15 123.216 0.400 A 91 GLN NE2 N 15 111.168 0.400 A 92 ASN H H 1 7.932 0.020 A 92 ASN HA H 1 4.732 0.020 A 92 ASN HBy H 1 2.795 0.020 A 92 ASN HBx H 1 2.701 0.020 A 92 ASN HD2y H 1 7.542 0.020 A 92 ASN HD2x H 1 6.836 0.020 A 92 ASN C C 13 174.631 0.400 A 92 ASN CA C 13 55.582 0.400 A 92 ASN CB C 13 39.544 0.400 A 92 ASN N N 15 112.789 0.400 A 92 ASN ND2 N 15 112.737 0.400 A 93 GLY H H 1 9.009 0.020 A 93 GLY HAy H 1 4.544 0.020 A 93 GLY HAx H 1 3.966 0.020 A 93 GLY C C 13 171.845 0.400 A 93 GLY CA C 13 44.014 0.400 A 93 GLY N N 15 111.463 0.400 A 94 SER H H 1 8.441 0.020 A 94 SER HA H 1 4.573 0.020 A 94 SER HBx H 1 3.614 0.020 A 94 SER HBy H 1 3.614 0.020 A 94 SER C C 13 173.984 0.400 A 94 SER CA C 13 58.831 0.400 A 94 SER CB C 13 63.558 0.400 A 94 SER N N 15 117.447 0.400 A 95 LEU H H 1 8.459 0.020 A 95 LEU HA H 1 5.086 0.020 A 95 LEU HBy H 1 1.468 0.020 A 95 LEU HBx H 1 1.169 0.020 A 95 LEU HDx% H 1 0.681 0.020 A 95 LEU HDy% H 1 0.498 0.020 A 95 LEU HG H 1 1.554 0.020 A 95 LEU C C 13 175.921 0.400 A 95 LEU CA C 13 53.066 0.400 A 95 LEU CB C 13 47.225 0.400 A 95 LEU CD1 C 13 26.690 0.400 A 95 LEU CD2 C 13 22.838 0.400 A 95 LEU CG C 13 25.506 0.400 A 95 LEU N N 15 123.046 0.400 A 96 LEU H H 1 8.294 0.020 A 96 LEU HA H 1 5.261 0.020 A 96 LEU HBy H 1 1.624 0.020 A 96 LEU HBx H 1 0.923 0.020 A 96 LEU HDx% H 1 0.778 0.020 A 96 LEU HDy% H 1 0.704 0.020 A 96 LEU HG H 1 0.685 0.020 A 96 LEU C C 13 176.761 0.400 A 96 LEU CA C 13 53.169 0.400 A 96 LEU CB C 13 43.188 0.400 A 96 LEU CD1 C 13 25.350 0.400 A 96 LEU CD2 C 13 23.153 0.400 A 96 LEU CG C 13 25.807 0.400 A 96 LEU N N 15 118.592 0.400 A 97 ILE H H 1 9.506 0.020 A 97 ILE HA H 1 4.919 0.020 A 97 ILE HB H 1 1.582 0.020 A 97 ILE HD1% H 1 0.611 0.020 A 97 ILE HG1x H 1 1.223 0.020 A 97 ILE HG1y H 1 1.223 0.020 A 97 ILE HG2% H 1 0.595 0.020 A 97 ILE C C 13 172.882 0.400 A 97 ILE CA C 13 57.263 0.400 A 97 ILE CB C 13 40.460 0.400 A 97 ILE CD1 C 13 14.371 0.400 A 97 ILE CG1 C 13 26.732 0.400 A 97 ILE CG2 C 13 17.739 0.400 A 97 ILE N N 15 120.709 0.400 A 98 CYS H H 1 9.289 0.020 A 98 CYS HA H 1 4.908 0.020 A 98 CYS HBy H 1 2.577 0.020 A 98 CYS HBx H 1 2.486 0.020 A 98 CYS C C 13 174.549 0.400 A 98 CYS CA C 13 56.556 0.400 A 98 CYS CB C 13 27.438 0.400 A 98 CYS N N 15 123.954 0.400 A 99 ALA H H 1 9.195 0.020 A 99 ALA HA H 1 4.187 0.020 A 99 ALA HB% H 1 1.199 0.020 A 99 ALA CA C 13 52.913 0.400 A 99 ALA CB C 13 18.928 0.400 A 99 ALA N N 15 131.321 0.400 A 100 THR H H 1 9.537 0.020 A 100 THR HA H 1 4.240 0.020 A 100 THR HB H 1 4.287 0.020 A 100 THR HG2% H 1 1.102 0.020 A 100 THR C C 13 173.980 0.400 A 100 THR CA C 13 61.824 0.400 A 100 THR CB C 13 69.213 0.400 A 100 THR CG2 C 13 20.610 0.400 A 100 THR N N 15 117.047 0.400 A 101 HIS H H 1 7.360 0.020 A 101 HIS HA H 1 4.704 0.020 A 101 HIS HBx H 1 2.615 0.020 A 101 HIS HBy H 1 2.852 0.020 A 101 HIS HD2 H 1 6.930 0.020 A 101 HIS C C 13 173.029 0.400 A 101 HIS CA C 13 55.637 0.400 A 101 HIS CB C 13 32.202 0.400 A 101 HIS N N 15 120.023 0.400 A 102 VAL H H 1 8.730 0.020 A 102 VAL HA H 1 4.467 0.020 A 102 VAL HB H 1 2.063 0.020 A 102 VAL HGx% H 1 0.576 0.020 A 102 VAL HGy% H 1 0.676 0.020 A 102 VAL C C 13 176.048 0.400 A 102 VAL CA C 13 59.045 0.400 A 102 VAL CB C 13 34.447 0.400 A 102 VAL CG1 C 13 21.005 0.400 A 102 VAL CG2 C 13 18.477 0.400 A 102 VAL N N 15 116.792 0.400 A 103 GLY H H 1 8.636 0.020 A 103 GLY HAy H 1 3.823 0.020 A 103 GLY HAx H 1 3.664 0.020 A 103 GLY C C 13 175.674 0.400 A 103 GLY CA C 13 46.634 0.400 A 103 GLY N N 15 111.647 0.400 A 104 ALA H H 1 8.840 0.020 A 104 ALA HA H 1 4.111 0.020 A 104 ALA HB% H 1 1.326 0.020 A 104 ALA C C 13 176.696 0.400 A 104 ALA CA C 13 52.966 0.400 A 104 ALA CB C 13 18.544 0.400 A 104 ALA N N 15 129.081 0.400 A 105 ASP H H 1 7.780 0.020 A 105 ASP HA H 1 4.602 0.020 A 105 ASP HBx H 1 2.753 0.020 A 105 ASP HBy H 1 2.852 0.020 A 105 ASP C C 13 178.705 0.400 A 105 ASP CA C 13 54.057 0.400 A 105 ASP CB C 13 41.722 0.400 A 105 ASP N N 15 114.682 0.400 A 106 THR H H 1 7.337 0.020 A 106 THR HA H 1 4.088 0.020 A 106 THR HB H 1 4.515 0.020 A 106 THR HG2% H 1 1.172 0.020 A 106 THR C C 13 171.430 0.400 A 106 THR CA C 13 61.344 0.400 A 106 THR CB C 13 70.588 0.400 A 106 THR CG2 C 13 20.894 0.400 A 106 THR N N 15 109.685 0.400 A 107 THR HA H 1 4.904 0.020 A 107 THR HB H 1 4.046 0.020 A 107 THR HG2% H 1 1.081 0.020 A 107 THR C C 13 172.945 0.400 A 107 THR CA C 13 61.399 0.400 A 107 THR CB C 13 69.890 0.400 A 107 THR CG2 C 13 21.421 0.400 A 108 LEU H H 1 7.870 0.020 A 108 LEU HA H 1 3.874 0.020 A 108 LEU HBx H 1 1.466 0.020 A 108 LEU HBy H 1 1.466 0.020 A 108 LEU HDx% H 1 0.777 0.020 A 108 LEU HDy% H 1 0.657 0.020 A 108 LEU HG H 1 1.345 0.020 A 108 LEU C C 13 177.345 0.400 A 108 LEU CA C 13 57.377 0.400 A 108 LEU CB C 13 41.511 0.400 A 108 LEU CD1 C 13 23.287 0.400 A 108 LEU CD2 C 13 25.144 0.400 A 108 LEU CG C 13 26.805 0.400 A 108 LEU N N 15 127.852 0.400 A 109 SER H H 1 7.844 0.020 A 109 SER HA H 1 3.851 0.020 A 109 SER HBx H 1 3.650 0.020 A 109 SER HBy H 1 3.650 0.020 A 109 SER C C 13 176.579 0.400 A 109 SER CA C 13 61.472 0.400 A 109 SER CB C 13 63.341 0.400 A 109 SER N N 15 114.520 0.400 A 110 GLN H H 1 7.942 0.020 A 110 GLN HA H 1 3.923 0.020 A 110 GLN HBx H 1 1.992 0.020 A 110 GLN HBy H 1 2.066 0.020 A 110 GLN HE2y H 1 6.957 0.020 A 110 GLN HE2x H 1 6.631 0.020 A 110 GLN HGy H 1 2.350 0.020 A 110 GLN HGx H 1 2.234 0.020 A 110 GLN C C 13 178.120 0.400 A 110 GLN CA C 13 58.305 0.400 A 110 GLN CB C 13 28.410 0.400 A 110 GLN CG C 13 33.567 0.400 A 110 GLN N N 15 120.288 0.400 A 110 GLN NE2 N 15 112.770 0.400 A 111 ILE H H 1 7.983 0.020 A 111 ILE HA H 1 3.629 0.020 A 111 ILE HB H 1 1.857 0.020 A 111 ILE HD1% H 1 0.682 0.020 A 111 ILE HG1y H 1 1.640 0.020 A 111 ILE HG1x H 1 0.950 0.020 A 111 ILE HG2% H 1 0.759 0.020 A 111 ILE C C 13 177.373 0.400 A 111 ILE CA C 13 64.793 0.400 A 111 ILE CB C 13 37.758 0.400 A 111 ILE CD1 C 13 13.927 0.400 A 111 ILE CG1 C 13 28.673 0.400 A 111 ILE CG2 C 13 17.128 0.400 A 111 ILE N N 15 121.471 0.400 A 112 VAL H H 1 8.121 0.020 A 112 VAL HA H 1 3.339 0.020 A 112 VAL HB H 1 1.977 0.020 A 112 VAL HGx% H 1 0.818 0.020 A 112 VAL HGy% H 1 0.748 0.020 A 112 VAL C C 13 176.827 0.400 A 112 VAL CA C 13 66.202 0.400 A 112 VAL CB C 13 31.545 0.400 A 112 VAL CG1 C 13 22.875 0.400 A 112 VAL CG2 C 13 21.084 0.400 A 112 VAL N N 15 119.944 0.400 A 113 LYS H H 1 7.533 0.020 A 113 LYS HA H 1 3.997 0.020 A 113 LYS HBx H 1 1.741 0.020 A 113 LYS HBy H 1 1.741 0.020 A 113 LYS HDx H 1 1.611 0.020 A 113 LYS HDy H 1 1.611 0.020 A 113 LYS HEx H 1 2.861 0.020 A 113 LYS HEy H 1 2.861 0.020 A 113 LYS HGy H 1 1.366 0.020 A 113 LYS HGx H 1 1.296 0.020 A 113 LYS C C 13 177.798 0.400 A 113 LYS CA C 13 58.345 0.400 A 113 LYS CB C 13 32.125 0.400 A 113 LYS CD C 13 28.679 0.400 A 113 LYS CE C 13 41.740 0.400 A 113 LYS CG C 13 24.409 0.400 A 113 LYS N N 15 118.715 0.400 A 114 LEU H H 1 7.499 0.020 A 114 LEU HA H 1 3.993 0.020 A 114 LEU HBy H 1 1.748 0.020 A 114 LEU HBx H 1 1.469 0.020 A 114 LEU HDx% H 1 0.775 0.020 A 114 LEU HDy% H 1 0.724 0.020 A 114 LEU HG H 1 1.640 0.020 A 114 LEU C C 13 179.225 0.400 A 114 LEU CA C 13 57.040 0.400 A 114 LEU CB C 13 41.848 0.400 A 114 LEU CD1 C 13 24.961 0.400 A 114 LEU CD2 C 13 23.203 0.400 A 114 LEU CG C 13 26.569 0.400 A 114 LEU N N 15 119.141 0.400 A 115 VAL H H 1 7.979 0.020 A 115 VAL HA H 1 3.628 0.020 A 115 VAL HB H 1 1.976 0.020 A 115 VAL HGx% H 1 0.841 0.020 A 115 VAL HGy% H 1 0.841 0.020 A 115 VAL C C 13 177.953 0.400 A 115 VAL CA C 13 65.071 0.400 A 115 VAL CB C 13 31.378 0.400 A 115 VAL CG1 C 13 22.086 0.400 A 115 VAL N N 15 119.813 0.400 A 116 GLU H H 1 8.481 0.020 A 116 GLU HA H 1 3.891 0.020 A 116 GLU HBx H 1 1.931 0.020 A 116 GLU HBy H 1 2.009 0.020 A 116 GLU HGx H 1 2.270 0.020 A 116 GLU HGy H 1 2.270 0.020 A 116 GLU C C 13 178.122 0.400 A 116 GLU CA C 13 57.888 0.400 A 116 GLU CB C 13 29.693 0.400 A 116 GLU CG C 13 36.256 0.400 A 116 GLU N N 15 121.490 0.400 A 117 GLU H H 1 7.914 0.020 A 117 GLU HA H 1 4.057 0.020 A 117 GLU HBy H 1 1.974 0.020 A 117 GLU HBx H 1 1.925 0.020 A 117 GLU HGy H 1 2.362 0.020 A 117 GLU HGx H 1 2.190 0.020 A 117 GLU C C 13 176.181 0.400 A 117 GLU CA C 13 56.928 0.400 A 117 GLU CB C 13 29.525 0.400 A 117 GLU CG C 13 36.269 0.400 A 117 GLU N N 15 117.961 0.400 A 118 ALA H H 1 7.577 0.020 A 118 ALA HA H 1 4.245 0.020 A 118 ALA HB% H 1 1.341 0.020 A 118 ALA C C 13 176.570 0.400 A 118 ALA CA C 13 52.127 0.400 A 118 ALA CB C 13 18.628 0.400 A 118 ALA N N 15 123.204 0.400 A 119 GLN H H 1 7.522 0.020 A 119 GLN HA H 1 3.938 0.020 A 119 GLN HBy H 1 2.010 0.020 A 119 GLN HBx H 1 1.841 0.020 A 119 GLN HE2y H 1 7.404 0.020 A 119 GLN HE2x H 1 6.669 0.020 A 119 GLN HGx H 1 2.281 0.020 A 119 GLN HGy H 1 2.281 0.020 A 119 GLN C C 13 180.560 0.400 A 119 GLN CA C 13 57.337 0.400 A 119 GLN CB C 13 29.890 0.400 A 119 GLN CG C 13 34.190 0.400 A 119 GLN N N 15 123.313 0.400 A 119 GLN NE2 N 15 112.634 0.400 stop_ save_ save_AMBER_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode AMBER_distance_constraints_4 _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 -3 SER H A -3 SER HBy 1.0 1.8 5.17 2 1 A -3 SER H A -3 SER HBx 1.0 1.8 5.17 3 2 A -3 SER HBy A -2 PHE H 1.0 1.8 6.92 4 2 A -3 SER HBx A -2 PHE H 1.0 1.8 6.92 5 3 A -2 PHE H A -1 THR H 1.0 1.8 3.92 6 4 A -2 PHE HA A -2 PHE HBx 1.0 1.8 3.49 7 5 A -2 PHE HA A -2 PHE HBy 1.0 1.8 3.42 8 6 A -2 PHE HA A -2 PHE HDy 1.0 1.8 4.31 9 6 A -2 PHE HA A -2 PHE HDx 1.0 1.8 4.31 10 7 A -2 PHE HA A -2 PHE HEy 1.0 1.8 5.46 11 7 A -2 PHE HA A -2 PHE HEx 1.0 1.8 5.46 12 8 A -2 PHE HA A 0 MET H 1.0 1.8 6.47 13 9 A -2 PHE HA A 1 SER H 1.0 1.8 5.39 14 10 A -1 THR H A -2 PHE HBx 1.0 1.8 4.91 15 11 A -1 THR H A -2 PHE HBy 1.0 1.8 5.14 16 12 A -1 THR H A -2 PHE HDy 1.0 1.8 7.40 17 12 A -1 THR H A -2 PHE HDx 1.0 1.8 7.40 18 13 A -1 THR H A -1 THR HB 1.0 1.8 4.55 19 14 A -1 THR H A -1 THR HG21 1.0 1.8 5.76 20 15 A -1 THR H A 0 MET H 1.0 1.8 5.58 21 16 A -1 THR HG21 A -1 THR HA 1.0 1.8 3.67 22 17 A 0 MET H A -1 THR HB 1.0 1.8 4.94 23 18 A 0 MET H A -1 THR HG21 1.0 1.8 5.80 24 19 A 1 SER H A -1 THR HG21 1.0 1.8 6.53 25 20 A 0 MET H A 0 MET HGy 1.0 1.8 5.05 26 20 A 0 MET H A 0 MET HGx 1.0 1.8 5.05 27 21 A 0 MET H A 1 SER H 1.0 1.8 4.17 28 22 A 0 MET HA A 0 MET HBy 1.0 1.8 3.61 29 22 A 0 MET HA A 0 MET HBx 1.0 1.8 3.61 30 23 A 0 MET HGy A 0 MET HA 1.0 1.8 4.55 31 23 A 0 MET HGx A 0 MET HA 1.0 1.8 4.55 32 24 A 0 MET HA A 3 ALA H 1.0 1.8 5.11 33 25 A 0 MET HA A 3 ALA HB% 1.0 1.8 5.71 34 26 A 0 MET HGy A 0 MET HBy 1.0 1.8 3.52 35 26 A 0 MET HGy A 0 MET HBx 1.0 1.8 3.52 36 26 A 0 MET HGx A 0 MET HBx 1.0 1.8 3.52 37 26 A 0 MET HGx A 0 MET HBy 1.0 1.8 3.52 38 27 A 1 SER H A 0 MET HBy 1.0 1.8 5.11 39 27 A 1 SER H A 0 MET HBx 1.0 1.8 5.11 40 28 A 0 MET HBy A 3 ALA H 1.0 1.8 6.38 41 28 A 0 MET HBx A 3 ALA H 1.0 1.8 6.38 42 29 A 1 SER H A 0 MET HGy 1.0 1.8 6.45 43 29 A 1 SER H A 0 MET HGx 1.0 1.8 6.45 44 30 A 1 SER H A 1 SER HBy 1.0 1.8 4.50 45 31 A 1 SER H A 4 LEU H 1.0 1.8 6.46 46 32 A 1 SER HA A 1 SER HBx 1.0 1.8 3.46 47 33 A 3 ALA H A 1 SER HA 1.0 1.8 5.15 48 34 A 4 LEU H A 1 SER HA 1.0 1.8 4.77 49 35 A 1 SER HA A 4 LEU HBx 1.0 1.8 4.41 50 36 A 1 SER HA A 4 LEU HBy 1.0 1.8 4.85 51 37 A 1 SER HA A 4 LEU HDx% 1.0 1.8 6.30 52 38 A 1 SER HA A 4 LEU HDy% 1.0 1.8 6.31 53 39 A 3 ALA H A 5 ALA H 1.0 1.8 6.52 54 40 A 3 ALA H A 6 LYS H 1.0 1.8 6.65 55 41 A 3 ALA H A 3 ALA HB% 1.0 1.8 3.96 56 42 A 3 ALA H A 4 LEU H 1.0 1.8 6.47 57 43 A 6 LYS H A 3 ALA HA 1.0 1.8 4.63 58 44 A 3 ALA HA A 6 LYS HBy 1.0 1.8 5.11 59 44 A 3 ALA HA A 6 LYS HBx 1.0 1.8 5.11 60 45 A 3 ALA HB% A 68 LEU HDx% 1.0 1.8 8.35 61 46 A 3 ALA HB% A 68 LEU HDy% 1.0 1.8 7.26 62 47 A 3 ALA HB% A 4 LEU H 1.0 1.8 5.16 63 48 A 4 LEU H A 5 ALA H 1.0 1.8 5.67 64 49 A 4 LEU H A 7 LEU H 1.0 1.8 6.65 65 50 A 4 LEU H A 4 LEU HG 1.0 1.8 6.24 66 51 A 4 LEU H A 4 LEU HDx% 1.0 1.8 6.44 67 52 A 4 LEU H A 4 LEU HDy% 1.0 1.8 6.07 68 53 A 4 LEU HA A 112 VAL HGx% 1.0 1.8 7.07 69 54 A 4 LEU HA A 112 VAL HGy% 1.0 1.8 7.80 70 55 A 4 LEU HA A 7 LEU HBx 1.0 1.8 5.04 71 56 A 4 LEU HA A 7 LEU HG 1.0 1.8 5.31 72 57 A 4 LEU HA A 7 LEU HDy% 1.0 1.8 4.64 73 58 A 4 LEU HG A 4 LEU HA 1.0 1.8 4.26 74 59 A 4 LEU HDx% A 4 LEU HA 1.0 1.8 4.61 75 60 A 4 LEU HDy% A 4 LEU HA 1.0 1.8 5.99 76 61 A 4 LEU HBx A 5 ALA H 1.0 1.8 4.78 77 62 A 4 LEU HBx A 112 VAL HB 1.0 1.8 6.65 78 63 A 4 LEU HBx A 4 LEU HDx% 1.0 1.8 3.38 79 64 A 4 LEU HBx A 4 LEU HDy% 1.0 1.8 4.97 80 65 A 4 LEU HBy A 5 ALA H 1.0 1.8 4.30 81 66 A 4 LEU HBy A 112 VAL HB 1.0 1.8 6.51 82 67 A 4 LEU HBy A 4 LEU HDx% 1.0 1.8 4.29 83 68 A 4 LEU HBy A 4 LEU HDy% 1.0 1.8 3.71 84 69 A 5 ALA H A 4 LEU HG 1.0 1.8 6.42 85 70 A 4 LEU HDx% A 5 ALA H 1.0 1.8 6.90 86 71 A 4 LEU HDx% A 112 VAL HB 1.0 1.8 7.07 87 72 A 4 LEU HDx% A 112 VAL HGx% 1.0 1.8 5.98 88 73 A 4 LEU HDx% A 112 VAL HGy% 1.0 1.8 7.60 89 74 A 4 LEU HDx% A 115 VAL HGy% 1.0 1.8 7.75 90 74 A 4 LEU HDx% A 115 VAL HGx% 1.0 1.8 7.75 91 75 A 4 LEU HDx% A 116 GLU H 1.0 1.8 7.89 92 76 A 4 LEU HDx% A 116 GLU HBx 1.0 1.8 5.52 93 77 A 4 LEU HDx% A 116 GLU HBy 1.0 1.8 7.29 94 78 A 4 LEU HDx% A 116 GLU HGx 1.0 1.8 6.62 95 78 A 4 LEU HDx% A 116 GLU HGy 1.0 1.8 6.62 96 79 A 4 LEU HDy% A 5 ALA H 1.0 1.8 6.20 97 80 A 4 LEU HDy% A 112 VAL HB 1.0 1.8 6.42 98 81 A 4 LEU HDy% A 112 VAL HGx% 1.0 1.8 6.87 99 82 A 4 LEU HDy% A 112 VAL HGy% 1.0 1.8 8.14 100 83 A 4 LEU HDy% A 116 GLU H 1.0 1.8 7.89 101 84 A 4 LEU HDy% A 116 GLU HBx 1.0 1.8 5.58 102 85 A 4 LEU HDy% A 116 GLU HBy 1.0 1.8 6.82 103 86 A 4 LEU HDy% A 116 GLU HGy 1.0 1.8 6.75 104 86 A 4 LEU HDy% A 116 GLU HGx 1.0 1.8 6.75 105 87 A 5 ALA H A 5 ALA HB% 1.0 1.8 4.23 106 88 A 5 ALA H A 6 LYS H 1.0 1.8 4.26 107 89 A 5 ALA H A 7 LEU H 1.0 1.8 6.65 108 90 A 112 VAL HB A 5 ALA HA 1.0 1.8 6.61 109 91 A 112 VAL HGx% A 5 ALA HA 1.0 1.8 6.32 110 92 A 112 VAL HGy% A 5 ALA HA 1.0 1.8 7.56 111 93 A 5 ALA HA A 8 ILE H 1.0 1.8 5.18 112 94 A 5 ALA HA A 8 ILE HB 1.0 1.8 4.72 113 95 A 5 ALA HA A 8 ILE HD1% 1.0 1.8 7.56 114 96 A 5 ALA HA A 8 ILE HG2% 1.0 1.8 7.09 115 97 A 6 LYS H A 5 ALA HB% 1.0 1.8 5.17 116 98 A 6 LYS H A 6 LYS HGy 1.0 1.8 5.45 117 99 A 6 LYS H A 6 LYS HGx 1.0 1.8 5.31 118 100 A 6 LYS H A 6 LYS HBy 1.0 1.8 3.79 119 100 A 6 LYS H A 6 LYS HBx 1.0 1.8 3.79 120 101 A 6 LYS H A 6 LYS HDy 1.0 1.8 5.72 121 101 A 6 LYS H A 6 LYS HDx 1.0 1.8 5.72 122 102 A 6 LYS H A 7 LEU H 1.0 1.8 4.72 123 103 A 6 LYS H A 8 ILE H 1.0 1.8 6.65 124 104 A 6 LYS H A 68 LEU HDy% 1.0 1.8 7.89 125 105 A 6 LYS HGy A 6 LYS HA 1.0 1.8 4.70 126 106 A 6 LYS HGx A 6 LYS HA 1.0 1.8 4.17 127 107 A 6 LYS HDy A 6 LYS HA 1.0 1.8 5.20 128 107 A 6 LYS HDx A 6 LYS HA 1.0 1.8 5.20 129 108 A 6 LYS HA A 6 LYS HEy 1.0 1.8 5.52 130 108 A 6 LYS HA A 6 LYS HEx 1.0 1.8 5.52 131 109 A 6 LYS HA A 9 SER HBy 1.0 1.8 4.16 132 110 A 6 LYS HGy A 6 LYS HDy 1.0 1.8 3.88 133 110 A 6 LYS HGy A 6 LYS HDx 1.0 1.8 3.88 134 111 A 6 LYS HGy A 6 LYS HEy 1.0 1.8 3.81 135 111 A 6 LYS HGy A 6 LYS HEx 1.0 1.8 3.81 136 112 A 7 LEU H A 6 LYS HGy 1.0 1.8 6.50 137 113 A 68 LEU HDy% A 6 LYS HGy 1.0 1.8 5.57 138 114 A 6 LYS HGx A 6 LYS HEy 1.0 1.8 5.15 139 114 A 6 LYS HGx A 6 LYS HEx 1.0 1.8 5.15 140 115 A 6 LYS HGx A 9 SER H 1.0 1.8 6.65 141 116 A 6 LYS HGx A 10 LEU H 1.0 1.8 6.65 142 117 A 6 LYS HBy A 6 LYS HGy 1.0 1.8 3.60 143 117 A 6 LYS HBx A 6 LYS HGy 1.0 1.8 3.60 144 118 A 6 LYS HBy A 6 LYS HDy 1.0 1.8 3.52 145 118 A 6 LYS HBy A 6 LYS HDx 1.0 1.8 3.52 146 118 A 6 LYS HBx A 6 LYS HDy 1.0 1.8 3.52 147 118 A 6 LYS HBx A 6 LYS HDx 1.0 1.8 3.52 148 119 A 6 LYS HBy A 6 LYS HEx 1.0 1.8 5.07 149 119 A 6 LYS HBx A 6 LYS HEy 1.0 1.8 5.07 150 119 A 6 LYS HBx A 6 LYS HEx 1.0 1.8 5.07 151 119 A 6 LYS HBy A 6 LYS HEy 1.0 1.8 5.07 152 120 A 6 LYS HBy A 7 LEU H 1.0 1.8 5.03 153 120 A 6 LYS HBx A 7 LEU H 1.0 1.8 5.03 154 121 A 6 LYS HBx A 68 LEU HDy% 1.0 1.8 6.78 155 121 A 6 LYS HBy A 68 LEU HDy% 1.0 1.8 6.78 156 122 A 6 LYS HDy A 6 LYS HEy 1.0 1.8 3.68 157 122 A 6 LYS HDy A 6 LYS HEx 1.0 1.8 3.68 158 122 A 6 LYS HDx A 6 LYS HEy 1.0 1.8 3.68 159 122 A 6 LYS HDx A 6 LYS HEx 1.0 1.8 3.68 160 123 A 7 LEU H A 6 LYS HDy 1.0 1.8 6.83 161 123 A 7 LEU H A 6 LYS HDx 1.0 1.8 6.83 162 124 A 68 LEU HDy% A 6 LYS HDx 1.0 1.8 6.05 163 124 A 68 LEU HDy% A 6 LYS HDy 1.0 1.8 6.05 164 125 A 7 LEU H A 7 LEU HA 1.0 1.8 3.38 165 126 A 7 LEU H A 7 LEU HBx 1.0 1.8 4.68 166 127 A 7 LEU H A 7 LEU HBy 1.0 1.8 4.55 167 128 A 7 LEU H A 7 LEU HG 1.0 1.8 4.89 168 129 A 7 LEU H A 7 LEU HDx% 1.0 1.8 5.89 169 130 A 7 LEU H A 7 LEU HDy% 1.0 1.8 4.66 170 131 A 7 LEU H A 8 ILE H 1.0 1.8 4.00 171 132 A 7 LEU HG A 7 LEU HA 1.0 1.8 4.67 172 133 A 7 LEU HA A 7 LEU HDx% 1.0 1.8 5.23 173 134 A 7 LEU HDy% A 7 LEU HA 1.0 1.8 3.74 174 135 A 7 LEU HA A 10 LEU HBy 1.0 1.8 5.97 175 136 A 7 LEU HA A 10 LEU HBx 1.0 1.8 5.78 176 137 A 112 VAL HGx% A 7 LEU HBx 1.0 1.8 6.34 177 138 A 112 VAL HGy% A 7 LEU HBx 1.0 1.8 6.10 178 139 A 7 LEU HBx A 7 LEU HG 1.0 1.8 3.32 179 140 A 7 LEU HBx A 7 LEU HDx% 1.0 1.8 4.42 180 141 A 7 LEU HBx A 7 LEU HDy% 1.0 1.8 3.78 181 142 A 7 LEU HBx A 8 ILE H 1.0 1.8 4.87 182 143 A 112 VAL HGx% A 7 LEU HBy 1.0 1.8 6.07 183 144 A 112 VAL HGy% A 7 LEU HBy 1.0 1.8 6.26 184 145 A 7 LEU HBy A 7 LEU HDx% 1.0 1.8 3.56 185 146 A 7 LEU HDy% A 7 LEU HBy 1.0 1.8 4.52 186 147 A 8 ILE H A 7 LEU HBy 1.0 1.8 4.38 187 148 A 112 VAL HGx% A 7 LEU HG 1.0 1.8 6.78 188 149 A 112 VAL HGy% A 7 LEU HG 1.0 1.8 6.73 189 150 A 7 LEU HG A 8 ILE H 1.0 1.8 6.31 190 151 A 7 LEU HDx% A 108 LEU H 1.0 1.8 7.80 191 152 A 7 LEU HDx% A 108 LEU HDx% 1.0 1.8 6.28 192 153 A 7 LEU HDx% A 108 LEU HDy% 1.0 1.8 7.16 193 154 A 7 LEU HDx% A 111 ILE HD1% 1.0 1.8 7.18 194 155 A 7 LEU HDx% A 112 VAL H 1.0 1.8 7.89 195 156 A 68 LEU HDx% A 7 LEU HDx% 1.0 1.8 7.45 196 157 A 68 LEU HDy% A 7 LEU HDx% 1.0 1.8 7.45 197 158 A 7 LEU HDy% A 108 LEU HDx% 1.0 1.8 8.45 198 159 A 7 LEU HDy% A 108 LEU HDy% 1.0 1.8 8.84 199 160 A 7 LEU HDy% A 111 ILE HD1% 1.0 1.8 8.75 200 161 A 7 LEU HDy% A 112 VAL H 1.0 1.8 7.89 201 162 A 68 LEU HDx% A 7 LEU HDy% 1.0 1.8 7.24 202 163 A 68 LEU HDy% A 7 LEU HDy% 1.0 1.8 6.43 203 164 A 112 VAL HGx% A 8 ILE H 1.0 1.8 7.89 204 165 A 112 VAL HGy% A 8 ILE H 1.0 1.8 7.89 205 166 A 8 ILE H A 8 ILE HB 1.0 1.8 3.61 206 167 A 8 ILE H A 8 ILE HG1y 1.0 1.8 5.21 207 168 A 8 ILE H A 8 ILE HG1x 1.0 1.8 5.43 208 169 A 8 ILE H A 8 ILE HD1% 1.0 1.8 5.90 209 170 A 8 ILE H A 8 ILE HG2% 1.0 1.8 5.18 210 171 A 8 ILE H A 9 SER H 1.0 1.8 6.13 211 172 A 8 ILE H A 10 LEU H 1.0 1.8 5.79 212 173 A 8 ILE HG1y A 8 ILE HA 1.0 1.8 3.54 213 174 A 8 ILE HG1x A 8 ILE HA 1.0 1.8 4.54 214 175 A 8 ILE HD1% A 8 ILE HA 1.0 1.8 4.70 215 176 A 8 ILE HG2% A 8 ILE HA 1.0 1.8 4.91 216 177 A 10 LEU H A 8 ILE HA 1.0 1.8 6.65 217 178 A 8 ILE HA A 11 GLN H 1.0 1.8 5.39 218 179 A 8 ILE HA A 11 GLN HGx 1.0 1.8 4.95 219 180 A 112 VAL HGx% A 8 ILE HB 1.0 1.8 7.67 220 181 A 112 VAL HGy% A 8 ILE HB 1.0 1.8 7.78 221 182 A 8 ILE HB A 8 ILE HG1y 1.0 1.8 3.40 222 183 A 8 ILE HB A 8 ILE HD1% 1.0 1.8 4.64 223 184 A 8 ILE HB A 9 SER H 1.0 1.8 5.13 224 185 A 112 VAL HGy% A 8 ILE HG1y 1.0 1.8 5.68 225 186 A 9 SER H A 8 ILE HG1y 1.0 1.8 5.83 226 187 A 9 SER H A 8 ILE HG1x 1.0 1.8 6.05 227 188 A 8 ILE HD1% A 109 SER HA 1.0 1.8 5.59 228 189 A 8 ILE HD1% A 9 SER H 1.0 1.8 7.62 229 190 A 8 ILE HD1% A 11 GLN HBy 1.0 1.8 6.66 230 191 A 8 ILE HD1% A 11 GLN HGx 1.0 1.8 6.17 231 192 A 8 ILE HG2% A 8 ILE HG1y 1.0 1.8 4.76 232 193 A 8 ILE HG2% A 8 ILE HG1x 1.0 1.8 5.06 233 194 A 8 ILE HD1% A 8 ILE HG2% 1.0 1.8 3.96 234 195 A 8 ILE HG2% A 9 SER H 1.0 1.8 5.15 235 196 A 8 ILE HG2% A 9 SER HA 1.0 1.8 4.86 236 197 A 8 ILE HG2% A 11 GLN HE2y 1.0 1.8 7.89 237 198 A 8 ILE HG2% A 11 GLN HE2x 1.0 1.8 7.89 238 199 A 9 SER HBy A 9 SER H 1.0 1.8 4.39 239 200 A 9 SER H A 9 SER HBx 1.0 1.8 4.10 240 201 A 9 SER H A 10 LEU H 1.0 1.8 4.88 241 202 A 11 GLN H A 9 SER HA 1.0 1.8 6.19 242 203 A 9 SER HBy A 10 LEU H 1.0 1.8 4.20 243 204 A 10 LEU H A 9 SER HBx 1.0 1.8 5.04 244 205 A 10 LEU H A 10 LEU HBy 1.0 1.8 4.35 245 206 A 10 LEU H A 10 LEU HG 1.0 1.8 4.99 246 207 A 10 LEU H A 10 LEU HDx% 1.0 1.8 6.59 247 208 A 10 LEU H A 10 LEU HDy% 1.0 1.8 6.74 248 209 A 10 LEU HG A 10 LEU HA 1.0 1.8 4.32 249 210 A 10 LEU HDx% A 10 LEU HA 1.0 1.8 5.35 250 211 A 10 LEU HDy% A 10 LEU HA 1.0 1.8 5.05 251 212 A 10 LEU HBy A 10 LEU HDx% 1.0 1.8 4.26 252 213 A 10 LEU HBy A 10 LEU HDy% 1.0 1.8 4.63 253 214 A 10 LEU HBy A 11 GLN H 1.0 1.8 5.08 254 215 A 10 LEU HBx A 10 LEU HDx% 1.0 1.8 4.56 255 216 A 10 LEU HBx A 10 LEU HDy% 1.0 1.8 3.38 256 217 A 10 LEU HBx A 11 GLN H 1.0 1.8 5.36 257 218 A 11 GLN H A 10 LEU HG 1.0 1.8 6.13 258 219 A 108 LEU HDx% A 10 LEU HDx% 1.0 1.8 7.55 259 220 A 108 LEU HDy% A 10 LEU HDx% 1.0 1.8 7.93 260 221 A 11 GLN H A 10 LEU HDx% 1.0 1.8 7.42 261 222 A 68 LEU HDx% A 10 LEU HDx% 1.0 1.8 7.19 262 223 A 68 LEU HDy% A 10 LEU HDx% 1.0 1.8 7.24 263 224 A 108 LEU HDx% A 10 LEU HDy% 1.0 1.8 7.55 264 225 A 108 LEU HDy% A 10 LEU HDy% 1.0 1.8 7.26 265 226 A 11 GLN H A 10 LEU HDy% 1.0 1.8 6.79 266 227 A 68 LEU HDx% A 10 LEU HDy% 1.0 1.8 7.38 267 228 A 68 LEU HDy% A 10 LEU HDy% 1.0 1.8 7.57 268 229 A 11 GLN H A 11 GLN HBx 1.0 1.8 4.46 269 230 A 11 GLN H A 11 GLN HE2y 1.0 1.8 6.65 270 231 A 11 GLN H A 11 GLN HE2x 1.0 1.8 6.65 271 232 A 11 GLN H A 11 GLN HGy 1.0 1.8 4.97 272 233 A 11 GLN H A 11 GLN HGx 1.0 1.8 5.26 273 234 A 11 GLN H A 12 ALA H 1.0 1.8 6.65 274 235 A 11 GLN HE2y A 11 GLN HA 1.0 1.8 6.19 275 236 A 11 GLN HE2x A 11 GLN HA 1.0 1.8 6.65 276 237 A 11 GLN HGy A 11 GLN HA 1.0 1.8 4.52 277 238 A 11 GLN HGx A 11 GLN HA 1.0 1.8 4.12 278 239 A 11 GLN HA A 12 ALA HB% 1.0 1.8 5.22 279 240 A 11 GLN HBy A 11 GLN HE2y 1.0 1.8 4.77 280 241 A 11 GLN HBy A 11 GLN HE2x 1.0 1.8 5.39 281 242 A 11 GLN HBy A 12 ALA H 1.0 1.8 5.52 282 243 A 11 GLN HE2y A 11 GLN HBx 1.0 1.8 4.82 283 244 A 11 GLN HE2x A 11 GLN HBx 1.0 1.8 6.04 284 245 A 11 GLN HBx A 12 ALA H 1.0 1.8 4.87 285 246 A 108 LEU HDx% A 11 GLN HE2y 1.0 1.8 7.89 286 247 A 108 LEU HDy% A 11 GLN HE2y 1.0 1.8 7.89 287 248 A 11 GLN HE2y A 109 SER HBy 1.0 1.8 7.40 288 248 A 11 GLN HE2y A 109 SER HBx 1.0 1.8 7.40 289 249 A 108 LEU HDx% A 11 GLN HE2x 1.0 1.8 7.89 290 250 A 108 LEU HDy% A 11 GLN HE2x 1.0 1.8 7.89 291 251 A 11 GLN HE2x A 109 SER HBy 1.0 1.8 7.40 292 251 A 11 GLN HE2x A 109 SER HBx 1.0 1.8 7.40 293 252 A 11 GLN HGy A 12 ALA H 1.0 1.8 5.44 294 253 A 108 LEU HDx% A 11 GLN HGx 1.0 1.8 5.84 295 254 A 108 LEU HDy% A 11 GLN HGx 1.0 1.8 6.26 296 255 A 11 GLN HGx A 12 ALA H 1.0 1.8 6.08 297 256 A 108 LEU HDy% A 12 ALA H 1.0 1.8 7.89 298 257 A 12 ALA H A 12 ALA HB% 1.0 1.8 4.26 299 258 A 12 ALA H A 13 THR H 1.0 1.8 5.96 300 259 A 12 ALA H A 52 PRO HA 1.0 1.8 6.65 301 260 A 12 ALA H A 53 VAL HGx% 1.0 1.8 7.89 302 261 A 12 ALA HA A 14 GLU H 1.0 1.8 5.44 303 262 A 12 ALA HB% A 13 THR H 1.0 1.8 4.05 304 263 A 12 ALA HB% A 14 GLU H 1.0 1.8 5.41 305 264 A 12 ALA HB% A 52 PRO HA 1.0 1.8 5.57 306 265 A 12 ALA HB% A 52 PRO HBy 1.0 1.8 5.21 307 266 A 12 ALA HB% A 52 PRO HBx 1.0 1.8 4.98 308 267 A 13 THR H A 13 THR HG2% 1.0 1.8 5.75 309 268 A 13 THR H A 14 GLU H 1.0 1.8 6.38 310 269 A 13 THR H A 34 VAL H 1.0 1.8 6.65 311 270 A 13 THR HG2% A 13 THR HA 1.0 1.8 3.66 312 271 A 13 THR HA A 34 VAL HGx% 1.0 1.8 4.85 313 272 A 13 THR HA A 35 GLU H 1.0 1.8 6.65 314 273 A 14 GLU H A 13 THR HB 1.0 1.8 4.32 315 274 A 13 THR HB A 14 GLU HBy 1.0 1.8 4.55 316 275 A 13 THR HB A 14 GLU HGy 1.0 1.8 6.40 317 275 A 13 THR HB A 14 GLU HGx 1.0 1.8 6.40 318 276 A 14 GLU H A 13 THR HG2% 1.0 1.8 5.58 319 277 A 14 GLU H A 14 GLU HBx 1.0 1.8 4.57 320 278 A 14 GLU H A 14 GLU HGy 1.0 1.8 4.34 321 278 A 14 GLU H A 14 GLU HGx 1.0 1.8 4.34 322 279 A 14 GLU H A 15 ALA H 1.0 1.8 6.65 323 280 A 14 GLU H A 34 VAL HGx% 1.0 1.8 6.50 324 281 A 14 GLU HBx A 14 GLU HA 1.0 1.8 3.22 325 282 A 14 GLU HGy A 14 GLU HA 1.0 1.8 4.45 326 282 A 14 GLU HGx A 14 GLU HA 1.0 1.8 4.45 327 283 A 15 ALA H A 14 GLU HA 1.0 1.8 3.41 328 284 A 14 GLU HA A 15 ALA HB% 1.0 1.8 5.14 329 285 A 14 GLU HA A 33 ASP HA 1.0 1.8 3.55 330 286 A 34 VAL H A 14 GLU HA 1.0 1.8 4.10 331 287 A 14 GLU HA A 34 VAL HA 1.0 1.8 5.33 332 288 A 14 GLU HA A 34 VAL HB 1.0 1.8 4.78 333 289 A 14 GLU HGy A 14 GLU HBx 1.0 1.8 3.19 334 289 A 14 GLU HGx A 14 GLU HBx 1.0 1.8 3.19 335 290 A 14 GLU HBx A 15 ALA H 1.0 1.8 3.81 336 291 A 14 GLU HBx A 33 ASP HA 1.0 1.8 4.51 337 292 A 14 GLU HBy A 15 ALA H 1.0 1.8 4.60 338 293 A 14 GLU HBy A 33 ASP HA 1.0 1.8 4.52 339 294 A 34 VAL H A 14 GLU HBy 1.0 1.8 5.22 340 295 A 14 GLU HGy A 15 ALA H 1.0 1.8 4.97 341 295 A 14 GLU HGx A 15 ALA H 1.0 1.8 4.97 342 296 A 15 ALA H A 15 ALA HB% 1.0 1.8 5.06 343 297 A 15 ALA H A 16 THR H 1.0 1.8 6.15 344 298 A 15 ALA H A 32 VAL H 1.0 1.8 5.16 345 299 A 15 ALA H A 32 VAL HB 1.0 1.8 6.65 346 300 A 15 ALA H A 32 VAL O 1.0 1.8 2.90 347 301 A 15 ALA H A 32 VAL HGy% 1.0 1.8 5.69 348 302 A 15 ALA H A 33 ASP HA 1.0 1.8 4.87 349 303 A 15 ALA H A 34 VAL HA 1.0 1.8 5.95 350 304 A 15 ALA H A 34 VAL HB 1.0 1.8 6.54 351 305 A 16 THR H A 15 ALA HA 1.0 1.8 3.65 352 306 A 15 ALA HA A 52 PRO HGy 1.0 1.8 6.46 353 307 A 15 ALA HA A 52 PRO HGx 1.0 1.8 6.17 354 308 A 32 VAL O A 15 ALA N 1.0 1.8 3.80 355 309 A 15 ALA HB% A 16 THR H 1.0 1.8 5.06 356 310 A 15 ALA HB% A 17 ILE HD1% 1.0 1.8 7.19 357 311 A 15 ALA HB% A 32 VAL H 1.0 1.8 6.17 358 312 A 15 ALA HB% A 32 VAL HGx% 1.0 1.8 8.91 359 313 A 15 ALA HB% A 32 VAL HGy% 1.0 1.8 6.40 360 314 A 15 ALA HB% A 34 VAL HA 1.0 1.8 5.12 361 315 A 52 PRO HBy A 15 ALA HB% 1.0 1.8 5.22 362 316 A 52 PRO HBx A 15 ALA HB% 1.0 1.8 5.44 363 317 A 16 THR H A 16 THR HB 1.0 1.8 4.02 364 318 A 16 THR H A 16 THR HG2% 1.0 1.8 5.58 365 319 A 16 THR H A 17 ILE H 1.0 1.8 5.64 366 320 A 16 THR H A 43 ILE HD1% 1.0 1.8 7.89 367 321 A 16 THR H A 43 ILE HG2% 1.0 1.8 7.89 368 322 A 16 THR HG2% A 16 THR HA 1.0 1.8 4.03 369 323 A 17 ILE H A 16 THR HA 1.0 1.8 3.83 370 324 A 16 THR HA A 31 GLN HA 1.0 1.8 4.34 371 325 A 32 VAL H A 16 THR HA 1.0 1.8 4.48 372 326 A 16 THR HB A 17 ILE H 1.0 1.8 5.48 373 327 A 16 THR HB A 44 LYS H 1.0 1.8 6.65 374 328 A 16 THR HG2% A 17 ILE H 1.0 1.8 5.87 375 329 A 16 THR HG2% A 29 GLU HGy 1.0 1.8 6.27 376 329 A 16 THR HG2% A 29 GLU HGx 1.0 1.8 6.27 377 330 A 16 THR HG2% A 30 GLU H 1.0 1.8 6.62 378 331 A 16 THR HG2% A 31 GLN HA 1.0 1.8 4.94 379 332 A 32 VAL H A 16 THR HG2% 1.0 1.8 7.89 380 333 A 16 THR HG2% A 44 LYS H 1.0 1.8 7.89 381 334 A 17 ILE H A 17 ILE HB 1.0 1.8 3.74 382 335 A 17 ILE H A 17 ILE HG1y 1.0 1.8 5.26 383 336 A 17 ILE H A 17 ILE HG1x 1.0 1.8 4.35 384 337 A 17 ILE HD1% A 17 ILE H 1.0 1.8 5.87 385 338 A 17 ILE H A 17 ILE HG2% 1.0 1.8 5.47 386 339 A 17 ILE H A 18 VAL H 1.0 1.8 6.26 387 340 A 17 ILE H A 30 GLU H 1.0 1.8 6.65 388 341 A 17 ILE H A 30 GLU HBx 1.0 1.8 5.62 389 342 A 17 ILE H A 30 GLU O 1.0 1.8 2.90 390 343 A 17 ILE H A 30 GLU HGy 1.0 1.8 5.75 391 343 A 17 ILE H A 30 GLU HGx 1.0 1.8 5.75 392 344 A 17 ILE H A 31 GLN HA 1.0 1.8 5.52 393 345 A 17 ILE HG1y A 17 ILE HA 1.0 1.8 3.81 394 346 A 17 ILE HG1x A 17 ILE HA 1.0 1.8 4.04 395 347 A 17 ILE HD1% A 17 ILE HA 1.0 1.8 5.48 396 348 A 17 ILE HG2% A 17 ILE HA 1.0 1.8 3.86 397 349 A 18 VAL H A 17 ILE HA 1.0 1.8 3.44 398 350 A 17 ILE HA A 18 VAL HGy% 1.0 1.8 5.18 399 351 A 17 ILE HA A 43 ILE HA 1.0 1.8 5.07 400 352 A 43 ILE HD1% A 17 ILE HA 1.0 1.8 4.21 401 353 A 17 ILE HD1% A 17 ILE HB 1.0 1.8 3.92 402 354 A 17 ILE HB A 18 VAL H 1.0 1.8 5.26 403 355 A 17 ILE HB A 30 GLU HBy 1.0 1.8 4.74 404 356 A 17 ILE HB A 30 GLU HBx 1.0 1.8 5.32 405 357 A 17 ILE HB A 30 GLU HGy 1.0 1.8 4.37 406 357 A 17 ILE HB A 30 GLU HGx 1.0 1.8 4.37 407 358 A 17 ILE HB A 37 VAL HB 1.0 1.8 6.65 408 359 A 17 ILE HG1y A 18 VAL H 1.0 1.8 6.23 409 360 A 17 ILE HG1y A 30 GLU HGy 1.0 1.8 7.40 410 360 A 17 ILE HG1y A 30 GLU HGx 1.0 1.8 7.40 411 361 A 32 VAL HGx% A 17 ILE HG1y 1.0 1.8 5.66 412 362 A 32 VAL HGy% A 17 ILE HG1y 1.0 1.8 4.63 413 363 A 17 ILE HG1x A 18 VAL H 1.0 1.8 6.51 414 364 A 17 ILE HG1x A 30 GLU HBy 1.0 1.8 6.53 415 365 A 17 ILE HG1x A 30 GLU HBx 1.0 1.8 6.40 416 366 A 17 ILE HG1x A 30 GLU HGy 1.0 1.8 7.06 417 366 A 17 ILE HG1x A 30 GLU HGx 1.0 1.8 7.06 418 367 A 17 ILE HG1x A 37 VAL HB 1.0 1.8 5.22 419 368 A 30 GLU O A 17 ILE N 1.0 1.8 3.80 420 369 A 17 ILE HD1% A 30 GLU HBy 1.0 1.8 5.15 421 370 A 17 ILE HD1% A 30 GLU HBx 1.0 1.8 6.41 422 371 A 17 ILE HD1% A 30 GLU HGy 1.0 1.8 6.94 423 371 A 17 ILE HD1% A 30 GLU HGx 1.0 1.8 6.94 424 372 A 17 ILE HD1% A 37 VAL HGx% 1.0 1.8 6.64 425 373 A 17 ILE HD1% A 37 VAL HGy% 1.0 1.8 6.64 426 374 A 17 ILE HD1% A 41 ASP HA 1.0 1.8 7.89 427 375 A 17 ILE HG1y A 17 ILE HG2% 1.0 1.8 4.39 428 376 A 17 ILE HG1x A 17 ILE HG2% 1.0 1.8 4.88 429 377 A 17 ILE HD1% A 17 ILE HG2% 1.0 1.8 3.96 430 378 A 17 ILE HG2% A 18 VAL H 1.0 1.8 4.55 431 379 A 17 ILE HG2% A 30 GLU HBy 1.0 1.8 5.59 432 380 A 17 ILE HG2% A 30 GLU HBx 1.0 1.8 7.59 433 381 A 17 ILE HG2% A 30 GLU HGy 1.0 1.8 6.07 434 381 A 17 ILE HG2% A 30 GLU HGx 1.0 1.8 6.07 435 382 A 17 ILE HG2% A 41 ASP H 1.0 1.8 7.89 436 383 A 17 ILE HG2% A 42 ILE H 1.0 1.8 6.73 437 384 A 18 VAL H A 18 VAL HB 1.0 1.8 4.51 438 385 A 18 VAL H A 18 VAL HGx% 1.0 1.8 7.44 439 386 A 18 VAL H A 18 VAL HGy% 1.0 1.8 5.45 440 387 A 18 VAL H A 19 THR H 1.0 1.8 6.65 441 388 A 18 VAL H A 42 ILE HB 1.0 1.8 6.65 442 389 A 18 VAL H A 43 ILE HA 1.0 1.8 5.31 443 390 A 43 ILE HD1% A 18 VAL H 1.0 1.8 5.22 444 391 A 43 ILE HG2% A 18 VAL H 1.0 1.8 7.12 445 392 A 18 VAL HGx% A 18 VAL HA 1.0 1.8 4.05 446 393 A 18 VAL HGy% A 18 VAL HA 1.0 1.8 4.52 447 394 A 19 THR H A 18 VAL HA 1.0 1.8 3.52 448 395 A 18 VAL HA A 29 GLU HA 1.0 1.8 3.15 449 396 A 18 VAL HA A 29 GLU HBy 1.0 1.8 5.64 450 396 A 18 VAL HA A 29 GLU HBx 1.0 1.8 5.64 451 397 A 29 GLU HGy A 18 VAL HA 1.0 1.8 5.52 452 397 A 29 GLU HGx A 18 VAL HA 1.0 1.8 5.52 453 398 A 30 GLU H A 18 VAL HA 1.0 1.8 4.69 454 399 A 18 VAL HB A 19 THR H 1.0 1.8 5.35 455 400 A 18 VAL HB A 29 GLU HBy 1.0 1.8 6.61 456 400 A 18 VAL HB A 29 GLU HBx 1.0 1.8 6.61 457 401 A 29 GLU HGy A 18 VAL HB 1.0 1.8 5.30 458 401 A 29 GLU HGx A 18 VAL HB 1.0 1.8 5.30 459 402 A 18 VAL HB A 42 ILE HG2% 1.0 1.8 6.25 460 403 A 18 VAL HGx% A 19 THR H 1.0 1.8 5.83 461 404 A 18 VAL HGx% A 29 GLU HA 1.0 1.8 5.06 462 405 A 18 VAL HGx% A 29 GLU HBx 1.0 1.8 6.90 463 405 A 18 VAL HGx% A 29 GLU HBy 1.0 1.8 6.90 464 406 A 29 GLU HGx A 18 VAL HGx% 1.0 1.8 6.47 465 406 A 29 GLU HGy A 18 VAL HGx% 1.0 1.8 6.47 466 407 A 30 GLU H A 18 VAL HGx% 1.0 1.8 7.15 467 408 A 18 VAL HGy% A 19 THR H 1.0 1.8 5.72 468 409 A 18 VAL HGy% A 29 GLU HBx 1.0 1.8 7.83 469 409 A 18 VAL HGy% A 29 GLU HBy 1.0 1.8 7.83 470 410 A 29 GLU HGy A 18 VAL HGy% 1.0 1.8 6.47 471 410 A 29 GLU HGx A 18 VAL HGy% 1.0 1.8 6.47 472 411 A 18 VAL HGy% A 43 ILE HA 1.0 1.8 5.00 473 412 A 18 VAL HGy% A 44 LYS HBy 1.0 1.8 7.32 474 412 A 18 VAL HGy% A 44 LYS HBx 1.0 1.8 7.32 475 413 A 18 VAL HGy% A 44 LYS HDx 1.0 1.8 6.77 476 413 A 18 VAL HGy% A 44 LYS HDy 1.0 1.8 6.77 477 414 A 19 THR H A 19 THR HG2% 1.0 1.8 5.57 478 415 A 19 THR H A 20 LEU H 1.0 1.8 6.65 479 416 A 19 THR H A 28 SER H 1.0 1.8 6.65 480 417 A 19 THR H A 28 SER HBx 1.0 1.8 6.65 481 418 A 19 THR H A 28 SER O 1.0 1.8 2.90 482 419 A 19 THR H A 29 GLU HA 1.0 1.8 4.34 483 420 A 19 THR H A 29 GLU HBy 1.0 1.8 7.01 484 420 A 19 THR H A 29 GLU HBx 1.0 1.8 7.01 485 421 A 29 GLU HGy A 19 THR H 1.0 1.8 7.12 486 421 A 29 GLU HGx A 19 THR H 1.0 1.8 7.12 487 422 A 19 THR HG2% A 19 THR HA 1.0 1.8 3.38 488 423 A 20 LEU H A 19 THR HB 1.0 1.8 4.92 489 424 A 28 SER H A 19 THR HB 1.0 1.8 5.91 490 425 A 28 SER O A 19 THR N 1.0 1.8 3.80 491 426 A 19 THR HG2% A 20 LEU H 1.0 1.8 5.16 492 427 A 19 THR HG2% A 21 ASP HA 1.0 1.8 6.70 493 428 A 19 THR HG2% A 28 SER HBy 1.0 1.8 7.89 494 429 A 19 THR HG2% A 28 SER HBx 1.0 1.8 7.55 495 430 A 20 LEU H A 20 LEU HBy 1.0 1.8 4.36 496 431 A 20 LEU H A 20 LEU HG 1.0 1.8 5.03 497 432 A 20 LEU H A 20 LEU HDx% 1.0 1.8 5.58 498 433 A 20 LEU H A 20 LEU HDy% 1.0 1.8 5.35 499 434 A 20 LEU HG A 20 LEU HA 1.0 1.8 4.39 500 435 A 20 LEU HDx% A 20 LEU HA 1.0 1.8 5.41 501 436 A 20 LEU HDy% A 20 LEU HA 1.0 1.8 4.96 502 437 A 20 LEU HA A 27 LEU HA 1.0 1.8 5.41 503 438 A 28 SER H A 20 LEU HA 1.0 1.8 6.65 504 439 A 20 LEU HBy A 20 LEU HDx% 1.0 1.8 4.86 505 440 A 20 LEU HBy A 20 LEU HDy% 1.0 1.8 4.92 506 441 A 20 LEU HBy A 21 ASP H 1.0 1.8 5.22 507 442 A 20 LEU HBy A 23 ASP H 1.0 1.8 6.65 508 443 A 20 LEU HBy A 24 ASN H 1.0 1.8 6.65 509 444 A 20 LEU HBy A 24 ASN HA 1.0 1.8 6.34 510 445 A 20 LEU HBy A 24 ASN HD2y 1.0 1.8 6.65 511 446 A 20 LEU HDx% A 20 LEU HBx 1.0 1.8 5.03 512 447 A 20 LEU HDy% A 20 LEU HBx 1.0 1.8 5.08 513 448 A 21 ASP H A 20 LEU HBx 1.0 1.8 5.38 514 449 A 23 ASP H A 20 LEU HBx 1.0 1.8 6.65 515 450 A 24 ASN H A 20 LEU HBx 1.0 1.8 6.65 516 451 A 24 ASN HA A 20 LEU HBx 1.0 1.8 5.81 517 452 A 24 ASN HD2y A 20 LEU HBx 1.0 1.8 6.65 518 453 A 20 LEU HG A 21 ASP H 1.0 1.8 6.22 519 454 A 20 LEU HG A 24 ASN HA 1.0 1.8 5.42 520 455 A 20 LEU HDx% A 21 ASP H 1.0 1.8 7.59 521 456 A 20 LEU HDx% A 24 ASN HA 1.0 1.8 6.34 522 457 A 20 LEU HDx% A 24 ASN HD2x 1.0 1.8 7.89 523 458 A 20 LEU HDx% A 24 ASN HD2y 1.0 1.8 7.89 524 459 A 20 LEU HDx% A 27 LEU HDx% 1.0 1.8 7.19 525 460 A 20 LEU HDx% A 27 LEU HDy% 1.0 1.8 8.39 526 461 A 20 LEU HDy% A 21 ASP H 1.0 1.8 7.43 527 462 A 20 LEU HDy% A 24 ASN HA 1.0 1.8 6.25 528 463 A 20 LEU HDy% A 27 LEU H 1.0 1.8 7.00 529 464 A 20 LEU HDy% A 27 LEU HDx% 1.0 1.8 7.61 530 465 A 20 LEU HDy% A 27 LEU HDy% 1.0 1.8 7.61 531 466 A 28 SER H A 20 LEU HDy% 1.0 1.8 7.89 532 467 A 21 ASP H A 22 SER H 1.0 1.8 6.65 533 468 A 21 ASP H A 24 ASN HA 1.0 1.8 6.65 534 469 A 21 ASP H A 26 LEU H 1.0 1.8 6.65 535 470 A 22 SER H A 21 ASP HBx 1.0 1.8 6.61 536 471 A 21 ASP HBx A 26 LEU HG 1.0 1.8 5.29 537 472 A 21 ASP HBx A 26 LEU HBy 1.0 1.8 5.76 538 472 A 21 ASP HBx A 26 LEU HBx 1.0 1.8 5.76 539 473 A 21 ASP HBx A 26 LEU HDx% 1.0 1.8 5.76 540 474 A 21 ASP HBx A 26 LEU HDy% 1.0 1.8 5.62 541 475 A 22 SER H A 21 ASP HBy 1.0 1.8 4.72 542 476 A 26 LEU HG A 21 ASP HBy 1.0 1.8 5.83 543 477 A 26 LEU HDx% A 21 ASP HBy 1.0 1.8 6.01 544 478 A 26 LEU HDy% A 21 ASP HBy 1.0 1.8 5.81 545 479 A 22 SER H A 22 SER HBx 1.0 1.8 4.12 546 480 A 23 ASP H A 22 SER H 1.0 1.8 6.52 547 481 A 22 SER H A 25 ILE HD1% 1.0 1.8 7.89 548 482 A 26 LEU H A 22 SER HA 1.0 1.8 6.65 549 483 A 26 LEU HDx% A 22 SER HA 1.0 1.8 7.89 550 484 A 26 LEU HDy% A 22 SER HA 1.0 1.8 6.78 551 485 A 23 ASP H A 22 SER HBx 1.0 1.8 5.00 552 486 A 22 SER HBx A 25 ILE HB 1.0 1.8 6.43 553 487 A 22 SER HBx A 25 ILE HG1y 1.0 1.8 5.64 554 488 A 22 SER HBx A 25 ILE HG1x 1.0 1.8 6.26 555 489 A 22 SER HBx A 25 ILE HD1% 1.0 1.8 6.10 556 490 A 22 SER HBx A 25 ILE HG2% 1.0 1.8 7.63 557 491 A 26 LEU HDx% A 22 SER HBx 1.0 1.8 6.30 558 492 A 26 LEU HDy% A 22 SER HBx 1.0 1.8 7.75 559 493 A 23 ASP H A 22 SER HBy 1.0 1.8 6.03 560 494 A 25 ILE HB A 22 SER HBy 1.0 1.8 6.65 561 495 A 25 ILE HG1y A 22 SER HBy 1.0 1.8 6.53 562 496 A 25 ILE HG1x A 22 SER HBy 1.0 1.8 5.86 563 497 A 25 ILE HD1% A 22 SER HBy 1.0 1.8 5.59 564 498 A 25 ILE HG2% A 22 SER HBy 1.0 1.8 6.78 565 499 A 23 ASP H A 23 ASP HBx 1.0 1.8 4.20 566 500 A 23 ASP H A 24 ASN H 1.0 1.8 5.37 567 501 A 23 ASP H A 25 ILE HB 1.0 1.8 6.65 568 502 A 23 ASP H A 25 ILE HG1y 1.0 1.8 6.65 569 503 A 23 ASP H A 25 ILE HG1x 1.0 1.8 6.65 570 504 A 23 ASP H A 25 ILE HD1% 1.0 1.8 7.89 571 505 A 23 ASP H A 25 ILE HG2% 1.0 1.8 7.89 572 506 A 24 ASN H A 23 ASP HBx 1.0 1.8 5.93 573 507 A 25 ILE HG1y A 23 ASP HBx 1.0 1.8 5.41 574 508 A 25 ILE HG1x A 23 ASP HBx 1.0 1.8 6.47 575 509 A 25 ILE HD1% A 23 ASP HBx 1.0 1.8 6.40 576 510 A 25 ILE HG2% A 23 ASP HBx 1.0 1.8 7.89 577 511 A 24 ASN H A 23 ASP HBy 1.0 1.8 5.29 578 512 A 23 ASP HBy A 25 ILE H 1.0 1.8 6.65 579 513 A 25 ILE HG1y A 23 ASP HBy 1.0 1.8 5.43 580 514 A 25 ILE HG1x A 23 ASP HBy 1.0 1.8 6.65 581 515 A 25 ILE HD1% A 23 ASP HBy 1.0 1.8 7.27 582 516 A 25 ILE HG2% A 23 ASP HBy 1.0 1.8 7.26 583 517 A 24 ASN H A 24 ASN HBy 1.0 1.8 4.70 584 518 A 24 ASN H A 24 ASN HD2x 1.0 1.8 6.65 585 519 A 24 ASN H A 24 ASN HD2y 1.0 1.8 6.65 586 520 A 24 ASN H A 25 ILE H 1.0 1.8 5.93 587 521 A 24 ASN H A 25 ILE HG1y 1.0 1.8 6.65 588 522 A 24 ASN H A 25 ILE HG1x 1.0 1.8 6.65 589 523 A 24 ASN H A 25 ILE HG2% 1.0 1.8 7.89 590 524 A 24 ASN HA A 24 ASN HD2y 1.0 1.8 6.07 591 525 A 24 ASN HD2x A 24 ASN HBy 1.0 1.8 4.38 592 526 A 25 ILE H A 24 ASN HBy 1.0 1.8 5.21 593 527 A 27 LEU HDx% A 24 ASN HBy 1.0 1.8 7.85 594 528 A 24 ASN HD2x A 24 ASN HBx 1.0 1.8 4.24 595 529 A 25 ILE H A 24 ASN HBx 1.0 1.8 6.16 596 530 A 27 LEU HDx% A 24 ASN HBx 1.0 1.8 7.38 597 531 A 24 ASN HD2x A 25 ILE HG2% 1.0 1.8 7.89 598 532 A 25 ILE HB A 25 ILE H 1.0 1.8 4.67 599 533 A 25 ILE HG1y A 25 ILE H 1.0 1.8 4.45 600 534 A 25 ILE HG1x A 25 ILE H 1.0 1.8 4.74 601 535 A 25 ILE HD1% A 25 ILE H 1.0 1.8 6.04 602 536 A 25 ILE HG2% A 25 ILE H 1.0 1.8 5.63 603 537 A 26 LEU H A 25 ILE H 1.0 1.8 4.84 604 538 A 25 ILE HG1y A 25 ILE HA 1.0 1.8 4.30 605 539 A 25 ILE HD1% A 25 ILE HA 1.0 1.8 6.05 606 540 A 25 ILE HG2% A 25 ILE HA 1.0 1.8 4.81 607 541 A 25 ILE HD1% A 25 ILE HB 1.0 1.8 4.88 608 542 A 26 LEU H A 25 ILE HB 1.0 1.8 4.74 609 543 A 26 LEU H A 25 ILE HG1x 1.0 1.8 5.53 610 544 A 26 LEU H A 25 ILE HD1% 1.0 1.8 6.23 611 545 A 25 ILE HG1y A 25 ILE HG2% 1.0 1.8 4.84 612 546 A 25 ILE HG1x A 25 ILE HG2% 1.0 1.8 4.52 613 547 A 25 ILE HD1% A 25 ILE HG2% 1.0 1.8 4.47 614 548 A 26 LEU H A 25 ILE HG2% 1.0 1.8 5.63 615 549 A 26 LEU H A 26 LEU HG 1.0 1.8 5.14 616 550 A 26 LEU H A 26 LEU HBy 1.0 1.8 4.74 617 550 A 26 LEU H A 26 LEU HBx 1.0 1.8 4.74 618 551 A 26 LEU H A 26 LEU HDx% 1.0 1.8 6.18 619 552 A 26 LEU H A 26 LEU HDy% 1.0 1.8 6.55 620 553 A 27 LEU H A 26 LEU H 1.0 1.8 6.65 621 554 A 26 LEU HDx% A 26 LEU HA 1.0 1.8 4.36 622 555 A 26 LEU HDy% A 26 LEU HA 1.0 1.8 5.72 623 556 A 27 LEU H A 26 LEU HG 1.0 1.8 5.39 624 557 A 26 LEU HG A 26 LEU HBy 1.0 1.8 3.59 625 557 A 26 LEU HG A 26 LEU HBx 1.0 1.8 3.59 626 558 A 26 LEU HBx A 26 LEU HDx% 1.0 1.8 4.22 627 558 A 26 LEU HBy A 26 LEU HDx% 1.0 1.8 4.22 628 559 A 26 LEU HBy A 26 LEU HDy% 1.0 1.8 3.82 629 559 A 26 LEU HBx A 26 LEU HDy% 1.0 1.8 3.82 630 560 A 27 LEU H A 26 LEU HBy 1.0 1.8 5.20 631 560 A 27 LEU H A 26 LEU HBx 1.0 1.8 5.20 632 561 A 27 LEU H A 26 LEU HDx% 1.0 1.8 6.43 633 562 A 28 SER HBy A 26 LEU HDx% 1.0 1.8 6.83 634 563 A 28 SER HBx A 26 LEU HDx% 1.0 1.8 7.89 635 564 A 27 LEU H A 26 LEU HDy% 1.0 1.8 7.66 636 565 A 28 SER HBy A 26 LEU HDy% 1.0 1.8 7.03 637 566 A 28 SER HBx A 26 LEU HDy% 1.0 1.8 6.89 638 567 A 27 LEU H A 27 LEU HBy 1.0 1.8 4.21 639 568 A 27 LEU H A 27 LEU HG 1.0 1.8 5.52 640 569 A 27 LEU HDx% A 27 LEU H 1.0 1.8 6.10 641 570 A 27 LEU HDy% A 27 LEU H 1.0 1.8 7.36 642 571 A 28 SER H A 27 LEU H 1.0 1.8 6.38 643 572 A 27 LEU HA A 27 LEU HG 1.0 1.8 4.53 644 573 A 27 LEU HA A 27 LEU HDx% 1.0 1.8 5.09 645 574 A 27 LEU HA A 27 LEU HDy% 1.0 1.8 5.47 646 575 A 27 LEU HDx% A 27 LEU HBy 1.0 1.8 4.80 647 576 A 27 LEU HDy% A 27 LEU HBy 1.0 1.8 4.60 648 577 A 28 SER H A 27 LEU HBy 1.0 1.8 5.48 649 578 A 27 LEU HDx% A 27 LEU HBx 1.0 1.8 4.43 650 579 A 27 LEU HDy% A 27 LEU HBx 1.0 1.8 4.43 651 580 A 28 SER H A 27 LEU HBx 1.0 1.8 5.55 652 581 A 28 SER H A 27 LEU HG 1.0 1.8 6.60 653 582 A 28 SER H A 27 LEU HDx% 1.0 1.8 6.65 654 583 A 28 SER H A 27 LEU HDy% 1.0 1.8 7.89 655 584 A 28 SER H A 19 THR O 1.0 1.8 2.90 656 585 A 28 SER H A 28 SER HBx 1.0 1.8 4.00 657 586 A 28 SER H A 29 GLU H 1.0 1.8 6.65 658 587 A 29 GLU HBy A 28 SER HA 1.0 1.8 6.18 659 587 A 29 GLU HBx A 28 SER HA 1.0 1.8 6.18 660 588 A 29 GLU HGy A 28 SER HA 1.0 1.8 5.92 661 588 A 29 GLU HGx A 28 SER HA 1.0 1.8 5.92 662 589 A 28 SER HBy A 29 GLU H 1.0 1.8 5.16 663 590 A 28 SER HBx A 29 GLU H 1.0 1.8 5.57 664 591 A 19 THR O A 28 SER N 1.0 1.8 3.80 665 592 A 29 GLU HBy A 29 GLU H 1.0 1.8 5.10 666 592 A 29 GLU HBx A 29 GLU H 1.0 1.8 5.10 667 593 A 29 GLU HGy A 29 GLU H 1.0 1.8 5.48 668 593 A 29 GLU HGx A 29 GLU H 1.0 1.8 5.48 669 594 A 30 GLU H A 29 GLU H 1.0 1.8 6.65 670 595 A 30 GLU HGy A 29 GLU H 1.0 1.8 6.55 671 595 A 30 GLU HGx A 29 GLU H 1.0 1.8 6.55 672 596 A 29 GLU HA A 29 GLU HBy 1.0 1.8 3.44 673 596 A 29 GLU HA A 29 GLU HBx 1.0 1.8 3.44 674 597 A 29 GLU HGy A 29 GLU HA 1.0 1.8 3.36 675 597 A 29 GLU HGx A 29 GLU HA 1.0 1.8 3.36 676 598 A 30 GLU H A 29 GLU HA 1.0 1.8 3.38 677 599 A 29 GLU HGx A 29 GLU HBy 1.0 1.8 3.52 678 599 A 29 GLU HGy A 29 GLU HBy 1.0 1.8 3.52 679 599 A 29 GLU HGy A 29 GLU HBx 1.0 1.8 3.52 680 599 A 29 GLU HGx A 29 GLU HBx 1.0 1.8 3.52 681 600 A 30 GLU H A 29 GLU HBy 1.0 1.8 4.41 682 600 A 30 GLU H A 29 GLU HBx 1.0 1.8 4.41 683 601 A 29 GLU HGy A 30 GLU H 1.0 1.8 5.72 684 601 A 29 GLU HGx A 30 GLU H 1.0 1.8 5.72 685 602 A 30 GLU H A 17 ILE O 1.0 1.8 2.90 686 603 A 30 GLU H A 30 GLU HBy 1.0 1.8 4.01 687 604 A 30 GLU H A 30 GLU HBx 1.0 1.8 4.66 688 605 A 30 GLU H A 30 GLU HGy 1.0 1.8 4.56 689 605 A 30 GLU H A 30 GLU HGx 1.0 1.8 4.56 690 606 A 30 GLU H A 31 GLN H 1.0 1.8 6.65 691 607 A 32 VAL HGx% A 30 GLU H 1.0 1.8 7.89 692 608 A 30 GLU HGy A 30 GLU HA 1.0 1.8 4.26 693 608 A 30 GLU HGx A 30 GLU HA 1.0 1.8 4.26 694 609 A 31 GLN H A 30 GLU HA 1.0 1.8 3.06 695 610 A 17 ILE O A 30 GLU N 1.0 1.8 3.80 696 611 A 31 GLN H A 31 GLN HBy 1.0 1.8 3.94 697 612 A 31 GLN H A 31 GLN HE2y 1.0 1.8 6.65 698 613 A 31 GLN H A 31 GLN HGy 1.0 1.8 4.41 699 614 A 31 GLN H A 31 GLN HGx 1.0 1.8 4.60 700 615 A 32 VAL H A 31 GLN H 1.0 1.8 6.65 701 616 A 31 GLN HA A 31 GLN HE2y 1.0 1.8 5.78 702 617 A 31 GLN HA A 31 GLN HE2x 1.0 1.8 5.34 703 618 A 31 GLN HA A 31 GLN HGy 1.0 1.8 4.21 704 619 A 31 GLN HA A 31 GLN HGx 1.0 1.8 4.63 705 620 A 32 VAL H A 31 GLN HA 1.0 1.8 3.28 706 621 A 32 VAL HGx% A 31 GLN HA 1.0 1.8 7.00 707 622 A 32 VAL HGy% A 31 GLN HA 1.0 1.8 6.04 708 623 A 31 GLN HBy A 31 GLN HE2y 1.0 1.8 4.62 709 624 A 31 GLN HBy A 31 GLN HE2x 1.0 1.8 5.63 710 625 A 32 VAL H A 31 GLN HBy 1.0 1.8 5.64 711 626 A 31 GLN HE2y A 31 GLN HBx 1.0 1.8 3.21 712 627 A 31 GLN HE2x A 31 GLN HBx 1.0 1.8 4.11 713 628 A 32 VAL H A 31 GLN HBx 1.0 1.8 5.99 714 629 A 32 VAL H A 31 GLN HE2x 1.0 1.8 6.65 715 630 A 31 GLN HE2y A 31 GLN HGy 1.0 1.8 3.56 716 631 A 32 VAL H A 31 GLN HGy 1.0 1.8 5.43 717 632 A 31 GLN HE2y A 31 GLN HGx 1.0 1.8 4.35 718 633 A 32 VAL H A 15 ALA O 1.0 1.8 2.90 719 634 A 32 VAL H A 32 VAL HB 1.0 1.8 4.69 720 635 A 32 VAL H A 32 VAL HGx% 1.0 1.8 4.26 721 636 A 32 VAL H A 32 VAL HGy% 1.0 1.8 4.22 722 637 A 32 VAL H A 33 ASP H 1.0 1.8 6.65 723 638 A 32 VAL HB A 32 VAL HA 1.0 1.8 3.23 724 639 A 32 VAL HGx% A 32 VAL HA 1.0 1.8 3.61 725 640 A 32 VAL HGy% A 32 VAL HA 1.0 1.8 4.92 726 641 A 33 ASP H A 32 VAL HA 1.0 1.8 3.31 727 642 A 32 VAL HB A 33 ASP H 1.0 1.8 3.65 728 643 A 32 VAL HB A 36 LEU HDy% 1.0 1.8 6.89 729 644 A 15 ALA O A 32 VAL N 1.0 1.8 3.80 730 645 A 32 VAL HGx% A 33 ASP H 1.0 1.8 5.93 731 646 A 32 VAL HGy% A 33 ASP H 1.0 1.8 4.78 732 647 A 33 ASP H A 33 ASP HBx 1.0 1.8 4.39 733 648 A 34 VAL H A 33 ASP H 1.0 1.8 6.65 734 649 A 35 GLU H A 33 ASP H 1.0 1.8 6.13 735 650 A 33 ASP H A 36 LEU HBy 1.0 1.8 5.95 736 651 A 33 ASP H A 36 LEU HBx 1.0 1.8 5.77 737 652 A 33 ASP H A 36 LEU HDx% 1.0 1.8 5.08 738 653 A 33 ASP H A 36 LEU HDy% 1.0 1.8 6.22 739 654 A 34 VAL H A 33 ASP HA 1.0 1.8 3.40 740 655 A 33 ASP HA A 36 LEU HDx% 1.0 1.8 6.07 741 656 A 33 ASP HA A 36 LEU HDy% 1.0 1.8 7.89 742 657 A 34 VAL H A 33 ASP HBy 1.0 1.8 5.24 743 658 A 34 VAL HGx% A 33 ASP HBy 1.0 1.8 6.88 744 659 A 35 GLU H A 33 ASP HBy 1.0 1.8 4.98 745 660 A 33 ASP HBy A 36 LEU H 1.0 1.8 6.09 746 661 A 33 ASP HBy A 36 LEU HG 1.0 1.8 5.21 747 662 A 36 LEU HDx% A 33 ASP HBy 1.0 1.8 5.06 748 663 A 34 VAL H A 33 ASP HBx 1.0 1.8 4.71 749 664 A 35 GLU H A 33 ASP HBx 1.0 1.8 6.65 750 665 A 33 ASP HBx A 36 LEU H 1.0 1.8 6.02 751 666 A 33 ASP HBx A 36 LEU HG 1.0 1.8 4.54 752 667 A 33 ASP HBx A 36 LEU HDx% 1.0 1.8 5.62 753 668 A 36 LEU HDy% A 33 ASP HBx 1.0 1.8 6.90 754 669 A 34 VAL H A 34 VAL HB 1.0 1.8 3.71 755 670 A 34 VAL H A 34 VAL HGx% 1.0 1.8 4.93 756 671 A 34 VAL H A 34 VAL HGy% 1.0 1.8 5.64 757 672 A 34 VAL H A 35 GLU H 1.0 1.8 6.65 758 673 A 34 VAL HA A 34 VAL HB 1.0 1.8 3.48 759 674 A 34 VAL HGx% A 34 VAL HA 1.0 1.8 4.91 760 675 A 34 VAL HA A 34 VAL HGy% 1.0 1.8 3.63 761 676 A 34 VAL HA A 36 LEU H 1.0 1.8 5.18 762 677 A 34 VAL HA A 37 VAL H 1.0 1.8 5.45 763 678 A 34 VAL HA A 37 VAL HB 1.0 1.8 5.33 764 679 A 35 GLU H A 34 VAL HGy% 1.0 1.8 6.01 765 680 A 34 VAL HGy% A 53 VAL HGy% 1.0 1.8 6.44 766 681 A 35 GLU H A 35 GLU HBy 1.0 1.8 3.69 767 682 A 35 GLU H A 35 GLU HBx 1.0 1.8 4.31 768 683 A 35 GLU H A 35 GLU HGy 1.0 1.8 5.32 769 683 A 35 GLU H A 35 GLU HGx 1.0 1.8 5.32 770 684 A 35 GLU H A 36 LEU H 1.0 1.8 6.02 771 685 A 35 GLU H A 36 LEU HA 1.0 1.8 6.65 772 686 A 35 GLU H A 36 LEU HBx 1.0 1.8 6.65 773 687 A 35 GLU H A 37 VAL H 1.0 1.8 6.65 774 688 A 35 GLU HBy A 35 GLU HA 1.0 1.8 3.36 775 689 A 35 GLU HGy A 35 GLU HA 1.0 1.8 3.52 776 689 A 35 GLU HGx A 35 GLU HA 1.0 1.8 3.52 777 690 A 37 VAL H A 35 GLU HA 1.0 1.8 6.65 778 691 A 36 LEU H A 35 GLU HBy 1.0 1.8 5.12 779 692 A 36 LEU HDx% A 35 GLU HBy 1.0 1.8 7.89 780 693 A 36 LEU HDy% A 35 GLU HBy 1.0 1.8 7.67 781 694 A 35 GLU HBx A 35 GLU HGy 1.0 1.8 3.19 782 694 A 35 GLU HBx A 35 GLU HGx 1.0 1.8 3.19 783 695 A 36 LEU H A 35 GLU HBx 1.0 1.8 5.13 784 696 A 36 LEU HDx% A 35 GLU HBx 1.0 1.8 6.78 785 697 A 36 LEU HDy% A 35 GLU HBx 1.0 1.8 6.04 786 698 A 36 LEU H A 35 GLU HGy 1.0 1.8 5.87 787 698 A 36 LEU H A 35 GLU HGx 1.0 1.8 5.87 788 699 A 36 LEU HDy% A 35 GLU HGx 1.0 1.8 6.80 789 699 A 36 LEU HDy% A 35 GLU HGy 1.0 1.8 6.80 790 700 A 36 LEU HBx A 36 LEU H 1.0 1.8 4.69 791 701 A 36 LEU H A 36 LEU HG 1.0 1.8 5.37 792 702 A 36 LEU HDx% A 36 LEU H 1.0 1.8 6.13 793 703 A 36 LEU HDy% A 36 LEU H 1.0 1.8 6.20 794 704 A 36 LEU H A 37 VAL H 1.0 1.8 5.61 795 705 A 36 LEU HG A 36 LEU HA 1.0 1.8 4.30 796 706 A 36 LEU HDx% A 36 LEU HA 1.0 1.8 5.62 797 707 A 36 LEU HDy% A 36 LEU HA 1.0 1.8 4.20 798 708 A 36 LEU HA A 38 GLN H 1.0 1.8 6.65 799 709 A 36 LEU HBy A 36 LEU HG 1.0 1.8 3.13 800 710 A 36 LEU HBy A 36 LEU HDx% 1.0 1.8 3.78 801 711 A 36 LEU HDy% A 36 LEU HBy 1.0 1.8 4.43 802 712 A 36 LEU HBy A 37 VAL H 1.0 1.8 5.15 803 713 A 36 LEU HBx A 36 LEU HDx% 1.0 1.8 4.38 804 714 A 36 LEU HDy% A 36 LEU HBx 1.0 1.8 4.03 805 715 A 36 LEU HBx A 37 VAL H 1.0 1.8 6.40 806 716 A 36 LEU HG A 37 VAL H 1.0 1.8 6.65 807 717 A 37 VAL HB A 37 VAL H 1.0 1.8 4.52 808 718 A 37 VAL HGx% A 37 VAL H 1.0 1.8 5.23 809 719 A 37 VAL HGy% A 37 VAL H 1.0 1.8 5.41 810 720 A 37 VAL H A 38 GLN H 1.0 1.8 6.65 811 721 A 37 VAL H A 38 GLN HA 1.0 1.8 6.65 812 722 A 37 VAL HGx% A 37 VAL HA 1.0 1.8 4.87 813 723 A 37 VAL HGy% A 37 VAL HA 1.0 1.8 5.06 814 724 A 37 VAL HB A 38 GLN H 1.0 1.8 6.23 815 725 A 37 VAL HGx% A 38 GLN H 1.0 1.8 6.05 816 726 A 53 VAL HGx% A 37 VAL HGx% 1.0 1.8 7.55 817 727 A 37 VAL HGy% A 38 GLN H 1.0 1.8 5.58 818 728 A 38 GLN H A 38 GLN HBy 1.0 1.8 4.66 819 729 A 38 GLN H A 38 GLN HE2y 1.0 1.8 6.65 820 730 A 38 GLN H A 38 GLN HGy 1.0 1.8 4.75 821 731 A 38 GLN H A 38 GLN HGx 1.0 1.8 4.81 822 732 A 38 GLN H A 39 ARG H 1.0 1.8 6.65 823 733 A 41 ASP H A 38 GLN H 1.0 1.8 6.65 824 734 A 38 GLN HA A 102 VAL H 1.0 1.8 6.65 825 735 A 38 GLN HA A 102 VAL HGx% 1.0 1.8 6.67 826 736 A 38 GLN HA A 102 VAL HGy% 1.0 1.8 6.89 827 737 A 38 GLN HA A 38 GLN HE2y 1.0 1.8 6.65 828 738 A 38 GLN HA A 38 GLN HE2x 1.0 1.8 6.65 829 739 A 38 GLN HA A 38 GLN HGy 1.0 1.8 4.74 830 740 A 38 GLN HA A 38 GLN HGx 1.0 1.8 4.48 831 741 A 38 GLN HA A 39 ARG H 1.0 1.8 3.48 832 742 A 38 GLN HBy A 38 GLN HE2y 1.0 1.8 4.24 833 743 A 38 GLN HBy A 38 GLN HE2x 1.0 1.8 4.77 834 744 A 38 GLN HBy A 39 ARG H 1.0 1.8 5.29 835 745 A 38 GLN HE2y A 38 GLN HBx 1.0 1.8 6.18 836 746 A 38 GLN HE2x A 38 GLN HBx 1.0 1.8 5.84 837 747 A 39 ARG H A 38 GLN HBx 1.0 1.8 5.13 838 748 A 38 GLN HE2y A 39 ARG H 1.0 1.8 6.65 839 749 A 39 ARG H A 38 GLN HE2x 1.0 1.8 6.65 840 750 A 38 GLN HE2y A 38 GLN HGy 1.0 1.8 4.36 841 751 A 38 GLN HGy A 39 ARG H 1.0 1.8 5.57 842 752 A 38 GLN HE2y A 38 GLN HGx 1.0 1.8 4.43 843 753 A 38 GLN HGx A 39 ARG H 1.0 1.8 5.26 844 754 A 39 ARG H A 101 HIS HA 1.0 1.8 6.65 845 755 A 39 ARG H A 102 VAL HGx% 1.0 1.8 7.18 846 756 A 39 ARG H A 102 VAL HGy% 1.0 1.8 6.08 847 757 A 39 ARG H A 39 ARG HDy 1.0 1.8 6.65 848 758 A 39 ARG H A 39 ARG HDx 1.0 1.8 6.65 849 759 A 39 ARG H A 39 ARG HGy 1.0 1.8 5.32 850 760 A 39 ARG H A 39 ARG HGx 1.0 1.8 5.40 851 761 A 39 ARG H A 39 ARG HBy 1.0 1.8 4.80 852 761 A 39 ARG H A 39 ARG HBx 1.0 1.8 4.80 853 762 A 39 ARG H A 40 GLY H 1.0 1.8 6.65 854 763 A 39 ARG HA A 100 THR HA 1.0 1.8 4.47 855 764 A 102 VAL HGx% A 39 ARG HA 1.0 1.8 7.59 856 765 A 102 VAL HGy% A 39 ARG HA 1.0 1.8 7.51 857 766 A 39 ARG HDy A 39 ARG HA 1.0 1.8 6.65 858 767 A 39 ARG HDx A 39 ARG HA 1.0 1.8 6.65 859 768 A 39 ARG HGy A 39 ARG HA 1.0 1.8 4.30 860 769 A 39 ARG HBy A 39 ARG HA 1.0 1.8 3.88 861 769 A 39 ARG HBx A 39 ARG HA 1.0 1.8 3.88 862 770 A 39 ARG HDx A 100 THR HA 1.0 1.8 6.57 863 771 A 102 VAL HGx% A 39 ARG HDx 1.0 1.8 5.11 864 772 A 102 VAL HGy% A 39 ARG HDx 1.0 1.8 6.32 865 773 A 39 ARG HDx A 40 GLY H 1.0 1.8 6.65 866 774 A 39 ARG HGy A 100 THR HA 1.0 1.8 5.73 867 775 A 39 ARG HGy A 40 GLY H 1.0 1.8 5.32 868 776 A 39 ARG HGx A 100 THR HA 1.0 1.8 5.58 869 777 A 39 ARG HGx A 101 HIS H 1.0 1.8 6.50 870 778 A 39 ARG HDy A 39 ARG HGx 1.0 1.8 3.37 871 779 A 39 ARG HGx A 40 GLY H 1.0 1.8 5.55 872 780 A 39 ARG HGx A 40 GLY HAy 1.0 1.8 5.71 873 781 A 39 ARG HGx A 40 GLY HAx 1.0 1.8 5.71 874 782 A 39 ARG HBy A 100 THR HA 1.0 1.8 4.94 875 782 A 39 ARG HBx A 100 THR HA 1.0 1.8 4.94 876 783 A 101 HIS HA A 39 ARG HBy 1.0 1.8 5.25 877 783 A 101 HIS HA A 39 ARG HBx 1.0 1.8 5.25 878 784 A 39 ARG HDy A 39 ARG HBy 1.0 1.8 3.87 879 784 A 39 ARG HDy A 39 ARG HBx 1.0 1.8 3.87 880 785 A 39 ARG HDx A 39 ARG HBy 1.0 1.8 3.19 881 785 A 39 ARG HDx A 39 ARG HBx 1.0 1.8 3.19 882 786 A 39 ARG HBy A 40 GLY H 1.0 1.8 5.12 883 786 A 39 ARG HBx A 40 GLY H 1.0 1.8 5.12 884 787 A 39 ARG HBy A 40 GLY HAy 1.0 1.8 6.26 885 787 A 39 ARG HBx A 40 GLY HAy 1.0 1.8 6.26 886 788 A 39 ARG HBy A 40 GLY HAx 1.0 1.8 7.30 887 788 A 39 ARG HBx A 40 GLY HAx 1.0 1.8 7.30 888 789 A 41 ASP H A 39 ARG HBy 1.0 1.8 6.56 889 789 A 41 ASP H A 39 ARG HBx 1.0 1.8 6.56 890 790 A 40 GLY H A 100 THR HA 1.0 1.8 6.65 891 791 A 41 ASP H A 40 GLY H 1.0 1.8 6.30 892 792 A 41 ASP H A 99 ALA HB% 1.0 1.8 6.79 893 793 A 41 ASP H A 41 ASP HBy 1.0 1.8 4.44 894 794 A 41 ASP H A 42 ILE H 1.0 1.8 6.65 895 795 A 43 ILE HD1% A 41 ASP H 1.0 1.8 7.67 896 796 A 41 ASP HA A 42 ILE H 1.0 1.8 3.36 897 797 A 43 ILE HD1% A 41 ASP HA 1.0 1.8 6.60 898 798 A 42 ILE H A 41 ASP HBy 1.0 1.8 5.07 899 799 A 43 ILE HD1% A 41 ASP HBy 1.0 1.8 4.82 900 800 A 41 ASP HBy A 43 ILE HG1y 1.0 1.8 5.93 901 800 A 41 ASP HBy A 43 ILE HG1x 1.0 1.8 5.93 902 801 A 42 ILE H A 41 ASP HBx 1.0 1.8 4.35 903 802 A 43 ILE HD1% A 41 ASP HBx 1.0 1.8 4.88 904 803 A 43 ILE HG1y A 41 ASP HBx 1.0 1.8 5.94 905 803 A 43 ILE HG1x A 41 ASP HBx 1.0 1.8 5.94 906 804 A 42 ILE H A 42 ILE HB 1.0 1.8 4.40 907 805 A 42 ILE H A 42 ILE HG1y 1.0 1.8 5.02 908 806 A 42 ILE H A 42 ILE HG1x 1.0 1.8 5.07 909 807 A 42 ILE H A 42 ILE HD1% 1.0 1.8 5.75 910 808 A 42 ILE H A 42 ILE HG2% 1.0 1.8 5.77 911 809 A 42 ILE HA A 98 CYS HA 1.0 1.8 4.87 912 810 A 42 ILE HA A 99 ALA H 1.0 1.8 5.14 913 811 A 99 ALA HB% A 42 ILE HA 1.0 1.8 6.07 914 812 A 42 ILE HG1y A 42 ILE HA 1.0 1.8 4.53 915 813 A 42 ILE HG1x A 42 ILE HA 1.0 1.8 4.22 916 814 A 42 ILE HD1% A 42 ILE HA 1.0 1.8 6.13 917 815 A 42 ILE HG2% A 42 ILE HA 1.0 1.8 4.07 918 816 A 42 ILE HA A 43 ILE H 1.0 1.8 3.62 919 817 A 43 ILE HG1y A 42 ILE HA 1.0 1.8 5.00 920 817 A 43 ILE HG1x A 42 ILE HA 1.0 1.8 5.00 921 818 A 42 ILE HB A 42 ILE HD1% 1.0 1.8 4.84 922 819 A 42 ILE HB A 43 ILE H 1.0 1.8 5.66 923 820 A 42 ILE HG1y A 98 CYS HA 1.0 1.8 5.96 924 821 A 42 ILE HG1y A 98 CYS HBy 1.0 1.8 6.65 925 822 A 42 ILE HG1y A 98 CYS HBx 1.0 1.8 5.54 926 823 A 42 ILE HG1y A 43 ILE H 1.0 1.8 5.95 927 824 A 42 ILE HG1x A 98 CYS HBy 1.0 1.8 6.65 928 825 A 42 ILE HG1x A 98 CYS HBx 1.0 1.8 6.17 929 826 A 42 ILE HD1% A 98 CYS HBy 1.0 1.8 6.04 930 827 A 42 ILE HD1% A 98 CYS HBx 1.0 1.8 5.82 931 828 A 42 ILE HG2% A 98 CYS HA 1.0 1.8 5.62 932 829 A 42 ILE HG2% A 42 ILE HG1y 1.0 1.8 4.43 933 830 A 42 ILE HG2% A 42 ILE HG1x 1.0 1.8 4.48 934 831 A 42 ILE HG2% A 42 ILE HD1% 1.0 1.8 3.96 935 832 A 42 ILE HG2% A 43 ILE H 1.0 1.8 4.49 936 833 A 43 ILE HA A 42 ILE HG2% 1.0 1.8 5.33 937 834 A 43 ILE H A 97 ILE H 1.0 1.8 6.65 938 835 A 98 CYS HA A 43 ILE H 1.0 1.8 5.10 939 836 A 43 ILE H A 43 ILE HB 1.0 1.8 4.21 940 837 A 43 ILE HD1% A 43 ILE H 1.0 1.8 5.18 941 838 A 43 ILE HG1y A 43 ILE H 1.0 1.8 4.46 942 838 A 43 ILE HG1x A 43 ILE H 1.0 1.8 4.46 943 839 A 43 ILE HG2% A 43 ILE H 1.0 1.8 7.89 944 840 A 44 LYS H A 43 ILE H 1.0 1.8 6.65 945 841 A 43 ILE HD1% A 43 ILE HA 1.0 1.8 4.03 946 842 A 43 ILE HA A 43 ILE HG1y 1.0 1.8 4.34 947 842 A 43 ILE HA A 43 ILE HG1x 1.0 1.8 4.34 948 843 A 43 ILE HG2% A 43 ILE HA 1.0 1.8 3.99 949 844 A 44 LYS H A 43 ILE HA 1.0 1.8 3.62 950 845 A 43 ILE HD1% A 43 ILE HB 1.0 1.8 5.02 951 846 A 43 ILE HG1y A 43 ILE HB 1.0 1.8 3.67 952 846 A 43 ILE HG1x A 43 ILE HB 1.0 1.8 3.67 953 847 A 44 LYS H A 43 ILE HB 1.0 1.8 6.65 954 848 A 43 ILE HD1% A 99 ALA H 1.0 1.8 7.89 955 849 A 43 ILE HD1% A 44 LYS H 1.0 1.8 6.16 956 850 A 43 ILE HG1y A 99 ALA H 1.0 1.8 7.40 957 850 A 43 ILE HG1x A 99 ALA H 1.0 1.8 7.40 958 851 A 44 LYS H A 43 ILE HG1y 1.0 1.8 6.03 959 851 A 44 LYS H A 43 ILE HG1x 1.0 1.8 6.03 960 852 A 43 ILE HG2% A 99 ALA H 1.0 1.8 7.89 961 853 A 43 ILE HD1% A 43 ILE HG2% 1.0 1.8 3.96 962 854 A 43 ILE HG2% A 43 ILE HG1x 1.0 1.8 3.74 963 854 A 43 ILE HG2% A 43 ILE HG1y 1.0 1.8 3.74 964 855 A 43 ILE HG2% A 44 LYS H 1.0 1.8 4.86 965 856 A 44 LYS H A 44 LYS HEx 1.0 1.8 6.65 966 857 A 44 LYS H A 44 LYS HBy 1.0 1.8 5.09 967 857 A 44 LYS H A 44 LYS HBx 1.0 1.8 5.09 968 858 A 44 LYS H A 44 LYS HDy 1.0 1.8 6.62 969 858 A 44 LYS H A 44 LYS HDx 1.0 1.8 6.62 970 859 A 44 LYS H A 44 LYS HGy 1.0 1.8 5.88 971 859 A 44 LYS H A 44 LYS HGx 1.0 1.8 5.88 972 860 A 44 LYS H A 45 VAL H 1.0 1.8 6.65 973 861 A 44 LYS HA A 96 LEU HA 1.0 1.8 4.45 974 862 A 44 LYS HA A 96 LEU HG 1.0 1.8 6.65 975 863 A 44 LYS HA A 96 LEU HDy% 1.0 1.8 7.89 976 864 A 97 ILE H A 44 LYS HA 1.0 1.8 5.02 977 865 A 44 LYS HA A 44 LYS HEy 1.0 1.8 5.42 978 866 A 44 LYS HEx A 44 LYS HA 1.0 1.8 4.91 979 867 A 44 LYS HDy A 44 LYS HA 1.0 1.8 5.00 980 867 A 44 LYS HDx A 44 LYS HA 1.0 1.8 5.00 981 868 A 44 LYS HGy A 44 LYS HA 1.0 1.8 4.79 982 868 A 44 LYS HGx A 44 LYS HA 1.0 1.8 4.79 983 869 A 45 VAL H A 44 LYS HA 1.0 1.8 3.69 984 870 A 44 LYS HEy A 96 LEU HDx% 1.0 1.8 4.55 985 871 A 45 VAL H A 44 LYS HEy 1.0 1.8 6.65 986 872 A 44 LYS HEx A 96 LEU HG 1.0 1.8 5.34 987 873 A 44 LYS HEx A 96 LEU HDx% 1.0 1.8 4.54 988 874 A 44 LYS HEx A 96 LEU HDy% 1.0 1.8 4.61 989 875 A 44 LYS HEx A 45 VAL H 1.0 1.8 6.65 990 876 A 44 LYS HBx A 96 LEU HDx% 1.0 1.8 7.82 991 876 A 44 LYS HBy A 96 LEU HDx% 1.0 1.8 7.82 992 877 A 44 LYS HBx A 96 LEU HDy% 1.0 1.8 8.79 993 877 A 44 LYS HBy A 96 LEU HDy% 1.0 1.8 8.79 994 878 A 44 LYS HBy A 44 LYS HEy 1.0 1.8 5.76 995 878 A 44 LYS HBx A 44 LYS HEy 1.0 1.8 5.76 996 879 A 44 LYS HBy A 44 LYS HEx 1.0 1.8 5.32 997 879 A 44 LYS HBx A 44 LYS HEx 1.0 1.8 5.32 998 880 A 44 LYS HBy A 44 LYS HDx 1.0 1.8 4.37 999 880 A 44 LYS HBy A 44 LYS HDy 1.0 1.8 4.37 1000 880 A 44 LYS HBx A 44 LYS HDy 1.0 1.8 4.37 1001 880 A 44 LYS HBx A 44 LYS HDx 1.0 1.8 4.37 1002 881 A 44 LYS HBy A 44 LYS HGy 1.0 1.8 3.52 1003 881 A 44 LYS HBy A 44 LYS HGx 1.0 1.8 3.52 1004 881 A 44 LYS HBx A 44 LYS HGy 1.0 1.8 3.52 1005 881 A 44 LYS HBx A 44 LYS HGx 1.0 1.8 3.52 1006 882 A 44 LYS HBy A 45 VAL H 1.0 1.8 5.97 1007 882 A 44 LYS HBx A 45 VAL H 1.0 1.8 5.97 1008 883 A 44 LYS HDx A 96 LEU HDx% 1.0 1.8 6.78 1009 883 A 44 LYS HDy A 96 LEU HDx% 1.0 1.8 6.78 1010 884 A 44 LYS HDx A 96 LEU HDy% 1.0 1.8 6.78 1011 884 A 44 LYS HDy A 96 LEU HDy% 1.0 1.8 6.78 1012 885 A 44 LYS HDy A 45 VAL H 1.0 1.8 6.57 1013 885 A 44 LYS HDx A 45 VAL H 1.0 1.8 6.57 1014 886 A 44 LYS HGy A 96 LEU HDx% 1.0 1.8 7.19 1015 886 A 44 LYS HGx A 96 LEU HDx% 1.0 1.8 7.19 1016 887 A 44 LYS HGy A 96 LEU HDy% 1.0 1.8 8.18 1017 887 A 44 LYS HGx A 96 LEU HDy% 1.0 1.8 8.18 1018 888 A 44 LYS HGy A 44 LYS HEy 1.0 1.8 4.56 1019 888 A 44 LYS HGx A 44 LYS HEy 1.0 1.8 4.56 1020 889 A 44 LYS HEx A 44 LYS HGy 1.0 1.8 5.19 1021 889 A 44 LYS HEx A 44 LYS HGx 1.0 1.8 5.19 1022 890 A 44 LYS HDx A 44 LYS HGy 1.0 1.8 3.52 1023 890 A 44 LYS HDy A 44 LYS HGy 1.0 1.8 3.52 1024 890 A 44 LYS HDy A 44 LYS HGx 1.0 1.8 3.52 1025 890 A 44 LYS HDx A 44 LYS HGx 1.0 1.8 3.52 1026 891 A 44 LYS HGy A 45 VAL H 1.0 1.8 5.69 1027 891 A 44 LYS HGx A 45 VAL H 1.0 1.8 5.69 1028 892 A 45 VAL H A 95 LEU H 1.0 1.8 6.65 1029 893 A 45 VAL H A 95 LEU O 1.0 1.8 2.90 1030 894 A 45 VAL H A 96 LEU HA 1.0 1.8 6.65 1031 895 A 45 VAL H A 45 VAL HB 1.0 1.8 4.23 1032 896 A 45 VAL H A 45 VAL HGx% 1.0 1.8 5.53 1033 897 A 45 VAL H A 45 VAL HGy% 1.0 1.8 5.46 1034 898 A 45 VAL H A 46 VAL H 1.0 1.8 6.65 1035 899 A 45 VAL HGx% A 45 VAL HA 1.0 1.8 4.61 1036 900 A 45 VAL HGy% A 45 VAL HA 1.0 1.8 3.81 1037 901 A 46 VAL H A 45 VAL HA 1.0 1.8 3.99 1038 902 A 97 ILE H A 45 VAL HB 1.0 1.8 5.53 1039 903 A 45 VAL HB A 46 VAL H 1.0 1.8 5.00 1040 904 A 95 LEU O A 45 VAL N 1.0 1.8 3.80 1041 905 A 45 VAL HGx% A 95 LEU HDx% 1.0 1.8 5.98 1042 906 A 45 VAL HGx% A 46 VAL H 1.0 1.8 5.54 1043 907 A 45 VAL HGx% A 49 GLY H 1.0 1.8 7.89 1044 908 A 45 VAL HGx% A 49 GLY HAx 1.0 1.8 7.89 1045 909 A 45 VAL HGx% A 90 ASN HD2x 1.0 1.8 5.83 1046 910 A 45 VAL HGx% A 90 ASN HD2y 1.0 1.8 6.86 1047 911 A 95 LEU H A 45 VAL HGy% 1.0 1.8 7.89 1048 912 A 45 VAL HGy% A 95 LEU HDx% 1.0 1.8 7.12 1049 913 A 45 VAL HGy% A 97 ILE HD1% 1.0 1.8 6.21 1050 914 A 45 VAL HGy% A 46 VAL H 1.0 1.8 5.03 1051 915 A 45 VAL HGy% A 49 GLY H 1.0 1.8 5.57 1052 916 A 45 VAL HGy% A 49 GLY HAy 1.0 1.8 7.89 1053 917 A 45 VAL HGy% A 49 GLY HAx 1.0 1.8 7.89 1054 918 A 45 VAL HGy% A 50 LYS H 1.0 1.8 5.94 1055 919 A 45 VAL HGy% A 90 ASN H 1.0 1.8 6.37 1056 920 A 45 VAL HGy% A 90 ASN HBy 1.0 1.8 4.70 1057 921 A 45 VAL HGy% A 90 ASN HBx 1.0 1.8 4.82 1058 922 A 45 VAL HGy% A 90 ASN HD2x 1.0 1.8 5.82 1059 923 A 45 VAL HGy% A 90 ASN HD2y 1.0 1.8 6.71 1060 924 A 46 VAL H A 46 VAL HB 1.0 1.8 4.70 1061 925 A 46 VAL H A 46 VAL HGx% 1.0 1.8 4.15 1062 926 A 46 VAL H A 46 VAL HGy% 1.0 1.8 5.34 1063 927 A 95 LEU H A 46 VAL HA 1.0 1.8 6.21 1064 928 A 46 VAL HGx% A 46 VAL HA 1.0 1.8 3.84 1065 929 A 46 VAL HGy% A 46 VAL HA 1.0 1.8 4.62 1066 930 A 46 VAL HA A 94 SER HA 1.0 1.8 5.21 1067 931 A 49 GLY H A 46 VAL HGx% 1.0 1.8 7.89 1068 932 A 46 VAL HGy% A 48 GLY HAy 1.0 1.8 7.09 1069 933 A 46 VAL HGy% A 48 GLY HAx 1.0 1.8 6.00 1070 934 A 49 GLY H A 46 VAL HGy% 1.0 1.8 6.34 1071 935 A 47 PRO HA A 48 GLY H 1.0 1.8 3.60 1072 936 A 90 ASN HD2x A 47 PRO HA 1.0 1.8 5.09 1073 937 A 90 ASN HD2y A 47 PRO HA 1.0 1.8 5.20 1074 938 A 47 PRO HA A 92 ASN HA 1.0 1.8 6.53 1075 939 A 92 ASN HA A 47 PRO HBy 1.0 1.8 5.71 1076 939 A 92 ASN HA A 47 PRO HBx 1.0 1.8 5.71 1077 940 A 92 ASN HA A 47 PRO HGy 1.0 1.8 7.18 1078 940 A 92 ASN HA A 47 PRO HGx 1.0 1.8 7.18 1079 941 A 49 GLY H A 48 GLY H 1.0 1.8 4.76 1080 942 A 48 GLY H A 89 ILE HG2% 1.0 1.8 7.89 1081 943 A 90 ASN HBx A 48 GLY H 1.0 1.8 5.22 1082 944 A 90 ASN HD2x A 48 GLY H 1.0 1.8 6.65 1083 945 A 90 ASN HD2y A 48 GLY H 1.0 1.8 6.65 1084 946 A 48 GLY H A 91 GLN HA 1.0 1.8 5.47 1085 947 A 48 GLY HAy A 89 ILE HG2% 1.0 1.8 5.38 1086 948 A 48 GLY HAy A 91 GLN HA 1.0 1.8 4.60 1087 949 A 48 GLY HAx A 89 ILE HG2% 1.0 1.8 7.23 1088 950 A 90 ASN H A 48 GLY HAx 1.0 1.8 6.65 1089 951 A 48 GLY HAx A 91 GLN HA 1.0 1.8 5.84 1090 952 A 49 GLY H A 90 ASN H 1.0 1.8 6.65 1091 953 A 49 GLY H A 90 ASN HBy 1.0 1.8 6.51 1092 954 A 49 GLY H A 90 ASN HBx 1.0 1.8 5.14 1093 955 A 49 GLY H A 90 ASN HD2x 1.0 1.8 6.65 1094 956 A 49 GLY H A 90 ASN HD2y 1.0 1.8 6.65 1095 957 A 49 GLY HAx A 50 LYS H 1.0 1.8 3.90 1096 958 A 50 LYS H A 50 LYS HGy 1.0 1.8 5.04 1097 959 A 50 LYS H A 50 LYS HGx 1.0 1.8 4.68 1098 960 A 50 LYS H A 50 LYS HBy 1.0 1.8 4.77 1099 960 A 50 LYS H A 50 LYS HBx 1.0 1.8 4.77 1100 961 A 50 LYS H A 50 LYS HDy 1.0 1.8 6.68 1101 961 A 50 LYS H A 50 LYS HDx 1.0 1.8 6.68 1102 962 A 50 LYS H A 50 LYS HEy 1.0 1.8 7.40 1103 962 A 50 LYS H A 50 LYS HEx 1.0 1.8 7.40 1104 963 A 50 LYS H A 51 PHE H 1.0 1.8 6.65 1105 964 A 50 LYS H A 89 ILE HA 1.0 1.8 5.86 1106 965 A 50 LYS H A 89 ILE HG2% 1.0 1.8 6.26 1107 966 A 50 LYS HGy A 50 LYS HA 1.0 1.8 4.45 1108 967 A 50 LYS HGx A 50 LYS HA 1.0 1.8 4.03 1109 968 A 50 LYS HDy A 50 LYS HA 1.0 1.8 5.91 1110 968 A 50 LYS HDx A 50 LYS HA 1.0 1.8 5.91 1111 969 A 50 LYS HEy A 50 LYS HA 1.0 1.8 6.33 1112 969 A 50 LYS HEx A 50 LYS HA 1.0 1.8 6.33 1113 970 A 51 PHE H A 50 LYS HA 1.0 1.8 3.86 1114 971 A 50 LYS HA A 51 PHE HD2 1.0 1.8 6.56 1115 971 A 50 LYS HA A 51 PHE HD1 1.0 1.8 6.56 1116 972 A 89 ILE HA A 50 LYS HA 1.0 1.8 4.02 1117 973 A 50 LYS HA A 89 ILE HG1y 1.0 1.8 6.65 1118 973 A 50 LYS HA A 89 ILE HG1x 1.0 1.8 6.65 1119 974 A 89 ILE HG2% A 50 LYS HA 1.0 1.8 4.97 1120 975 A 50 LYS HGy A 50 LYS HEy 1.0 1.8 3.96 1121 975 A 50 LYS HGy A 50 LYS HEx 1.0 1.8 3.96 1122 976 A 50 LYS HGy A 51 PHE H 1.0 1.8 6.65 1123 977 A 89 ILE HG2% A 50 LYS HGy 1.0 1.8 4.58 1124 978 A 50 LYS HGx A 50 LYS HEy 1.0 1.8 4.07 1125 978 A 50 LYS HGx A 50 LYS HEx 1.0 1.8 4.07 1126 979 A 50 LYS HGx A 51 PHE H 1.0 1.8 5.55 1127 980 A 89 ILE HG2% A 50 LYS HGx 1.0 1.8 4.84 1128 981 A 50 LYS HGy A 50 LYS HBy 1.0 1.8 3.74 1129 981 A 50 LYS HGy A 50 LYS HBx 1.0 1.8 3.74 1130 982 A 50 LYS HBy A 50 LYS HDx 1.0 1.8 3.52 1131 982 A 50 LYS HBx A 50 LYS HDy 1.0 1.8 3.52 1132 982 A 50 LYS HBx A 50 LYS HDx 1.0 1.8 3.52 1133 982 A 50 LYS HBy A 50 LYS HDy 1.0 1.8 3.52 1134 983 A 50 LYS HBy A 50 LYS HEy 1.0 1.8 5.15 1135 983 A 50 LYS HBy A 50 LYS HEx 1.0 1.8 5.15 1136 983 A 50 LYS HBx A 50 LYS HEy 1.0 1.8 5.15 1137 983 A 50 LYS HBx A 50 LYS HEx 1.0 1.8 5.15 1138 984 A 50 LYS HBy A 51 PHE H 1.0 1.8 7.06 1139 984 A 50 LYS HBx A 51 PHE H 1.0 1.8 7.06 1140 985 A 50 LYS HBy A 89 ILE HA 1.0 1.8 5.20 1141 985 A 50 LYS HBx A 89 ILE HA 1.0 1.8 5.20 1142 986 A 89 ILE HG2% A 50 LYS HBy 1.0 1.8 6.08 1143 986 A 89 ILE HG2% A 50 LYS HBx 1.0 1.8 6.08 1144 987 A 89 ILE HG2% A 50 LYS HDx 1.0 1.8 6.03 1145 987 A 89 ILE HG2% A 50 LYS HDy 1.0 1.8 6.03 1146 988 A 89 ILE HG2% A 50 LYS HEy 1.0 1.8 4.69 1147 988 A 89 ILE HG2% A 50 LYS HEx 1.0 1.8 4.69 1148 989 A 51 PHE H A 51 PHE HE2 1.0 1.8 7.40 1149 989 A 51 PHE H A 51 PHE HE1 1.0 1.8 7.40 1150 990 A 51 PHE H A 87 GLY H 1.0 1.8 6.65 1151 991 A 51 PHE H A 88 SER H 1.0 1.8 6.65 1152 992 A 51 PHE HD2 A 51 PHE HA 1.0 1.8 4.79 1153 992 A 51 PHE HD1 A 51 PHE HA 1.0 1.8 4.79 1154 993 A 51 PHE HE2 A 51 PHE HA 1.0 1.8 6.80 1155 993 A 51 PHE HE1 A 51 PHE HA 1.0 1.8 6.80 1156 994 A 51 PHE HA A 52 PRO HDy 1.0 1.8 4.10 1157 995 A 51 PHE HA A 52 PRO HDx 1.0 1.8 3.81 1158 996 A 51 PHE HA A 86 ALA HA 1.0 1.8 6.27 1159 997 A 87 GLY H A 51 PHE HA 1.0 1.8 6.65 1160 998 A 86 ALA HA A 51 PHE HBy 1.0 1.8 4.49 1161 999 A 51 PHE HBy A 86 ALA HB% 1.0 1.8 6.64 1162 1000 A 51 PHE HBy A 88 SER HBy 1.0 1.8 6.47 1163 1000 A 51 PHE HBy A 88 SER HBx 1.0 1.8 6.47 1164 1001 A 52 PRO HDy A 51 PHE HBx 1.0 1.8 4.81 1165 1002 A 52 PRO HDx A 51 PHE HBx 1.0 1.8 5.62 1166 1003 A 51 PHE HBx A 53 VAL H 1.0 1.8 4.59 1167 1004 A 86 ALA HA A 51 PHE HBx 1.0 1.8 4.85 1168 1005 A 86 ALA HB% A 51 PHE HBx 1.0 1.8 6.66 1169 1006 A 88 SER H A 51 PHE HBx 1.0 1.8 6.65 1170 1007 A 51 PHE HD1 A 97 ILE HG2% 1.0 1.8 7.35 1171 1007 A 51 PHE HD2 A 97 ILE HG2% 1.0 1.8 7.35 1172 1008 A 51 PHE HD1 A 64 VAL HGx% 1.0 1.8 6.61 1173 1008 A 51 PHE HD2 A 64 VAL HGx% 1.0 1.8 6.61 1174 1009 A 51 PHE HD1 A 84 VAL HGx% 1.0 1.8 7.29 1175 1009 A 51 PHE HD2 A 84 VAL HGx% 1.0 1.8 7.29 1176 1010 A 51 PHE HD2 A 84 VAL HGy% 1.0 1.8 5.89 1177 1010 A 51 PHE HD1 A 84 VAL HGy% 1.0 1.8 5.89 1178 1011 A 51 PHE HD2 A 87 GLY H 1.0 1.8 7.40 1179 1011 A 51 PHE HD1 A 87 GLY H 1.0 1.8 7.40 1180 1012 A 51 PHE HD2 A 88 SER H 1.0 1.8 7.38 1181 1012 A 51 PHE HD1 A 88 SER H 1.0 1.8 7.38 1182 1013 A 90 ASN H A 51 PHE HD2 1.0 1.8 7.40 1183 1013 A 90 ASN H A 51 PHE HD1 1.0 1.8 7.40 1184 1014 A 90 ASN HBy A 51 PHE HD2 1.0 1.8 6.99 1185 1014 A 90 ASN HBy A 51 PHE HD1 1.0 1.8 6.99 1186 1015 A 95 LEU HDx% A 51 PHE HE1 1.0 1.8 5.81 1187 1015 A 95 LEU HDx% A 51 PHE HE2 1.0 1.8 5.81 1188 1016 A 51 PHE HE2 A 97 ILE HG1y 1.0 1.8 6.42 1189 1016 A 51 PHE HE2 A 97 ILE HG1x 1.0 1.8 6.42 1190 1016 A 51 PHE HE1 A 97 ILE HG1y 1.0 1.8 6.42 1191 1016 A 51 PHE HE1 A 97 ILE HG1x 1.0 1.8 6.42 1192 1017 A 51 PHE HE1 A 97 ILE HG2% 1.0 1.8 5.72 1193 1017 A 51 PHE HE2 A 97 ILE HG2% 1.0 1.8 5.72 1194 1018 A 51 PHE HE2 A 64 VAL HGx% 1.0 1.8 5.37 1195 1018 A 51 PHE HE1 A 64 VAL HGx% 1.0 1.8 5.37 1196 1019 A 51 PHE HE1 A 64 VAL HGy% 1.0 1.8 6.11 1197 1019 A 51 PHE HE2 A 64 VAL HGy% 1.0 1.8 6.11 1198 1020 A 51 PHE HE1 A 84 VAL HGx% 1.0 1.8 5.70 1199 1020 A 51 PHE HE2 A 84 VAL HGx% 1.0 1.8 5.70 1200 1021 A 51 PHE HE2 A 84 VAL HGy% 1.0 1.8 6.13 1201 1021 A 51 PHE HE1 A 84 VAL HGy% 1.0 1.8 6.13 1202 1022 A 90 ASN H A 51 PHE HE2 1.0 1.8 7.40 1203 1022 A 90 ASN H A 51 PHE HE1 1.0 1.8 7.40 1204 1023 A 90 ASN HBy A 51 PHE HE2 1.0 1.8 5.80 1205 1023 A 90 ASN HBy A 51 PHE HE1 1.0 1.8 5.80 1206 1024 A 90 ASN HBx A 51 PHE HE2 1.0 1.8 5.79 1207 1024 A 90 ASN HBx A 51 PHE HE1 1.0 1.8 5.79 1208 1025 A 52 PRO HDx A 53 VAL H 1.0 1.8 5.02 1209 1026 A 53 VAL HGy% A 52 PRO HDx 1.0 1.8 7.66 1210 1027 A 52 PRO HGy A 53 VAL H 1.0 1.8 4.27 1211 1028 A 53 VAL HGx% A 53 VAL H 1.0 1.8 7.89 1212 1029 A 53 VAL HGy% A 53 VAL H 1.0 1.8 4.21 1213 1030 A 53 VAL H A 54 ASP H 1.0 1.8 6.65 1214 1031 A 86 ALA HB% A 53 VAL H 1.0 1.8 5.26 1215 1032 A 53 VAL HGx% A 53 VAL HA 1.0 1.8 4.90 1216 1033 A 53 VAL HGy% A 53 VAL HA 1.0 1.8 4.37 1217 1034 A 54 ASP H A 53 VAL HA 1.0 1.8 3.71 1218 1035 A 86 ALA HB% A 53 VAL HA 1.0 1.8 4.01 1219 1036 A 99 ALA HB% A 53 VAL HB 1.0 1.8 6.24 1220 1037 A 53 VAL HB A 102 VAL HA 1.0 1.8 6.02 1221 1038 A 54 ASP H A 53 VAL HB 1.0 1.8 4.86 1222 1039 A 53 VAL HGx% A 99 ALA HB% 1.0 1.8 7.25 1223 1040 A 53 VAL HGx% A 102 VAL HA 1.0 1.8 5.28 1224 1041 A 53 VAL HGx% A 102 VAL HGx% 1.0 1.8 8.50 1225 1042 A 53 VAL HGx% A 103 GLY H 1.0 1.8 6.40 1226 1043 A 53 VAL HGx% A 54 ASP H 1.0 1.8 7.89 1227 1044 A 53 VAL HGx% A 86 ALA HB% 1.0 1.8 6.53 1228 1045 A 53 VAL HGy% A 99 ALA H 1.0 1.8 7.14 1229 1046 A 53 VAL HGy% A 99 ALA HA 1.0 1.8 6.19 1230 1047 A 53 VAL HGy% A 99 ALA HB% 1.0 1.8 6.25 1231 1048 A 53 VAL HGy% A 100 THR H 1.0 1.8 6.53 1232 1049 A 53 VAL HGy% A 54 ASP H 1.0 1.8 5.35 1233 1050 A 53 VAL HGy% A 86 ALA HB% 1.0 1.8 6.70 1234 1051 A 54 ASP H A 100 THR H 1.0 1.8 6.65 1235 1052 A 101 HIS H A 54 ASP H 1.0 1.8 6.65 1236 1053 A 54 ASP H A 102 VAL HA 1.0 1.8 6.65 1237 1054 A 54 ASP H A 106 THR HG2% 1.0 1.8 7.89 1238 1055 A 54 ASP H A 55 GLY H 1.0 1.8 6.65 1239 1056 A 55 GLY H A 54 ASP HA 1.0 1.8 2.90 1240 1057 A 54 ASP HA A 85 ILE HA 1.0 1.8 3.94 1241 1058 A 54 ASP HA A 85 ILE HB 1.0 1.8 6.63 1242 1059 A 54 ASP HA A 85 ILE HG1y 1.0 1.8 7.25 1243 1059 A 54 ASP HA A 85 ILE HG1x 1.0 1.8 7.25 1244 1060 A 54 ASP HA A 85 ILE HG2% 1.0 1.8 7.89 1245 1061 A 54 ASP HA A 86 ALA H 1.0 1.8 4.39 1246 1062 A 55 GLY H A 54 ASP HBy 1.0 1.8 6.11 1247 1063 A 54 ASP HBy A 85 ILE HD1% 1.0 1.8 7.89 1248 1064 A 85 ILE HG1y A 54 ASP HBy 1.0 1.8 7.03 1249 1064 A 85 ILE HG1x A 54 ASP HBy 1.0 1.8 7.03 1250 1065 A 85 ILE HG2% A 54 ASP HBy 1.0 1.8 7.89 1251 1066 A 55 GLY H A 54 ASP HBx 1.0 1.8 5.17 1252 1067 A 85 ILE HD1% A 54 ASP HBx 1.0 1.8 7.54 1253 1068 A 85 ILE HG1y A 54 ASP HBx 1.0 1.8 7.40 1254 1068 A 85 ILE HG1x A 54 ASP HBx 1.0 1.8 7.40 1255 1069 A 85 ILE HG2% A 54 ASP HBx 1.0 1.8 7.89 1256 1070 A 55 GLY H A 84 VAL H 1.0 1.8 6.65 1257 1071 A 55 GLY H A 84 VAL HB 1.0 1.8 6.65 1258 1072 A 84 VAL HGx% A 55 GLY H 1.0 1.8 7.89 1259 1073 A 84 VAL HGy% A 55 GLY H 1.0 1.8 5.32 1260 1074 A 55 GLY H A 85 ILE HA 1.0 1.8 5.75 1261 1075 A 55 GLY H A 85 ILE HD1% 1.0 1.8 7.89 1262 1076 A 99 ALA HA A 55 GLY HAy 1.0 1.8 6.05 1263 1077 A 99 ALA HB% A 55 GLY HAy 1.0 1.8 7.66 1264 1078 A 100 THR H A 55 GLY HAy 1.0 1.8 5.40 1265 1079 A 101 HIS H A 55 GLY HAy 1.0 1.8 6.65 1266 1080 A 99 ALA HB% A 55 GLY HAx 1.0 1.8 7.20 1267 1081 A 100 THR H A 55 GLY HAx 1.0 1.8 5.46 1268 1082 A 55 GLY HAx A 56 ARG H 1.0 1.8 3.99 1269 1083 A 56 ARG H A 98 CYS H 1.0 1.8 6.65 1270 1084 A 98 CYS HBy A 56 ARG H 1.0 1.8 6.65 1271 1085 A 99 ALA HA A 56 ARG H 1.0 1.8 6.49 1272 1086 A 56 ARG H A 100 THR HG2% 1.0 1.8 7.89 1273 1087 A 56 ARG H A 56 ARG HGy 1.0 1.8 6.62 1274 1088 A 56 ARG H A 56 ARG HGx 1.0 1.8 5.32 1275 1089 A 56 ARG H A 56 ARG HBy 1.0 1.8 4.26 1276 1089 A 56 ARG H A 56 ARG HBx 1.0 1.8 4.26 1277 1090 A 56 ARG H A 56 ARG HDy 1.0 1.8 7.40 1278 1090 A 56 ARG H A 56 ARG HDx 1.0 1.8 7.40 1279 1091 A 56 ARG HGy A 56 ARG HA 1.0 1.8 4.40 1280 1092 A 56 ARG HGx A 56 ARG HA 1.0 1.8 4.14 1281 1093 A 56 ARG HBy A 56 ARG HA 1.0 1.8 3.88 1282 1093 A 56 ARG HBx A 56 ARG HA 1.0 1.8 3.88 1283 1094 A 56 ARG HDy A 56 ARG HA 1.0 1.8 5.21 1284 1094 A 56 ARG HDx A 56 ARG HA 1.0 1.8 5.21 1285 1095 A 56 ARG HA A 57 VAL H 1.0 1.8 3.97 1286 1096 A 56 ARG HA A 83 THR HA 1.0 1.8 4.07 1287 1097 A 84 VAL H A 56 ARG HA 1.0 1.8 4.25 1288 1098 A 84 VAL HGy% A 56 ARG HA 1.0 1.8 5.41 1289 1099 A 56 ARG HGy A 56 ARG HDy 1.0 1.8 3.76 1290 1099 A 56 ARG HGy A 56 ARG HDx 1.0 1.8 3.76 1291 1100 A 56 ARG HGy A 57 VAL H 1.0 1.8 4.29 1292 1101 A 56 ARG HGy A 81 GLY HAy 1.0 1.8 5.81 1293 1102 A 56 ARG HGy A 81 GLY HAx 1.0 1.8 6.65 1294 1103 A 56 ARG HGy A 83 THR HG2% 1.0 1.8 7.07 1295 1104 A 56 ARG HGx A 56 ARG HDy 1.0 1.8 3.28 1296 1104 A 56 ARG HGx A 56 ARG HDx 1.0 1.8 3.28 1297 1105 A 56 ARG HGx A 81 GLY HAy 1.0 1.8 5.91 1298 1106 A 56 ARG HGx A 83 THR HG2% 1.0 1.8 5.18 1299 1107 A 98 CYS HBy A 56 ARG HBy 1.0 1.8 6.86 1300 1107 A 98 CYS HBy A 56 ARG HBx 1.0 1.8 6.86 1301 1108 A 98 CYS HBx A 56 ARG HBy 1.0 1.8 6.81 1302 1108 A 98 CYS HBx A 56 ARG HBx 1.0 1.8 6.81 1303 1109 A 56 ARG HGy A 56 ARG HBy 1.0 1.8 3.19 1304 1109 A 56 ARG HGy A 56 ARG HBx 1.0 1.8 3.19 1305 1110 A 56 ARG HGx A 56 ARG HBy 1.0 1.8 3.43 1306 1110 A 56 ARG HGx A 56 ARG HBx 1.0 1.8 3.43 1307 1111 A 56 ARG HBy A 56 ARG HDy 1.0 1.8 3.65 1308 1111 A 56 ARG HBy A 56 ARG HDx 1.0 1.8 3.65 1309 1111 A 56 ARG HBx A 56 ARG HDy 1.0 1.8 3.65 1310 1111 A 56 ARG HBx A 56 ARG HDx 1.0 1.8 3.65 1311 1112 A 56 ARG HBy A 57 VAL H 1.0 1.8 5.15 1312 1112 A 56 ARG HBx A 57 VAL H 1.0 1.8 5.15 1313 1113 A 56 ARG HBx A 83 THR HG2% 1.0 1.8 6.24 1314 1113 A 56 ARG HBy A 83 THR HG2% 1.0 1.8 6.24 1315 1114 A 56 ARG HDy A 57 VAL H 1.0 1.8 6.21 1316 1114 A 56 ARG HDx A 57 VAL H 1.0 1.8 6.21 1317 1115 A 56 ARG HDy A 81 GLY HAy 1.0 1.8 5.57 1318 1115 A 56 ARG HDx A 81 GLY HAy 1.0 1.8 5.57 1319 1116 A 56 ARG HDy A 81 GLY HAx 1.0 1.8 7.04 1320 1116 A 56 ARG HDx A 81 GLY HAx 1.0 1.8 7.04 1321 1117 A 56 ARG HDx A 83 THR HG2% 1.0 1.8 4.87 1322 1117 A 56 ARG HDy A 83 THR HG2% 1.0 1.8 4.87 1323 1118 A 97 ILE HG2% A 57 VAL H 1.0 1.8 6.66 1324 1119 A 57 VAL H A 57 VAL HGx% 1.0 1.8 5.36 1325 1120 A 57 VAL H A 57 VAL HGy% 1.0 1.8 5.62 1326 1121 A 57 VAL H A 58 ILE H 1.0 1.8 5.53 1327 1122 A 57 VAL H A 81 GLY H 1.0 1.8 6.65 1328 1123 A 57 VAL H A 82 SER H 1.0 1.8 6.65 1329 1124 A 57 VAL H A 83 THR HA 1.0 1.8 5.12 1330 1125 A 57 VAL H A 83 THR HG2% 1.0 1.8 7.78 1331 1126 A 57 VAL HA A 97 ILE HA 1.0 1.8 4.18 1332 1127 A 97 ILE HG1y A 57 VAL HA 1.0 1.8 5.93 1333 1127 A 97 ILE HG1x A 57 VAL HA 1.0 1.8 5.93 1334 1128 A 97 ILE HG2% A 57 VAL HA 1.0 1.8 6.17 1335 1129 A 98 CYS H A 57 VAL HA 1.0 1.8 6.04 1336 1130 A 57 VAL HGx% A 57 VAL HA 1.0 1.8 4.73 1337 1131 A 57 VAL HGy% A 57 VAL HA 1.0 1.8 4.54 1338 1132 A 57 VAL HA A 58 ILE HG1y 1.0 1.8 5.40 1339 1133 A 82 SER H A 57 VAL HB 1.0 1.8 6.48 1340 1134 A 57 VAL HGx% A 58 ILE HA 1.0 1.8 6.19 1341 1135 A 57 VAL HGx% A 59 GLU H 1.0 1.8 4.22 1342 1136 A 57 VAL HGx% A 62 SER HBy 1.0 1.8 7.59 1343 1137 A 57 VAL HGx% A 82 SER H 1.0 1.8 6.77 1344 1138 A 57 VAL HGy% A 95 LEU HBx 1.0 1.8 6.48 1345 1139 A 57 VAL HGy% A 59 GLU H 1.0 1.8 7.89 1346 1140 A 57 VAL HGy% A 81 GLY H 1.0 1.8 7.89 1347 1141 A 57 VAL HGy% A 82 SER H 1.0 1.8 7.07 1348 1142 A 57 VAL HGy% A 82 SER HBx 1.0 1.8 5.83 1349 1143 A 84 VAL HGx% A 57 VAL HGy% 1.0 1.8 4.68 1350 1144 A 84 VAL HGy% A 57 VAL HGy% 1.0 1.8 6.17 1351 1145 A 58 ILE H A 96 LEU H 1.0 1.8 6.65 1352 1146 A 58 ILE H A 96 LEU HBy 1.0 1.8 6.65 1353 1147 A 96 LEU HDx% A 58 ILE H 1.0 1.8 7.89 1354 1148 A 96 LEU HDy% A 58 ILE H 1.0 1.8 7.89 1355 1149 A 58 ILE H A 97 ILE HA 1.0 1.8 5.12 1356 1150 A 58 ILE H A 58 ILE HG1y 1.0 1.8 4.05 1357 1151 A 58 ILE H A 58 ILE HG1x 1.0 1.8 5.05 1358 1152 A 58 ILE H A 58 ILE HD1% 1.0 1.8 5.51 1359 1153 A 58 ILE H A 58 ILE HG2% 1.0 1.8 5.41 1360 1154 A 58 ILE H A 59 GLU H 1.0 1.8 5.70 1361 1155 A 58 ILE HA A 58 ILE HD1% 1.0 1.8 5.65 1362 1156 A 58 ILE HA A 58 ILE HG2% 1.0 1.8 3.38 1363 1157 A 58 ILE HA A 80 PRO HA 1.0 1.8 5.01 1364 1158 A 81 GLY H A 58 ILE HA 1.0 1.8 6.65 1365 1159 A 81 GLY HAy A 58 ILE HA 1.0 1.8 5.26 1366 1160 A 58 ILE HD1% A 58 ILE HB 1.0 1.8 4.76 1367 1161 A 59 GLU H A 58 ILE HB 1.0 1.8 5.21 1368 1162 A 97 ILE HA A 58 ILE HG1y 1.0 1.8 6.20 1369 1163 A 58 ILE HG1y A 59 GLU H 1.0 1.8 6.13 1370 1164 A 82 SER H A 58 ILE HG1y 1.0 1.8 6.65 1371 1165 A 59 GLU H A 58 ILE HG1x 1.0 1.8 6.65 1372 1166 A 59 GLU H A 58 ILE HD1% 1.0 1.8 7.47 1373 1167 A 58 ILE HD1% A 59 GLU HBy 1.0 1.8 6.41 1374 1168 A 58 ILE HD1% A 59 GLU HBx 1.0 1.8 7.89 1375 1169 A 58 ILE HG1y A 58 ILE HG2% 1.0 1.8 4.32 1376 1170 A 58 ILE HG1x A 58 ILE HG2% 1.0 1.8 5.02 1377 1171 A 58 ILE HD1% A 58 ILE HG2% 1.0 1.8 6.47 1378 1172 A 59 GLU H A 58 ILE HG2% 1.0 1.8 5.88 1379 1173 A 59 GLU H A 95 LEU HA 1.0 1.8 6.65 1380 1174 A 59 GLU H A 95 LEU HBy 1.0 1.8 6.65 1381 1175 A 59 GLU H A 96 LEU H 1.0 1.8 6.65 1382 1176 A 59 GLU H A 96 LEU HBy 1.0 1.8 6.65 1383 1177 A 59 GLU H A 96 LEU HBx 1.0 1.8 6.65 1384 1178 A 96 LEU HDx% A 59 GLU H 1.0 1.8 7.89 1385 1179 A 59 GLU H A 59 GLU HBy 1.0 1.8 4.24 1386 1180 A 59 GLU H A 59 GLU HBx 1.0 1.8 4.35 1387 1181 A 59 GLU H A 59 GLU HGy 1.0 1.8 5.69 1388 1182 A 59 GLU H A 59 GLU HGx 1.0 1.8 6.43 1389 1183 A 59 GLU H A 60 GLY H 1.0 1.8 5.86 1390 1184 A 59 GLU HGy A 59 GLU HA 1.0 1.8 4.44 1391 1185 A 59 GLU HGx A 59 GLU HA 1.0 1.8 4.44 1392 1186 A 60 GLY H A 59 GLU HA 1.0 1.8 3.65 1393 1187 A 80 PRO HA A 59 GLU HA 1.0 1.8 5.09 1394 1188 A 59 GLU HA A 80 PRO HGy 1.0 1.8 6.65 1395 1189 A 59 GLU HA A 80 PRO HGx 1.0 1.8 6.52 1396 1190 A 59 GLU HBy A 95 LEU HA 1.0 1.8 5.83 1397 1191 A 96 LEU HDx% A 59 GLU HBy 1.0 1.8 6.97 1398 1192 A 96 LEU HDy% A 59 GLU HBy 1.0 1.8 6.38 1399 1193 A 59 GLU HBy A 60 GLY H 1.0 1.8 6.47 1400 1194 A 59 GLU HBx A 95 LEU HA 1.0 1.8 4.97 1401 1195 A 59 GLU HBx A 96 LEU HBx 1.0 1.8 4.99 1402 1196 A 96 LEU HDx% A 59 GLU HBx 1.0 1.8 7.36 1403 1197 A 96 LEU HDy% A 59 GLU HBx 1.0 1.8 6.91 1404 1198 A 59 GLU HBx A 60 GLY H 1.0 1.8 5.04 1405 1199 A 59 GLU HGy A 60 GLY H 1.0 1.8 5.37 1406 1200 A 59 GLU HGx A 60 GLY H 1.0 1.8 6.17 1407 1201 A 60 GLY H A 61 HIS H 1.0 1.8 6.65 1408 1202 A 80 PRO HA A 60 GLY H 1.0 1.8 6.65 1409 1203 A 60 GLY H A 80 PRO HGy 1.0 1.8 6.65 1410 1204 A 60 GLY H A 80 PRO HGx 1.0 1.8 6.65 1411 1205 A 95 LEU HA A 60 GLY HAx 1.0 1.8 6.65 1412 1206 A 60 GLY HAx A 95 LEU HDy% 1.0 1.8 4.81 1413 1207 A 95 LEU HA A 60 GLY HAy 1.0 1.8 6.48 1414 1208 A 95 LEU HDy% A 60 GLY HAy 1.0 1.8 4.72 1415 1209 A 61 HIS H A 60 GLY HAy 1.0 1.8 3.74 1416 1210 A 95 LEU HA A 61 HIS H 1.0 1.8 6.65 1417 1211 A 95 LEU HBy A 61 HIS H 1.0 1.8 6.65 1418 1212 A 95 LEU HBx A 61 HIS H 1.0 1.8 6.65 1419 1213 A 61 HIS H A 95 LEU HG 1.0 1.8 6.65 1420 1214 A 95 LEU HDx% A 61 HIS H 1.0 1.8 7.89 1421 1215 A 61 HIS H A 95 LEU HDy% 1.0 1.8 7.89 1422 1216 A 61 HIS H A 61 HIS HBx 1.0 1.8 4.33 1423 1217 A 61 HIS H A 62 SER H 1.0 1.8 6.65 1424 1218 A 61 HIS H A 94 SER H 1.0 1.8 6.65 1425 1219 A 61 HIS HA A 61 HIS HD2 1.0 1.8 5.47 1426 1220 A 61 HIS HA A 79 LYS HA 1.0 1.8 4.76 1427 1221 A 61 HIS HA A 79 LYS HBy 1.0 1.8 6.67 1428 1221 A 61 HIS HA A 79 LYS HBx 1.0 1.8 6.67 1429 1222 A 62 SER H A 61 HIS HBy 1.0 1.8 5.13 1430 1223 A 79 LYS HBy A 61 HIS HBy 1.0 1.8 6.67 1431 1223 A 79 LYS HBx A 61 HIS HBy 1.0 1.8 6.67 1432 1224 A 61 HIS HBx A 62 SER H 1.0 1.8 5.43 1433 1225 A 61 HIS HBx A 79 LYS HBy 1.0 1.8 5.83 1434 1225 A 61 HIS HBx A 79 LYS HBx 1.0 1.8 5.83 1435 1226 A 62 SER H A 61 HIS HD2 1.0 1.8 6.65 1436 1227 A 95 LEU HDx% A 62 SER H 1.0 1.8 7.89 1437 1228 A 95 LEU HDy% A 62 SER H 1.0 1.8 7.89 1438 1229 A 62 SER HBy A 62 SER H 1.0 1.8 3.89 1439 1230 A 62 SER H A 77 ALA HB% 1.0 1.8 7.89 1440 1231 A 62 SER H A 78 LYS H 1.0 1.8 6.49 1441 1232 A 62 SER H A 78 LYS HDy 1.0 1.8 7.40 1442 1232 A 62 SER H A 78 LYS HDx 1.0 1.8 7.40 1443 1233 A 62 SER H A 79 LYS HA 1.0 1.8 6.10 1444 1234 A 62 SER HA A 93 GLY H 1.0 1.8 6.65 1445 1235 A 95 LEU HDx% A 62 SER HBy 1.0 1.8 5.21 1446 1236 A 62 SER HBy A 95 LEU HDy% 1.0 1.8 4.82 1447 1237 A 62 SER HBy A 63 MET H 1.0 1.8 5.12 1448 1238 A 62 SER HBy A 78 LYS HBx 1.0 1.8 6.65 1449 1239 A 62 SER HBy A 78 LYS HGx 1.0 1.8 6.65 1450 1240 A 90 ASN HD2y A 62 SER HBy 1.0 1.8 5.36 1451 1241 A 62 SER HBy A 92 ASN H 1.0 1.8 6.65 1452 1242 A 62 SER HBy A 93 GLY H 1.0 1.8 5.90 1453 1243 A 95 LEU HDx% A 62 SER HBx 1.0 1.8 5.90 1454 1244 A 95 LEU HDy% A 62 SER HBx 1.0 1.8 5.90 1455 1245 A 63 MET H A 62 SER HBx 1.0 1.8 4.61 1456 1246 A 78 LYS HGx A 62 SER HBx 1.0 1.8 6.65 1457 1247 A 62 SER HBx A 78 LYS HGy 1.0 1.8 5.88 1458 1248 A 90 ASN HD2y A 62 SER HBx 1.0 1.8 5.26 1459 1249 A 92 ASN H A 62 SER HBx 1.0 1.8 6.65 1460 1250 A 93 GLY H A 62 SER HBx 1.0 1.8 6.41 1461 1251 A 63 MET H A 63 MET HGx 1.0 1.8 5.89 1462 1252 A 63 MET H A 63 MET HGy 1.0 1.8 5.26 1463 1253 A 63 MET H A 91 GLN H 1.0 1.8 6.65 1464 1254 A 63 MET H A 92 ASN H 1.0 1.8 6.65 1465 1255 A 63 MET H A 92 ASN HBy 1.0 1.8 6.64 1466 1256 A 63 MET H A 92 ASN HBx 1.0 1.8 5.91 1467 1257 A 93 GLY H A 63 MET H 1.0 1.8 6.65 1468 1258 A 63 MET HGx A 63 MET HA 1.0 1.8 4.36 1469 1259 A 63 MET HGy A 63 MET HA 1.0 1.8 4.33 1470 1260 A 63 MET HA A 63 MET HE% 1.0 1.8 4.68 1471 1261 A 63 MET HA A 64 VAL H 1.0 1.8 3.70 1472 1262 A 64 VAL HGy% A 63 MET HA 1.0 1.8 5.84 1473 1263 A 63 MET HA A 77 ALA HA 1.0 1.8 3.73 1474 1264 A 78 LYS H A 63 MET HA 1.0 1.8 5.37 1475 1265 A 63 MET HE% A 63 MET HBx 1.0 1.8 4.73 1476 1266 A 64 VAL H A 63 MET HBx 1.0 1.8 5.92 1477 1267 A 91 GLN H A 63 MET HBx 1.0 1.8 6.65 1478 1268 A 63 MET HE% A 63 MET HBy 1.0 1.8 5.76 1479 1269 A 64 VAL H A 63 MET HBy 1.0 1.8 5.87 1480 1270 A 63 MET HBy A 91 GLN HBy 1.0 1.8 5.62 1481 1270 A 63 MET HBy A 91 GLN HBx 1.0 1.8 5.62 1482 1271 A 63 MET HGx A 63 MET HE% 1.0 1.8 4.88 1483 1272 A 63 MET HGx A 64 VAL H 1.0 1.8 6.24 1484 1273 A 63 MET HGx A 76 VAL H 1.0 1.8 6.65 1485 1274 A 63 MET HGy A 63 MET HE% 1.0 1.8 3.69 1486 1275 A 63 MET HGy A 64 VAL H 1.0 1.8 5.30 1487 1276 A 63 MET HGy A 75 PRO HBy 1.0 1.8 5.43 1488 1276 A 63 MET HGy A 75 PRO HBx 1.0 1.8 5.43 1489 1277 A 63 MET HGy A 76 VAL H 1.0 1.8 5.31 1490 1278 A 63 MET HGy A 76 VAL HA 1.0 1.8 5.43 1491 1279 A 63 MET HE% A 76 VAL HA 1.0 1.8 4.99 1492 1280 A 63 MET HE% A 77 ALA H 1.0 1.8 6.18 1493 1281 A 77 ALA HB% A 63 MET HE% 1.0 1.8 4.13 1494 1282 A 64 VAL H A 64 VAL HB 1.0 1.8 3.85 1495 1283 A 64 VAL HGx% A 64 VAL H 1.0 1.8 5.77 1496 1284 A 64 VAL HGy% A 64 VAL H 1.0 1.8 4.22 1497 1285 A 64 VAL H A 76 VAL H 1.0 1.8 5.56 1498 1286 A 64 VAL H A 77 ALA HA 1.0 1.8 6.07 1499 1287 A 78 LYS HGx A 64 VAL H 1.0 1.8 6.63 1500 1288 A 64 VAL H A 91 GLN HBy 1.0 1.8 7.40 1501 1288 A 64 VAL H A 91 GLN HBx 1.0 1.8 7.40 1502 1289 A 64 VAL HGx% A 64 VAL HA 1.0 1.8 3.98 1503 1290 A 64 VAL HGy% A 64 VAL HA 1.0 1.8 4.31 1504 1291 A 64 VAL HA A 65 ASP H 1.0 1.8 3.59 1505 1292 A 64 VAL HA A 90 ASN HA 1.0 1.8 3.53 1506 1293 A 91 GLN H A 64 VAL HA 1.0 1.8 5.25 1507 1294 A 64 VAL HB A 65 ASP H 1.0 1.8 5.58 1508 1295 A 64 VAL HB A 66 GLU HGy 1.0 1.8 5.32 1509 1295 A 64 VAL HB A 66 GLU HGx 1.0 1.8 5.32 1510 1296 A 64 VAL HB A 76 VAL HB 1.0 1.8 5.99 1511 1297 A 64 VAL HB A 78 LYS HEy 1.0 1.8 5.01 1512 1297 A 64 VAL HB A 78 LYS HEx 1.0 1.8 5.01 1513 1298 A 64 VAL HGx% A 65 ASP H 1.0 1.8 5.40 1514 1299 A 64 VAL HGx% A 66 GLU H 1.0 1.8 6.01 1515 1300 A 64 VAL HGx% A 66 GLU HA 1.0 1.8 6.90 1516 1301 A 64 VAL HGx% A 66 GLU HGy 1.0 1.8 5.57 1517 1301 A 64 VAL HGx% A 66 GLU HGx 1.0 1.8 5.57 1518 1302 A 64 VAL HGx% A 78 LYS HGy 1.0 1.8 6.40 1519 1303 A 64 VAL HGx% A 78 LYS HEy 1.0 1.8 5.50 1520 1303 A 64 VAL HGx% A 78 LYS HEx 1.0 1.8 5.50 1521 1304 A 64 VAL HGx% A 84 VAL HB 1.0 1.8 6.79 1522 1305 A 64 VAL HGx% A 84 VAL HGx% 1.0 1.8 6.17 1523 1306 A 88 SER HBy A 64 VAL HGx% 1.0 1.8 7.78 1524 1306 A 88 SER HBx A 64 VAL HGx% 1.0 1.8 7.78 1525 1307 A 64 VAL HGx% A 89 ILE H 1.0 1.8 6.62 1526 1308 A 90 ASN H A 64 VAL HGx% 1.0 1.8 6.28 1527 1309 A 64 VAL HGx% A 91 GLN H 1.0 1.8 7.71 1528 1310 A 64 VAL HGy% A 65 ASP H 1.0 1.8 6.02 1529 1311 A 64 VAL HGy% A 78 LYS HGx 1.0 1.8 4.14 1530 1312 A 84 VAL HGx% A 64 VAL HGy% 1.0 1.8 5.81 1531 1313 A 84 VAL HGy% A 64 VAL HGy% 1.0 1.8 8.09 1532 1314 A 90 ASN HBy A 64 VAL HGy% 1.0 1.8 5.96 1533 1315 A 64 VAL HGy% A 91 GLN H 1.0 1.8 6.68 1534 1316 A 65 ASP H A 65 ASP HBy 1.0 1.8 4.24 1535 1317 A 65 ASP H A 65 ASP HBx 1.0 1.8 4.25 1536 1318 A 65 ASP H A 66 GLU H 1.0 1.8 6.52 1537 1319 A 65 ASP H A 89 ILE H 1.0 1.8 6.65 1538 1320 A 65 ASP H A 89 ILE HB 1.0 1.8 4.55 1539 1321 A 65 ASP H A 89 ILE O 1.0 1.8 2.90 1540 1322 A 65 ASP H A 89 ILE O 1.0 1.8 2.90 1541 1323 A 89 ILE HG2% A 65 ASP H 1.0 1.8 6.89 1542 1324 A 65 ASP H A 90 ASN HA 1.0 1.8 4.87 1543 1325 A 65 ASP HA A 67 SER H 1.0 1.8 5.64 1544 1326 A 65 ASP HA A 75 PRO HA 1.0 1.8 5.10 1545 1327 A 76 VAL H A 65 ASP HA 1.0 1.8 4.63 1546 1328 A 66 GLU H A 65 ASP HBy 1.0 1.8 5.34 1547 1329 A 65 ASP HBy A 89 ILE HB 1.0 1.8 5.37 1548 1330 A 66 GLU H A 65 ASP HBx 1.0 1.8 5.16 1549 1331 A 89 ILE H A 65 ASP HBx 1.0 1.8 5.17 1550 1332 A 65 ASP HBx A 89 ILE HD1% 1.0 1.8 6.99 1551 1333 A 89 ILE HG1y A 65 ASP HBx 1.0 1.8 5.21 1552 1333 A 89 ILE HG1x A 65 ASP HBx 1.0 1.8 5.21 1553 1334 A 66 GLU HGy A 66 GLU H 1.0 1.8 4.69 1554 1334 A 66 GLU HGx A 66 GLU H 1.0 1.8 4.69 1555 1335 A 66 GLU H A 67 SER H 1.0 1.8 6.65 1556 1336 A 66 GLU H A 75 PRO HA 1.0 1.8 6.32 1557 1337 A 66 GLU HGy A 66 GLU HA 1.0 1.8 4.50 1558 1337 A 66 GLU HGx A 66 GLU HA 1.0 1.8 4.50 1559 1338 A 66 GLU HA A 69 ILE H 1.0 1.8 6.65 1560 1339 A 66 GLU HA A 69 ILE HB 1.0 1.8 5.67 1561 1340 A 85 ILE HD1% A 66 GLU HA 1.0 1.8 6.47 1562 1341 A 66 GLU HA A 89 ILE H 1.0 1.8 5.37 1563 1342 A 66 GLU HGy A 66 GLU HBy 1.0 1.8 3.52 1564 1342 A 66 GLU HGx A 66 GLU HBy 1.0 1.8 3.52 1565 1342 A 66 GLU HGy A 66 GLU HBx 1.0 1.8 3.52 1566 1342 A 66 GLU HGx A 66 GLU HBx 1.0 1.8 3.52 1567 1343 A 67 SER H A 66 GLU HBy 1.0 1.8 7.07 1568 1343 A 67 SER H A 66 GLU HBx 1.0 1.8 7.07 1569 1344 A 69 ILE H A 66 GLU HBy 1.0 1.8 7.17 1570 1344 A 69 ILE H A 66 GLU HBx 1.0 1.8 7.17 1571 1345 A 66 GLU HBy A 70 THR H 1.0 1.8 6.67 1572 1345 A 66 GLU HBx A 70 THR H 1.0 1.8 6.67 1573 1346 A 66 GLU HBx A 70 THR HG2% 1.0 1.8 7.01 1574 1346 A 66 GLU HBy A 70 THR HG2% 1.0 1.8 7.01 1575 1347 A 85 ILE HD1% A 66 GLU HBx 1.0 1.8 6.38 1576 1347 A 85 ILE HD1% A 66 GLU HBy 1.0 1.8 6.38 1577 1348 A 88 SER HBx A 66 GLU HBy 1.0 1.8 6.12 1578 1348 A 88 SER HBy A 66 GLU HBy 1.0 1.8 6.12 1579 1348 A 88 SER HBy A 66 GLU HBx 1.0 1.8 6.12 1580 1348 A 88 SER HBx A 66 GLU HBx 1.0 1.8 6.12 1581 1349 A 66 GLU HGy A 67 SER H 1.0 1.8 5.88 1582 1349 A 66 GLU HGx A 67 SER H 1.0 1.8 5.88 1583 1350 A 66 GLU HGy A 69 ILE H 1.0 1.8 7.40 1584 1350 A 66 GLU HGx A 69 ILE H 1.0 1.8 7.40 1585 1351 A 66 GLU HGy A 70 THR H 1.0 1.8 7.40 1586 1351 A 66 GLU HGx A 70 THR H 1.0 1.8 7.40 1587 1352 A 66 GLU HGx A 70 THR HG2% 1.0 1.8 6.86 1588 1352 A 66 GLU HGy A 70 THR HG2% 1.0 1.8 6.86 1589 1353 A 66 GLU HGy A 72 GLU HGy 1.0 1.8 6.74 1590 1353 A 66 GLU HGx A 72 GLU HGy 1.0 1.8 6.74 1591 1354 A 66 GLU HGy A 72 GLU HGx 1.0 1.8 6.00 1592 1354 A 66 GLU HGx A 72 GLU HGx 1.0 1.8 6.00 1593 1355 A 76 VAL H A 66 GLU HGy 1.0 1.8 6.31 1594 1355 A 76 VAL H A 66 GLU HGx 1.0 1.8 6.31 1595 1356 A 85 ILE HD1% A 66 GLU HGx 1.0 1.8 5.77 1596 1356 A 85 ILE HD1% A 66 GLU HGy 1.0 1.8 5.77 1597 1357 A 88 SER HBy A 66 GLU HGy 1.0 1.8 5.65 1598 1357 A 88 SER HBx A 66 GLU HGy 1.0 1.8 5.65 1599 1357 A 88 SER HBy A 66 GLU HGx 1.0 1.8 5.65 1600 1357 A 88 SER HBx A 66 GLU HGx 1.0 1.8 5.65 1601 1358 A 67 SER H A 68 LEU H 1.0 1.8 6.65 1602 1359 A 70 THR H A 67 SER HA 1.0 1.8 6.07 1603 1360 A 68 LEU H A 67 SER HBy 1.0 1.8 5.28 1604 1361 A 69 ILE H A 67 SER HBy 1.0 1.8 6.65 1605 1362 A 67 SER HBy A 73 ALA H 1.0 1.8 6.08 1606 1363 A 67 SER HBy A 73 ALA HA 1.0 1.8 5.09 1607 1364 A 67 SER HBy A 73 ALA HB% 1.0 1.8 5.74 1608 1365 A 67 SER HBy A 74 MET H 1.0 1.8 6.65 1609 1366 A 68 LEU H A 67 SER HBx 1.0 1.8 5.51 1610 1367 A 73 ALA H A 67 SER HBx 1.0 1.8 6.47 1611 1368 A 73 ALA HA A 67 SER HBx 1.0 1.8 4.96 1612 1369 A 73 ALA HB% A 67 SER HBx 1.0 1.8 6.04 1613 1370 A 74 MET H A 67 SER HBx 1.0 1.8 6.64 1614 1371 A 68 LEU H A 68 LEU HBy 1.0 1.8 4.16 1615 1372 A 68 LEU H A 68 LEU HBx 1.0 1.8 4.56 1616 1373 A 68 LEU H A 68 LEU HG 1.0 1.8 5.80 1617 1374 A 68 LEU HDx% A 68 LEU H 1.0 1.8 6.20 1618 1375 A 68 LEU HDy% A 68 LEU H 1.0 1.8 6.41 1619 1376 A 69 ILE H A 68 LEU H 1.0 1.8 5.75 1620 1377 A 68 LEU HG A 68 LEU HA 1.0 1.8 4.40 1621 1378 A 68 LEU HDx% A 68 LEU HA 1.0 1.8 5.05 1622 1379 A 68 LEU HDy% A 68 LEU HA 1.0 1.8 5.18 1623 1380 A 68 LEU HA A 71 GLY H 1.0 1.8 5.34 1624 1381 A 68 LEU HA A 71 GLY HAy 1.0 1.8 4.51 1625 1382 A 68 LEU HDx% A 68 LEU HBy 1.0 1.8 4.50 1626 1383 A 68 LEU HDy% A 68 LEU HBy 1.0 1.8 5.06 1627 1384 A 69 ILE H A 68 LEU HBy 1.0 1.8 5.73 1628 1385 A 68 LEU HDx% A 68 LEU HBx 1.0 1.8 3.66 1629 1386 A 68 LEU HDy% A 68 LEU HBx 1.0 1.8 4.92 1630 1387 A 69 ILE H A 68 LEU HBx 1.0 1.8 4.43 1631 1388 A 68 LEU HBx A 69 ILE HG1x 1.0 1.8 6.65 1632 1389 A 69 ILE H A 68 LEU HG 1.0 1.8 6.08 1633 1390 A 68 LEU HDx% A 69 ILE H 1.0 1.8 7.89 1634 1391 A 68 LEU HDx% A 69 ILE HA 1.0 1.8 5.45 1635 1392 A 68 LEU HDy% A 69 ILE H 1.0 1.8 7.72 1636 1393 A 69 ILE H A 69 ILE HB 1.0 1.8 4.31 1637 1394 A 69 ILE H A 69 ILE HG1y 1.0 1.8 4.30 1638 1395 A 69 ILE H A 69 ILE HG1x 1.0 1.8 4.48 1639 1396 A 69 ILE H A 69 ILE HD1% 1.0 1.8 5.56 1640 1397 A 69 ILE H A 69 ILE HG2% 1.0 1.8 6.90 1641 1398 A 69 ILE H A 70 THR H 1.0 1.8 4.06 1642 1399 A 69 ILE HA A 69 ILE HG1y 1.0 1.8 4.07 1643 1400 A 69 ILE HA A 69 ILE HD1% 1.0 1.8 4.15 1644 1401 A 69 ILE HA A 69 ILE HG2% 1.0 1.8 4.01 1645 1402 A 69 ILE HB A 69 ILE HG1x 1.0 1.8 3.50 1646 1403 A 69 ILE HB A 69 ILE HD1% 1.0 1.8 4.49 1647 1404 A 69 ILE HB A 70 THR H 1.0 1.8 4.14 1648 1405 A 69 ILE HB A 70 THR HG2% 1.0 1.8 5.98 1649 1406 A 69 ILE HB A 71 GLY H 1.0 1.8 5.45 1650 1407 A 70 THR H A 69 ILE HG1y 1.0 1.8 5.74 1651 1408 A 71 GLY H A 69 ILE HG1y 1.0 1.8 6.65 1652 1409 A 88 SER H A 69 ILE HG1y 1.0 1.8 6.65 1653 1410 A 88 SER H A 69 ILE HG1x 1.0 1.8 5.15 1654 1411 A 108 LEU HDx% A 69 ILE HD1% 1.0 1.8 8.13 1655 1412 A 108 LEU HDy% A 69 ILE HD1% 1.0 1.8 7.12 1656 1413 A 70 THR H A 69 ILE HD1% 1.0 1.8 6.25 1657 1414 A 71 GLY H A 69 ILE HD1% 1.0 1.8 7.89 1658 1415 A 85 ILE HD1% A 69 ILE HD1% 1.0 1.8 6.64 1659 1416 A 85 ILE HG1x A 69 ILE HD1% 1.0 1.8 6.70 1660 1416 A 85 ILE HG1y A 69 ILE HD1% 1.0 1.8 6.70 1661 1417 A 85 ILE HG2% A 69 ILE HD1% 1.0 1.8 7.12 1662 1418 A 87 GLY H A 69 ILE HD1% 1.0 1.8 6.83 1663 1419 A 69 ILE HD1% A 87 GLY HAx 1.0 1.8 4.45 1664 1420 A 88 SER H A 69 ILE HD1% 1.0 1.8 5.90 1665 1421 A 69 ILE HG1y A 69 ILE HG2% 1.0 1.8 5.03 1666 1422 A 69 ILE HG1x A 69 ILE HG2% 1.0 1.8 4.68 1667 1423 A 69 ILE HD1% A 69 ILE HG2% 1.0 1.8 3.96 1668 1424 A 70 THR H A 69 ILE HG2% 1.0 1.8 4.97 1669 1425 A 69 ILE HG2% A 70 THR HA 1.0 1.8 6.13 1670 1426 A 70 THR HG2% A 69 ILE HG2% 1.0 1.8 6.85 1671 1427 A 71 GLY H A 69 ILE HG2% 1.0 1.8 7.89 1672 1428 A 70 THR H A 70 THR HG2% 1.0 1.8 5.69 1673 1429 A 70 THR H A 71 GLY H 1.0 1.8 6.65 1674 1430 A 70 THR H A 72 GLU H 1.0 1.8 5.88 1675 1431 A 70 THR HG2% A 70 THR HA 1.0 1.8 3.68 1676 1432 A 71 GLY H A 70 THR HB 1.0 1.8 6.65 1677 1433 A 72 GLU H A 70 THR HB 1.0 1.8 4.76 1678 1434 A 70 THR HG2% A 71 GLY H 1.0 1.8 5.94 1679 1435 A 70 THR HG2% A 72 GLU H 1.0 1.8 6.94 1680 1436 A 70 THR HG2% A 72 GLU HGy 1.0 1.8 6.28 1681 1437 A 70 THR HG2% A 72 GLU HGx 1.0 1.8 6.08 1682 1438 A 71 GLY H A 72 GLU H 1.0 1.8 4.51 1683 1439 A 71 GLY H A 72 GLU HBy 1.0 1.8 6.65 1684 1440 A 72 GLU HGy A 71 GLY H 1.0 1.8 6.65 1685 1441 A 72 GLU HGx A 71 GLY H 1.0 1.8 6.65 1686 1442 A 72 GLU H A 72 GLU HBy 1.0 1.8 4.53 1687 1443 A 72 GLU H A 72 GLU HBx 1.0 1.8 4.57 1688 1444 A 72 GLU HGy A 72 GLU H 1.0 1.8 4.00 1689 1445 A 72 GLU HGx A 72 GLU H 1.0 1.8 5.20 1690 1446 A 73 ALA H A 72 GLU H 1.0 1.8 5.70 1691 1447 A 74 MET H A 72 GLU H 1.0 1.8 6.65 1692 1448 A 72 GLU HGy A 72 GLU HA 1.0 1.8 4.49 1693 1449 A 72 GLU HGx A 72 GLU HA 1.0 1.8 4.51 1694 1450 A 74 MET H A 72 GLU HA 1.0 1.8 5.74 1695 1451 A 73 ALA H A 72 GLU HBy 1.0 1.8 5.26 1696 1452 A 74 MET H A 72 GLU HBy 1.0 1.8 5.46 1697 1453 A 73 ALA H A 72 GLU HBx 1.0 1.8 5.22 1698 1454 A 74 MET H A 72 GLU HBx 1.0 1.8 5.82 1699 1455 A 72 GLU HGy A 73 ALA H 1.0 1.8 6.65 1700 1456 A 72 GLU HGy A 74 MET H 1.0 1.8 6.65 1701 1457 A 72 GLU HGy A 76 VAL HGx% 1.0 1.8 7.89 1702 1458 A 72 GLU HGy A 76 VAL HGy% 1.0 1.8 6.23 1703 1459 A 72 GLU HGx A 73 ALA H 1.0 1.8 6.65 1704 1460 A 72 GLU HGx A 74 MET H 1.0 1.8 6.06 1705 1461 A 72 GLU HGx A 76 VAL HGx% 1.0 1.8 6.79 1706 1462 A 72 GLU HGx A 76 VAL HGy% 1.0 1.8 5.84 1707 1463 A 73 ALA H A 73 ALA HB% 1.0 1.8 5.38 1708 1464 A 73 ALA H A 74 MET H 1.0 1.8 6.65 1709 1465 A 73 ALA H A 74 MET HBy 1.0 1.8 6.49 1710 1466 A 73 ALA H A 74 MET HBx 1.0 1.8 6.22 1711 1467 A 73 ALA H A 74 MET HGy 1.0 1.8 7.40 1712 1467 A 73 ALA H A 74 MET HGx 1.0 1.8 7.40 1713 1468 A 73 ALA HB% A 74 MET H 1.0 1.8 5.05 1714 1469 A 74 MET H A 74 MET HBy 1.0 1.8 4.53 1715 1470 A 74 MET H A 74 MET HGy 1.0 1.8 5.01 1716 1470 A 74 MET H A 74 MET HGx 1.0 1.8 5.01 1717 1471 A 74 MET HGy A 74 MET HA 1.0 1.8 4.51 1718 1471 A 74 MET HGx A 74 MET HA 1.0 1.8 4.51 1719 1472 A 74 MET HA A 75 PRO HDy 1.0 1.8 3.24 1720 1473 A 74 MET HA A 75 PRO HDx 1.0 1.8 3.06 1721 1474 A 74 MET HBy A 74 MET HGy 1.0 1.8 3.33 1722 1474 A 74 MET HBy A 74 MET HGx 1.0 1.8 3.33 1723 1475 A 74 MET HBx A 74 MET HGy 1.0 1.8 3.46 1724 1475 A 74 MET HBx A 74 MET HGx 1.0 1.8 3.46 1725 1476 A 74 MET HBx A 75 PRO HDy 1.0 1.8 4.78 1726 1477 A 76 VAL H A 75 PRO HA 1.0 1.8 3.60 1727 1478 A 75 PRO HA A 76 VAL HGy% 1.0 1.8 5.53 1728 1479 A 76 VAL H A 75 PRO HBy 1.0 1.8 4.87 1729 1479 A 76 VAL H A 75 PRO HBx 1.0 1.8 4.87 1730 1480 A 76 VAL H A 76 VAL HB 1.0 1.8 3.60 1731 1481 A 76 VAL H A 76 VAL HGx% 1.0 1.8 6.74 1732 1482 A 76 VAL H A 76 VAL HGy% 1.0 1.8 4.10 1733 1483 A 76 VAL H A 77 ALA H 1.0 1.8 6.65 1734 1484 A 76 VAL HA A 76 VAL HGx% 1.0 1.8 4.29 1735 1485 A 76 VAL HA A 76 VAL HGy% 1.0 1.8 4.51 1736 1486 A 76 VAL HA A 77 ALA H 1.0 1.8 3.15 1737 1487 A 77 ALA H A 76 VAL HB 1.0 1.8 5.00 1738 1488 A 76 VAL HB A 78 LYS HEy 1.0 1.8 5.43 1739 1488 A 76 VAL HB A 78 LYS HEx 1.0 1.8 5.43 1740 1489 A 77 ALA H A 76 VAL HGx% 1.0 1.8 4.21 1741 1490 A 77 ALA HB% A 76 VAL HGx% 1.0 1.8 6.87 1742 1491 A 78 LYS HDx A 76 VAL HGx% 1.0 1.8 7.24 1743 1491 A 78 LYS HDy A 76 VAL HGx% 1.0 1.8 7.24 1744 1492 A 78 LYS HEx A 76 VAL HGx% 1.0 1.8 5.74 1745 1492 A 78 LYS HEy A 76 VAL HGx% 1.0 1.8 5.74 1746 1493 A 77 ALA H A 76 VAL HGy% 1.0 1.8 5.90 1747 1494 A 77 ALA HB% A 77 ALA H 1.0 1.8 3.51 1748 1495 A 78 LYS H A 77 ALA HA 1.0 1.8 3.12 1749 1496 A 78 LYS HGx A 77 ALA HA 1.0 1.8 5.68 1750 1497 A 77 ALA HB% A 78 LYS H 1.0 1.8 4.46 1751 1498 A 78 LYS H A 78 LYS HBx 1.0 1.8 4.52 1752 1499 A 78 LYS H A 78 LYS HGx 1.0 1.8 5.26 1753 1500 A 78 LYS H A 78 LYS HGy 1.0 1.8 6.24 1754 1501 A 78 LYS H A 78 LYS HDy 1.0 1.8 6.16 1755 1501 A 78 LYS H A 78 LYS HDx 1.0 1.8 6.16 1756 1502 A 78 LYS H A 78 LYS HEy 1.0 1.8 7.40 1757 1502 A 78 LYS H A 78 LYS HEx 1.0 1.8 7.40 1758 1503 A 78 LYS H A 79 LYS H 1.0 1.8 6.65 1759 1504 A 78 LYS HGx A 78 LYS HA 1.0 1.8 4.31 1760 1505 A 78 LYS HDy A 78 LYS HA 1.0 1.8 4.68 1761 1505 A 78 LYS HDx A 78 LYS HA 1.0 1.8 4.68 1762 1506 A 78 LYS HEy A 78 LYS HA 1.0 1.8 5.41 1763 1506 A 78 LYS HEx A 78 LYS HA 1.0 1.8 5.41 1764 1507 A 79 LYS H A 78 LYS HA 1.0 1.8 3.76 1765 1508 A 78 LYS HDy A 78 LYS HBy 1.0 1.8 4.50 1766 1508 A 78 LYS HDx A 78 LYS HBy 1.0 1.8 4.50 1767 1509 A 78 LYS HEy A 78 LYS HBy 1.0 1.8 5.65 1768 1509 A 78 LYS HEx A 78 LYS HBy 1.0 1.8 5.65 1769 1510 A 79 LYS H A 78 LYS HBy 1.0 1.8 5.24 1770 1511 A 78 LYS HDy A 78 LYS HBx 1.0 1.8 3.82 1771 1511 A 78 LYS HDx A 78 LYS HBx 1.0 1.8 3.82 1772 1512 A 78 LYS HBx A 78 LYS HEy 1.0 1.8 5.80 1773 1512 A 78 LYS HBx A 78 LYS HEx 1.0 1.8 5.80 1774 1513 A 78 LYS HBx A 79 LYS H 1.0 1.8 5.17 1775 1514 A 78 LYS HDy A 78 LYS HGx 1.0 1.8 3.84 1776 1514 A 78 LYS HDx A 78 LYS HGx 1.0 1.8 3.84 1777 1515 A 78 LYS HGx A 78 LYS HEy 1.0 1.8 3.81 1778 1515 A 78 LYS HGx A 78 LYS HEx 1.0 1.8 3.81 1779 1516 A 78 LYS HGx A 79 LYS H 1.0 1.8 5.70 1780 1517 A 78 LYS HGx A 82 SER HBy 1.0 1.8 6.65 1781 1518 A 82 SER HBx A 78 LYS HGx 1.0 1.8 6.55 1782 1519 A 78 LYS HDy A 78 LYS HGy 1.0 1.8 3.35 1783 1519 A 78 LYS HDx A 78 LYS HGy 1.0 1.8 3.35 1784 1520 A 78 LYS HGy A 78 LYS HEy 1.0 1.8 4.04 1785 1520 A 78 LYS HGy A 78 LYS HEx 1.0 1.8 4.04 1786 1521 A 78 LYS HGy A 79 LYS H 1.0 1.8 5.73 1787 1522 A 78 LYS HGy A 82 SER HBy 1.0 1.8 6.65 1788 1523 A 82 SER HBx A 78 LYS HGy 1.0 1.8 6.60 1789 1524 A 78 LYS HDy A 79 LYS H 1.0 1.8 5.21 1790 1524 A 78 LYS HDx A 79 LYS H 1.0 1.8 5.21 1791 1525 A 79 LYS H A 79 LYS HGy 1.0 1.8 5.52 1792 1526 A 79 LYS H A 79 LYS HGx 1.0 1.8 6.65 1793 1527 A 79 LYS HBy A 79 LYS H 1.0 1.8 5.05 1794 1527 A 79 LYS HBx A 79 LYS H 1.0 1.8 5.05 1795 1528 A 79 LYS H A 79 LYS HDy 1.0 1.8 6.52 1796 1528 A 79 LYS H A 79 LYS HDx 1.0 1.8 6.52 1797 1529 A 82 SER H A 79 LYS H 1.0 1.8 6.65 1798 1530 A 79 LYS H A 82 SER HBy 1.0 1.8 6.65 1799 1531 A 82 SER HBx A 79 LYS H 1.0 1.8 6.65 1800 1532 A 79 LYS HA A 79 LYS HGy 1.0 1.8 4.68 1801 1533 A 79 LYS HA A 79 LYS HGx 1.0 1.8 4.58 1802 1534 A 79 LYS HA A 79 LYS HDy 1.0 1.8 5.61 1803 1534 A 79 LYS HA A 79 LYS HDx 1.0 1.8 5.61 1804 1535 A 79 LYS HA A 79 LYS HEy 1.0 1.8 6.00 1805 1535 A 79 LYS HA A 79 LYS HEx 1.0 1.8 6.00 1806 1536 A 79 LYS HGy A 79 LYS HEy 1.0 1.8 4.26 1807 1536 A 79 LYS HGy A 79 LYS HEx 1.0 1.8 4.26 1808 1537 A 79 LYS HGy A 80 PRO HDy 1.0 1.8 6.34 1809 1537 A 79 LYS HGy A 80 PRO HDx 1.0 1.8 6.34 1810 1538 A 79 LYS HGx A 79 LYS HEy 1.0 1.8 4.35 1811 1538 A 79 LYS HGx A 79 LYS HEx 1.0 1.8 4.35 1812 1539 A 79 LYS HGx A 80 PRO HDy 1.0 1.8 5.63 1813 1539 A 79 LYS HGx A 80 PRO HDx 1.0 1.8 5.63 1814 1540 A 79 LYS HBy A 79 LYS HDy 1.0 1.8 5.02 1815 1540 A 79 LYS HBy A 79 LYS HDx 1.0 1.8 5.02 1816 1540 A 79 LYS HBx A 79 LYS HDy 1.0 1.8 5.02 1817 1540 A 79 LYS HBx A 79 LYS HDx 1.0 1.8 5.02 1818 1541 A 79 LYS HBy A 79 LYS HEx 1.0 1.8 3.79 1819 1541 A 79 LYS HBx A 79 LYS HEy 1.0 1.8 3.79 1820 1541 A 79 LYS HBx A 79 LYS HEx 1.0 1.8 3.79 1821 1541 A 79 LYS HBy A 79 LYS HEy 1.0 1.8 3.79 1822 1542 A 79 LYS HBy A 80 PRO HDx 1.0 1.8 3.93 1823 1542 A 79 LYS HBx A 80 PRO HDy 1.0 1.8 3.93 1824 1542 A 79 LYS HBx A 80 PRO HDx 1.0 1.8 3.93 1825 1542 A 79 LYS HBy A 80 PRO HDy 1.0 1.8 3.93 1826 1543 A 82 SER H A 79 LYS HBy 1.0 1.8 6.94 1827 1543 A 82 SER H A 79 LYS HBx 1.0 1.8 6.94 1828 1544 A 79 LYS HDy A 79 LYS HEx 1.0 1.8 3.52 1829 1544 A 79 LYS HDx A 79 LYS HEy 1.0 1.8 3.52 1830 1544 A 79 LYS HDx A 79 LYS HEx 1.0 1.8 3.52 1831 1544 A 79 LYS HDy A 79 LYS HEy 1.0 1.8 3.52 1832 1545 A 79 LYS HEy A 80 PRO HDx 1.0 1.8 5.89 1833 1545 A 79 LYS HEy A 80 PRO HDy 1.0 1.8 5.89 1834 1545 A 79 LYS HEx A 80 PRO HDy 1.0 1.8 5.89 1835 1545 A 79 LYS HEx A 80 PRO HDx 1.0 1.8 5.89 1836 1546 A 81 GLY H A 80 PRO HA 1.0 1.8 3.61 1837 1547 A 81 GLY H A 80 PRO HGy 1.0 1.8 5.73 1838 1548 A 81 GLY H A 80 PRO HBy 1.0 1.8 5.12 1839 1548 A 81 GLY H A 80 PRO HBx 1.0 1.8 5.12 1840 1549 A 81 GLY H A 82 SER H 1.0 1.8 4.90 1841 1550 A 81 GLY HAy A 82 SER H 1.0 1.8 4.06 1842 1551 A 82 SER H A 82 SER HBy 1.0 1.8 3.51 1843 1552 A 83 THR HG2% A 82 SER HA 1.0 1.8 5.14 1844 1553 A 82 SER HBy A 83 THR H 1.0 1.8 5.39 1845 1554 A 82 SER HBx A 83 THR H 1.0 1.8 5.03 1846 1555 A 83 THR H A 83 THR HB 1.0 1.8 4.67 1847 1556 A 83 THR HG2% A 83 THR H 1.0 1.8 4.55 1848 1557 A 84 VAL H A 83 THR H 1.0 1.8 5.20 1849 1558 A 83 THR HA A 83 THR HG2% 1.0 1.8 3.75 1850 1559 A 84 VAL H A 83 THR HA 1.0 1.8 3.51 1851 1560 A 84 VAL HGx% A 83 THR HA 1.0 1.8 6.55 1852 1561 A 84 VAL HGy% A 83 THR HA 1.0 1.8 5.28 1853 1562 A 84 VAL H A 83 THR HB 1.0 1.8 4.70 1854 1563 A 84 VAL H A 83 THR HG2% 1.0 1.8 6.08 1855 1564 A 84 VAL HGx% A 84 VAL H 1.0 1.8 5.15 1856 1565 A 84 VAL HGy% A 84 VAL H 1.0 1.8 4.28 1857 1566 A 84 VAL HGx% A 84 VAL HA 1.0 1.8 4.28 1858 1567 A 84 VAL HGy% A 84 VAL HA 1.0 1.8 4.85 1859 1568 A 84 VAL HA A 85 ILE H 1.0 1.8 3.98 1860 1569 A 84 VAL HB A 85 ILE H 1.0 1.8 4.56 1861 1570 A 84 VAL HGx% A 97 ILE HG1y 1.0 1.8 6.92 1862 1570 A 84 VAL HGx% A 97 ILE HG1x 1.0 1.8 6.92 1863 1571 A 84 VAL HGx% A 85 ILE H 1.0 1.8 5.70 1864 1572 A 84 VAL HGy% A 97 ILE HG1y 1.0 1.8 6.94 1865 1572 A 84 VAL HGy% A 97 ILE HG1x 1.0 1.8 6.94 1866 1573 A 97 ILE HG2% A 84 VAL HGy% 1.0 1.8 5.50 1867 1574 A 84 VAL HGy% A 85 ILE H 1.0 1.8 7.63 1868 1575 A 84 VAL HGy% A 85 ILE HA 1.0 1.8 6.80 1869 1576 A 85 ILE HD1% A 85 ILE H 1.0 1.8 6.84 1870 1577 A 85 ILE HG1y A 85 ILE H 1.0 1.8 7.40 1871 1577 A 85 ILE HG1x A 85 ILE H 1.0 1.8 7.40 1872 1578 A 85 ILE HG2% A 85 ILE H 1.0 1.8 7.89 1873 1579 A 86 ALA H A 85 ILE H 1.0 1.8 6.65 1874 1580 A 85 ILE HA A 85 ILE HD1% 1.0 1.8 5.58 1875 1581 A 85 ILE HA A 85 ILE HG1y 1.0 1.8 4.55 1876 1581 A 85 ILE HA A 85 ILE HG1x 1.0 1.8 4.55 1877 1582 A 85 ILE HA A 85 ILE HG2% 1.0 1.8 4.93 1878 1583 A 85 ILE HA A 86 ALA H 1.0 1.8 3.70 1879 1584 A 108 LEU HDx% A 85 ILE HB 1.0 1.8 4.72 1880 1585 A 85 ILE HB A 85 ILE HD1% 1.0 1.8 4.81 1881 1586 A 85 ILE HB A 85 ILE HG1y 1.0 1.8 3.40 1882 1586 A 85 ILE HB A 85 ILE HG1x 1.0 1.8 3.40 1883 1587 A 85 ILE HB A 86 ALA H 1.0 1.8 6.20 1884 1588 A 86 ALA H A 85 ILE HD1% 1.0 1.8 7.03 1885 1589 A 86 ALA HA A 85 ILE HD1% 1.0 1.8 6.40 1886 1590 A 88 SER H A 85 ILE HD1% 1.0 1.8 7.89 1887 1591 A 85 ILE HG1y A 86 ALA H 1.0 1.8 6.73 1888 1591 A 85 ILE HG1x A 86 ALA H 1.0 1.8 6.73 1889 1592 A 85 ILE HG2% A 107 THR HG2% 1.0 1.8 7.19 1890 1593 A 85 ILE HG2% A 85 ILE HD1% 1.0 1.8 6.25 1891 1594 A 85 ILE HG1x A 85 ILE HG2% 1.0 1.8 4.92 1892 1594 A 85 ILE HG1y A 85 ILE HG2% 1.0 1.8 4.92 1893 1595 A 85 ILE HG2% A 86 ALA H 1.0 1.8 5.81 1894 1596 A 88 SER H A 85 ILE HG2% 1.0 1.8 7.89 1895 1597 A 88 SER HBy A 85 ILE HG2% 1.0 1.8 8.78 1896 1597 A 88 SER HBx A 85 ILE HG2% 1.0 1.8 8.78 1897 1598 A 86 ALA HB% A 86 ALA H 1.0 1.8 4.91 1898 1599 A 108 LEU HDy% A 86 ALA HA 1.0 1.8 6.29 1899 1600 A 88 SER H A 86 ALA HA 1.0 1.8 5.42 1900 1601 A 87 GLY H A 86 ALA HB% 1.0 1.8 5.57 1901 1602 A 87 GLY H A 88 SER H 1.0 1.8 6.64 1902 1603 A 108 LEU HDy% A 87 GLY HAy 1.0 1.8 6.97 1903 1604 A 88 SER H A 88 SER HBy 1.0 1.8 4.78 1904 1604 A 88 SER H A 88 SER HBx 1.0 1.8 4.78 1905 1605 A 88 SER HBy A 88 SER HA 1.0 1.8 3.76 1906 1605 A 88 SER HBx A 88 SER HA 1.0 1.8 3.76 1907 1606 A 88 SER HBy A 89 ILE H 1.0 1.8 4.22 1908 1606 A 88 SER HBx A 89 ILE H 1.0 1.8 4.22 1909 1607 A 89 ILE H A 89 ILE HB 1.0 1.8 3.98 1910 1608 A 89 ILE H A 89 ILE HD1% 1.0 1.8 5.04 1911 1609 A 89 ILE HG1y A 89 ILE H 1.0 1.8 4.48 1912 1609 A 89 ILE HG1x A 89 ILE H 1.0 1.8 4.48 1913 1610 A 89 ILE HG2% A 89 ILE H 1.0 1.8 5.42 1914 1611 A 89 ILE HA A 89 ILE HD1% 1.0 1.8 4.31 1915 1612 A 89 ILE HA A 89 ILE HG1y 1.0 1.8 4.42 1916 1612 A 89 ILE HA A 89 ILE HG1x 1.0 1.8 4.42 1917 1613 A 89 ILE HG2% A 89 ILE HA 1.0 1.8 3.89 1918 1614 A 90 ASN H A 89 ILE HA 1.0 1.8 4.01 1919 1615 A 89 ILE HB A 89 ILE HD1% 1.0 1.8 4.75 1920 1616 A 89 ILE HG1y A 89 ILE HB 1.0 1.8 3.55 1921 1616 A 89 ILE HG1x A 89 ILE HB 1.0 1.8 3.55 1922 1617 A 90 ASN H A 89 ILE HB 1.0 1.8 4.92 1923 1618 A 90 ASN H A 89 ILE HG1y 1.0 1.8 7.01 1924 1618 A 90 ASN H A 89 ILE HG1x 1.0 1.8 7.01 1925 1619 A 89 ILE HG2% A 89 ILE HD1% 1.0 1.8 3.96 1926 1620 A 89 ILE HG2% A 89 ILE HG1x 1.0 1.8 3.74 1927 1620 A 89 ILE HG2% A 89 ILE HG1y 1.0 1.8 3.74 1928 1621 A 90 ASN H A 89 ILE HG2% 1.0 1.8 4.25 1929 1622 A 90 ASN H A 90 ASN HBy 1.0 1.8 4.16 1930 1623 A 90 ASN H A 90 ASN HBx 1.0 1.8 4.28 1931 1624 A 90 ASN HD2x A 90 ASN H 1.0 1.8 6.65 1932 1625 A 90 ASN HD2y A 90 ASN H 1.0 1.8 6.65 1933 1626 A 90 ASN H A 91 GLN H 1.0 1.8 6.65 1934 1627 A 90 ASN HBy A 90 ASN HA 1.0 1.8 3.49 1935 1628 A 90 ASN HD2x A 90 ASN HA 1.0 1.8 5.60 1936 1629 A 90 ASN HD2y A 90 ASN HA 1.0 1.8 6.65 1937 1630 A 90 ASN HD2x A 90 ASN HBy 1.0 1.8 4.36 1938 1631 A 90 ASN HBy A 91 GLN H 1.0 1.8 5.18 1939 1632 A 90 ASN HD2x A 90 ASN HBx 1.0 1.8 4.47 1940 1633 A 95 LEU H A 90 ASN HD2x 1.0 1.8 6.65 1941 1634 A 90 ASN HD2x A 91 GLN H 1.0 1.8 6.65 1942 1635 A 90 ASN HD2x A 94 SER HA 1.0 1.8 5.53 1943 1636 A 95 LEU H A 90 ASN HD2y 1.0 1.8 6.65 1944 1637 A 90 ASN HD2y A 95 LEU HG 1.0 1.8 5.45 1945 1638 A 90 ASN HD2y A 91 GLN H 1.0 1.8 6.65 1946 1639 A 90 ASN HD2y A 93 GLY H 1.0 1.8 6.65 1947 1640 A 90 ASN HD2y A 94 SER HA 1.0 1.8 5.34 1948 1641 A 91 GLN H A 91 GLN HE2x 1.0 1.8 6.65 1949 1642 A 91 GLN H A 91 GLN HE2y 1.0 1.8 6.65 1950 1643 A 91 GLN H A 91 GLN HBy 1.0 1.8 4.98 1951 1643 A 91 GLN H A 91 GLN HBx 1.0 1.8 4.98 1952 1644 A 91 GLN H A 91 GLN HGy 1.0 1.8 5.72 1953 1644 A 91 GLN H A 91 GLN HGx 1.0 1.8 5.72 1954 1645 A 92 ASN H A 91 GLN H 1.0 1.8 6.65 1955 1646 A 91 GLN HA A 91 GLN HE2x 1.0 1.8 5.13 1956 1647 A 91 GLN HA A 91 GLN HE2y 1.0 1.8 4.53 1957 1648 A 91 GLN HA A 91 GLN HBy 1.0 1.8 3.68 1958 1648 A 91 GLN HA A 91 GLN HBx 1.0 1.8 3.68 1959 1649 A 91 GLN HA A 91 GLN HGy 1.0 1.8 3.90 1960 1649 A 91 GLN HA A 91 GLN HGx 1.0 1.8 3.90 1961 1650 A 91 GLN HBy A 91 GLN HE2x 1.0 1.8 6.09 1962 1650 A 91 GLN HBx A 91 GLN HE2x 1.0 1.8 6.09 1963 1651 A 91 GLN HBy A 91 GLN HE2y 1.0 1.8 5.87 1964 1651 A 91 GLN HBx A 91 GLN HE2y 1.0 1.8 5.87 1965 1652 A 91 GLN HBy A 91 GLN HGx 1.0 1.8 3.52 1966 1652 A 91 GLN HBx A 91 GLN HGy 1.0 1.8 3.52 1967 1652 A 91 GLN HBx A 91 GLN HGx 1.0 1.8 3.52 1968 1652 A 91 GLN HBy A 91 GLN HGy 1.0 1.8 3.52 1969 1653 A 92 ASN H A 91 GLN HBy 1.0 1.8 5.58 1970 1653 A 92 ASN H A 91 GLN HBx 1.0 1.8 5.58 1971 1654 A 92 ASN HBx A 91 GLN HBy 1.0 1.8 6.58 1972 1654 A 92 ASN HBx A 91 GLN HBx 1.0 1.8 6.58 1973 1655 A 93 GLY H A 91 GLN HBy 1.0 1.8 7.40 1974 1655 A 93 GLY H A 91 GLN HBx 1.0 1.8 7.40 1975 1656 A 92 ASN H A 91 GLN HGy 1.0 1.8 4.99 1976 1656 A 92 ASN H A 91 GLN HGx 1.0 1.8 4.99 1977 1657 A 93 GLY H A 91 GLN HGy 1.0 1.8 7.40 1978 1657 A 93 GLY H A 91 GLN HGx 1.0 1.8 7.40 1979 1658 A 92 ASN H A 92 ASN HBx 1.0 1.8 4.63 1980 1659 A 92 ASN H A 92 ASN HD2x 1.0 1.8 6.65 1981 1660 A 93 GLY H A 92 ASN H 1.0 1.8 6.12 1982 1661 A 92 ASN H A 93 GLY HAx 1.0 1.8 5.92 1983 1662 A 92 ASN HA A 92 ASN HBy 1.0 1.8 3.20 1984 1663 A 92 ASN HA A 92 ASN HD2y 1.0 1.8 5.10 1985 1664 A 92 ASN HA A 92 ASN HD2x 1.0 1.8 5.36 1986 1665 A 93 GLY H A 92 ASN HBy 1.0 1.8 5.52 1987 1666 A 92 ASN HBx A 92 ASN HD2y 1.0 1.8 4.30 1988 1667 A 93 GLY H A 92 ASN HBx 1.0 1.8 6.65 1989 1668 A 93 GLY H A 92 ASN HD2y 1.0 1.8 6.65 1990 1669 A 93 GLY HAx A 92 ASN HD2y 1.0 1.8 5.91 1991 1670 A 93 GLY H A 92 ASN HD2x 1.0 1.8 6.65 1992 1671 A 94 SER H A 93 GLY H 1.0 1.8 6.65 1993 1672 A 95 LEU H A 94 SER H 1.0 1.8 5.80 1994 1673 A 95 LEU H A 94 SER HA 1.0 1.8 3.87 1995 1674 A 94 SER HA A 94 SER HBy 1.0 1.8 3.49 1996 1674 A 94 SER HA A 94 SER HBx 1.0 1.8 3.49 1997 1675 A 95 LEU H A 94 SER HBy 1.0 1.8 5.94 1998 1675 A 95 LEU H A 94 SER HBx 1.0 1.8 5.94 1999 1676 A 95 LEU H A 95 LEU HBy 1.0 1.8 4.49 2000 1677 A 95 LEU H A 95 LEU HG 1.0 1.8 5.32 2001 1678 A 95 LEU H A 95 LEU HDx% 1.0 1.8 6.42 2002 1679 A 95 LEU H A 95 LEU HDy% 1.0 1.8 6.12 2003 1680 A 95 LEU HA A 95 LEU HG 1.0 1.8 4.44 2004 1681 A 95 LEU HDx% A 95 LEU HA 1.0 1.8 5.81 2005 1682 A 95 LEU HA A 95 LEU HDy% 1.0 1.8 5.44 2006 1683 A 96 LEU H A 95 LEU HA 1.0 1.8 3.68 2007 1684 A 95 LEU HDx% A 95 LEU HBy 1.0 1.8 3.61 2008 1685 A 95 LEU HBy A 95 LEU HDy% 1.0 1.8 4.82 2009 1686 A 96 LEU H A 95 LEU HBy 1.0 1.8 4.75 2010 1687 A 95 LEU HBx A 95 LEU HDy% 1.0 1.8 4.49 2011 1688 A 95 LEU HBx A 96 LEU H 1.0 1.8 4.66 2012 1689 A 97 ILE HD1% A 95 LEU HBx 1.0 1.8 5.95 2013 1690 A 96 LEU H A 95 LEU HG 1.0 1.8 5.65 2014 1691 A 96 LEU H A 95 LEU HDy% 1.0 1.8 5.58 2015 1692 A 96 LEU H A 96 LEU HBx 1.0 1.8 4.69 2016 1693 A 96 LEU HG A 96 LEU H 1.0 1.8 5.32 2017 1694 A 96 LEU HDx% A 96 LEU H 1.0 1.8 6.56 2018 1695 A 96 LEU HDy% A 96 LEU H 1.0 1.8 6.53 2019 1696 A 97 ILE H A 96 LEU H 1.0 1.8 6.65 2020 1697 A 97 ILE HG1y A 96 LEU H 1.0 1.8 5.99 2021 1697 A 97 ILE HG1x A 96 LEU H 1.0 1.8 5.99 2022 1698 A 96 LEU HA A 96 LEU HG 1.0 1.8 4.29 2023 1699 A 96 LEU HA A 96 LEU HDx% 1.0 1.8 6.62 2024 1700 A 96 LEU HA A 96 LEU HDy% 1.0 1.8 5.40 2025 1701 A 97 ILE H A 96 LEU HA 1.0 1.8 3.67 2026 1702 A 96 LEU HA A 97 ILE HG1y 1.0 1.8 6.55 2027 1702 A 96 LEU HA A 97 ILE HG1x 1.0 1.8 6.55 2028 1703 A 96 LEU HDy% A 96 LEU HBy 1.0 1.8 5.14 2029 1704 A 97 ILE H A 96 LEU HBx 1.0 1.8 6.39 2030 1705 A 97 ILE H A 96 LEU HDy% 1.0 1.8 7.30 2031 1706 A 97 ILE H A 97 ILE HB 1.0 1.8 4.33 2032 1707 A 97 ILE H A 97 ILE HD1% 1.0 1.8 5.70 2033 1708 A 97 ILE H A 97 ILE HG1y 1.0 1.8 4.66 2034 1708 A 97 ILE H A 97 ILE HG1x 1.0 1.8 4.66 2035 1709 A 97 ILE H A 97 ILE HG2% 1.0 1.8 5.90 2036 1710 A 97 ILE HD1% A 97 ILE HA 1.0 1.8 5.38 2037 1711 A 97 ILE HG1y A 97 ILE HA 1.0 1.8 4.99 2038 1711 A 97 ILE HG1x A 97 ILE HA 1.0 1.8 4.99 2039 1712 A 97 ILE HG2% A 97 ILE HA 1.0 1.8 3.55 2040 1713 A 97 ILE HD1% A 97 ILE HB 1.0 1.8 4.38 2041 1714 A 97 ILE HG1y A 97 ILE HB 1.0 1.8 3.50 2042 1714 A 97 ILE HG1x A 97 ILE HB 1.0 1.8 3.50 2043 1715 A 98 CYS H A 97 ILE HB 1.0 1.8 5.90 2044 1716 A 97 ILE HG1y A 98 CYS H 1.0 1.8 6.85 2045 1716 A 97 ILE HG1x A 98 CYS H 1.0 1.8 6.85 2046 1717 A 97 ILE HD1% A 97 ILE HG2% 1.0 1.8 5.50 2047 1718 A 97 ILE HG2% A 97 ILE HG1y 1.0 1.8 3.74 2048 1718 A 97 ILE HG2% A 97 ILE HG1x 1.0 1.8 3.74 2049 1719 A 97 ILE HG2% A 98 CYS H 1.0 1.8 5.98 2050 1720 A 98 CYS HBy A 98 CYS H 1.0 1.8 4.33 2051 1721 A 98 CYS HBx A 98 CYS H 1.0 1.8 4.40 2052 1722 A 99 ALA H A 98 CYS H 1.0 1.8 5.34 2053 1723 A 99 ALA H A 98 CYS HBy 1.0 1.8 5.24 2054 1724 A 99 ALA H A 98 CYS HBx 1.0 1.8 5.40 2055 1725 A 99 ALA HB% A 99 ALA H 1.0 1.8 4.39 2056 1726 A 99 ALA HA A 100 THR H 1.0 1.8 3.79 2057 1727 A 101 HIS H A 99 ALA HB% 1.0 1.8 5.74 2058 1728 A 100 THR H A 100 THR HG2% 1.0 1.8 5.54 2059 1729 A 101 HIS H A 100 THR H 1.0 1.8 6.63 2060 1730 A 100 THR HA A 100 THR HG2% 1.0 1.8 5.38 2061 1731 A 101 HIS H A 100 THR HB 1.0 1.8 5.35 2062 1732 A 101 HIS H A 100 THR HG2% 1.0 1.8 6.25 2063 1733 A 102 VAL HGx% A 101 HIS H 1.0 1.8 7.89 2064 1734 A 102 VAL HGy% A 101 HIS H 1.0 1.8 7.89 2065 1735 A 101 HIS HA A 101 HIS HD2 1.0 1.8 6.65 2066 1736 A 101 HIS HBx A 106 THR H 1.0 1.8 6.65 2067 1737 A 101 HIS HBx A 106 THR HA 1.0 1.8 6.65 2068 1738 A 101 HIS HBy A 105 ASP HBy 1.0 1.8 4.91 2069 1739 A 106 THR H A 101 HIS HBy 1.0 1.8 6.65 2070 1740 A 106 THR HA A 101 HIS HBy 1.0 1.8 6.01 2071 1741 A 101 HIS HD2 A 105 ASP HA 1.0 1.8 6.05 2072 1742 A 102 VAL H A 102 VAL HGx% 1.0 1.8 5.74 2073 1743 A 102 VAL H A 102 VAL HGy% 1.0 1.8 5.83 2074 1744 A 102 VAL H A 103 GLY H 1.0 1.8 5.17 2075 1745 A 102 VAL H A 104 ALA H 1.0 1.8 6.65 2076 1746 A 102 VAL H A 105 ASP H 1.0 1.8 6.65 2077 1747 A 102 VAL H A 105 ASP HBx 1.0 1.8 4.77 2078 1748 A 102 VAL H A 105 ASP HBy 1.0 1.8 4.30 2079 1749 A 102 VAL H A 106 THR H 1.0 1.8 6.65 2080 1750 A 102 VAL HGx% A 102 VAL HA 1.0 1.8 5.29 2081 1751 A 102 VAL HGy% A 102 VAL HA 1.0 1.8 5.38 2082 1752 A 102 VAL HA A 104 ALA H 1.0 1.8 5.30 2083 1753 A 102 VAL HA A 105 ASP HBy 1.0 1.8 6.65 2084 1754 A 103 GLY H A 102 VAL HB 1.0 1.8 5.19 2085 1755 A 102 VAL HGx% A 103 GLY H 1.0 1.8 4.81 2086 1756 A 102 VAL HGx% A 103 GLY HAx 1.0 1.8 7.38 2087 1757 A 102 VAL HGy% A 103 GLY H 1.0 1.8 5.51 2088 1758 A 102 VAL HGy% A 103 GLY HAy 1.0 1.8 7.12 2089 1759 A 102 VAL HGy% A 103 GLY HAx 1.0 1.8 6.99 2090 1760 A 103 GLY H A 104 ALA H 1.0 1.8 6.65 2091 1761 A 103 GLY H A 104 ALA HA 1.0 1.8 6.64 2092 1762 A 103 GLY H A 105 ASP H 1.0 1.8 6.65 2093 1763 A 103 GLY H A 106 THR HG2% 1.0 1.8 6.67 2094 1764 A 105 ASP H A 103 GLY HAy 1.0 1.8 5.42 2095 1765 A 106 THR H A 103 GLY HAy 1.0 1.8 5.35 2096 1766 A 105 ASP H A 103 GLY HAx 1.0 1.8 5.77 2097 1767 A 106 THR H A 103 GLY HAx 1.0 1.8 6.65 2098 1768 A 103 GLY HAx A 106 THR HB 1.0 1.8 6.65 2099 1769 A 104 ALA H A 104 ALA HB% 1.0 1.8 5.09 2100 1770 A 104 ALA H A 105 ASP H 1.0 1.8 6.65 2101 1771 A 105 ASP H A 104 ALA HB% 1.0 1.8 4.02 2102 1772 A 105 ASP H A 105 ASP HBx 1.0 1.8 4.70 2103 1773 A 105 ASP HBy A 105 ASP H 1.0 1.8 3.91 2104 1774 A 106 THR H A 105 ASP H 1.0 1.8 6.50 2105 1775 A 106 THR H A 105 ASP HBx 1.0 1.8 4.97 2106 1776 A 106 THR H A 105 ASP HBy 1.0 1.8 4.42 2107 1777 A 106 THR HG2% A 106 THR H 1.0 1.8 4.15 2108 1778 A 106 THR H A 109 SER H 1.0 1.8 6.65 2109 1779 A 109 SER HBy A 106 THR H 1.0 1.8 7.40 2110 1779 A 109 SER HBx A 106 THR H 1.0 1.8 7.40 2111 1780 A 106 THR HG2% A 106 THR HA 1.0 1.8 4.92 2112 1781 A 106 THR HA A 109 SER H 1.0 1.8 6.65 2113 1782 A 106 THR HB A 109 SER H 1.0 1.8 5.73 2114 1783 A 106 THR HB A 110 GLN H 1.0 1.8 6.65 2115 1784 A 106 THR HG2% A 109 SER H 1.0 1.8 7.36 2116 1785 A 110 GLN H A 107 THR HA 1.0 1.8 4.39 2117 1786 A 107 THR HA A 110 GLN HBy 1.0 1.8 4.64 2118 1787 A 108 LEU H A 107 THR HB 1.0 1.8 5.14 2119 1788 A 108 LEU H A 107 THR HG2% 1.0 1.8 5.34 2120 1789 A 107 THR HG2% A 109 SER H 1.0 1.8 7.89 2121 1790 A 111 ILE HD1% A 107 THR HG2% 1.0 1.8 6.24 2122 1791 A 108 LEU H A 108 LEU HG 1.0 1.8 5.14 2123 1792 A 108 LEU H A 108 LEU HDx% 1.0 1.8 5.81 2124 1793 A 108 LEU H A 108 LEU HDy% 1.0 1.8 6.29 2125 1794 A 108 LEU H A 109 SER H 1.0 1.8 4.91 2126 1795 A 108 LEU HDx% A 108 LEU HA 1.0 1.8 5.23 2127 1796 A 108 LEU HDy% A 108 LEU HA 1.0 1.8 6.32 2128 1797 A 108 LEU HA A 111 ILE HB 1.0 1.8 4.18 2129 1798 A 111 ILE HD1% A 108 LEU HA 1.0 1.8 3.38 2130 1799 A 109 SER H A 108 LEU HG 1.0 1.8 6.15 2131 1800 A 108 LEU HDx% A 108 LEU HBx 1.0 1.8 3.74 2132 1800 A 108 LEU HDx% A 108 LEU HBy 1.0 1.8 3.74 2133 1801 A 108 LEU HDy% A 108 LEU HBy 1.0 1.8 3.74 2134 1801 A 108 LEU HDy% A 108 LEU HBx 1.0 1.8 3.74 2135 1802 A 109 SER H A 108 LEU HBy 1.0 1.8 6.22 2136 1802 A 109 SER H A 108 LEU HBx 1.0 1.8 6.22 2137 1803 A 108 LEU HDx% A 109 SER H 1.0 1.8 6.65 2138 1804 A 108 LEU HDx% A 110 GLN H 1.0 1.8 7.89 2139 1805 A 108 LEU HDy% A 109 SER H 1.0 1.8 6.20 2140 1806 A 108 LEU HDy% A 110 GLN H 1.0 1.8 7.89 2141 1807 A 109 SER HBy A 109 SER H 1.0 1.8 3.52 2142 1807 A 109 SER HBx A 109 SER H 1.0 1.8 3.52 2143 1808 A 109 SER H A 110 GLN H 1.0 1.8 4.71 2144 1809 A 109 SER H A 111 ILE H 1.0 1.8 4.86 2145 1810 A 109 SER H A 111 ILE HG1x 1.0 1.8 6.44 2146 1811 A 112 VAL H A 109 SER HA 1.0 1.8 5.05 2147 1812 A 112 VAL HGy% A 109 SER HA 1.0 1.8 4.40 2148 1813 A 109 SER HBy A 110 GLN H 1.0 1.8 5.27 2149 1813 A 109 SER HBx A 110 GLN H 1.0 1.8 5.27 2150 1814 A 110 GLN H A 110 GLN HBx 1.0 1.8 4.05 2151 1815 A 110 GLN H A 110 GLN HBy 1.0 1.8 4.42 2152 1816 A 110 GLN H A 110 GLN HE2y 1.0 1.8 6.65 2153 1817 A 110 GLN H A 110 GLN HGy 1.0 1.8 5.32 2154 1818 A 110 GLN H A 110 GLN HGx 1.0 1.8 5.60 2155 1819 A 110 GLN H A 111 ILE HG1x 1.0 1.8 5.44 2156 1820 A 110 GLN H A 113 LYS HDy 1.0 1.8 7.40 2157 1820 A 110 GLN H A 113 LYS HDx 1.0 1.8 7.40 2158 1821 A 110 GLN HBx A 110 GLN HA 1.0 1.8 3.14 2159 1822 A 110 GLN HE2y A 110 GLN HA 1.0 1.8 4.84 2160 1823 A 110 GLN HA A 110 GLN HE2x 1.0 1.8 6.55 2161 1824 A 110 GLN HGy A 110 GLN HA 1.0 1.8 4.32 2162 1825 A 110 GLN HGx A 110 GLN HA 1.0 1.8 4.09 2163 1826 A 112 VAL H A 110 GLN HA 1.0 1.8 6.46 2164 1827 A 110 GLN HA A 113 LYS H 1.0 1.8 4.92 2165 1828 A 110 GLN HA A 113 LYS HGx 1.0 1.8 4.67 2166 1829 A 110 GLN HA A 113 LYS HBy 1.0 1.8 5.03 2167 1829 A 110 GLN HA A 113 LYS HBx 1.0 1.8 5.03 2168 1830 A 113 LYS HDy A 110 GLN HA 1.0 1.8 5.49 2169 1830 A 113 LYS HDx A 110 GLN HA 1.0 1.8 5.49 2170 1831 A 110 GLN HBx A 110 GLN HE2y 1.0 1.8 4.17 2171 1832 A 110 GLN HBx A 110 GLN HE2x 1.0 1.8 5.18 2172 1833 A 111 ILE H A 110 GLN HBx 1.0 1.8 5.46 2173 1834 A 110 GLN HBy A 110 GLN HE2y 1.0 1.8 5.25 2174 1835 A 110 GLN HBy A 110 GLN HE2x 1.0 1.8 6.01 2175 1836 A 110 GLN HBy A 110 GLN HGy 1.0 1.8 3.35 2176 1837 A 110 GLN HBy A 111 ILE H 1.0 1.8 4.57 2177 1838 A 110 GLN HE2y A 110 GLN HGy 1.0 1.8 4.15 2178 1839 A 111 ILE H A 110 GLN HGy 1.0 1.8 5.23 2179 1840 A 111 ILE H A 110 GLN HGx 1.0 1.8 5.38 2180 1841 A 111 ILE H A 107 THR O 1.0 1.8 2.90 2181 1842 A 111 ILE HB A 111 ILE H 1.0 1.8 3.78 2182 1843 A 111 ILE H A 111 ILE HG1y 1.0 1.8 4.58 2183 1844 A 111 ILE H A 111 ILE HG1x 1.0 1.8 4.29 2184 1845 A 111 ILE HD1% A 111 ILE H 1.0 1.8 5.54 2185 1846 A 111 ILE H A 111 ILE HG2% 1.0 1.8 6.13 2186 1847 A 112 VAL H A 111 ILE H 1.0 1.8 6.30 2187 1848 A 112 VAL HGy% A 111 ILE H 1.0 1.8 7.79 2188 1849 A 111 ILE H A 113 LYS HGx 1.0 1.8 6.54 2189 1850 A 111 ILE HG1y A 111 ILE HA 1.0 1.8 4.22 2190 1851 A 111 ILE HG1x A 111 ILE HA 1.0 1.8 3.61 2191 1852 A 111 ILE HD1% A 111 ILE HA 1.0 1.8 5.56 2192 1853 A 111 ILE HA A 114 LEU H 1.0 1.8 4.99 2193 1854 A 111 ILE HA A 114 LEU HBy 1.0 1.8 4.80 2194 1855 A 111 ILE HA A 114 LEU HBx 1.0 1.8 4.89 2195 1856 A 111 ILE HD1% A 111 ILE HB 1.0 1.8 4.05 2196 1857 A 112 VAL H A 111 ILE HB 1.0 1.8 4.42 2197 1858 A 112 VAL H A 111 ILE HG1y 1.0 1.8 6.06 2198 1859 A 112 VAL H A 111 ILE HG1x 1.0 1.8 5.54 2199 1860 A 107 THR O A 111 ILE N 1.0 1.8 3.80 2200 1861 A 111 ILE HD1% A 112 VAL H 1.0 1.8 6.59 2201 1862 A 111 ILE HG1y A 111 ILE HG2% 1.0 1.8 4.01 2202 1863 A 111 ILE HG1x A 111 ILE HG2% 1.0 1.8 5.06 2203 1864 A 111 ILE HD1% A 111 ILE HG2% 1.0 1.8 3.96 2204 1865 A 112 VAL H A 111 ILE HG2% 1.0 1.8 5.10 2205 1866 A 111 ILE HG2% A 112 VAL HA 1.0 1.8 4.50 2206 1867 A 111 ILE HG2% A 115 VAL H 1.0 1.8 5.76 2207 1868 A 111 ILE HG2% A 115 VAL HB 1.0 1.8 5.81 2208 1869 A 112 VAL HB A 112 VAL H 1.0 1.8 4.40 2209 1870 A 112 VAL HGx% A 112 VAL H 1.0 1.8 5.23 2210 1871 A 112 VAL HGy% A 112 VAL H 1.0 1.8 5.05 2211 1872 A 112 VAL H A 113 LYS H 1.0 1.8 5.17 2212 1873 A 112 VAL H A 113 LYS HGx 1.0 1.8 5.92 2213 1874 A 112 VAL H A 114 LEU H 1.0 1.8 6.60 2214 1875 A 112 VAL H A 115 VAL H 1.0 1.8 6.65 2215 1876 A 112 VAL HGx% A 112 VAL HA 1.0 1.8 4.72 2216 1877 A 112 VAL HGy% A 112 VAL HA 1.0 1.8 5.14 2217 1878 A 114 LEU H A 112 VAL HA 1.0 1.8 6.27 2218 1879 A 112 VAL HA A 115 VAL H 1.0 1.8 5.26 2219 1880 A 112 VAL HA A 115 VAL HB 1.0 1.8 4.34 2220 1881 A 112 VAL HB A 113 LYS H 1.0 1.8 4.61 2221 1882 A 112 VAL HB A 113 LYS HGx 1.0 1.8 6.65 2222 1883 A 112 VAL HGx% A 113 LYS H 1.0 1.8 5.95 2223 1884 A 112 VAL HGy% A 113 LYS H 1.0 1.8 6.65 2224 1885 A 113 LYS H A 113 LYS HGy 1.0 1.8 4.94 2225 1886 A 113 LYS H A 113 LYS HGx 1.0 1.8 4.60 2226 1887 A 113 LYS H A 113 LYS HBy 1.0 1.8 4.01 2227 1887 A 113 LYS H A 113 LYS HBx 1.0 1.8 4.01 2228 1888 A 113 LYS HDy A 113 LYS H 1.0 1.8 7.30 2229 1888 A 113 LYS HDx A 113 LYS H 1.0 1.8 7.30 2230 1889 A 113 LYS H A 113 LYS HEy 1.0 1.8 6.39 2231 1889 A 113 LYS H A 113 LYS HEx 1.0 1.8 6.39 2232 1890 A 113 LYS H A 114 LEU H 1.0 1.8 4.61 2233 1891 A 116 GLU H A 113 LYS H 1.0 1.8 6.43 2234 1892 A 113 LYS HGy A 113 LYS HA 1.0 1.8 3.69 2235 1893 A 113 LYS HGx A 113 LYS HA 1.0 1.8 4.59 2236 1894 A 113 LYS HBy A 113 LYS HA 1.0 1.8 3.29 2237 1894 A 113 LYS HBx A 113 LYS HA 1.0 1.8 3.29 2238 1895 A 113 LYS HDy A 113 LYS HA 1.0 1.8 5.23 2239 1895 A 113 LYS HDx A 113 LYS HA 1.0 1.8 5.23 2240 1896 A 113 LYS HEy A 113 LYS HA 1.0 1.8 5.30 2241 1896 A 113 LYS HEx A 113 LYS HA 1.0 1.8 5.30 2242 1897 A 116 GLU H A 113 LYS HA 1.0 1.8 5.10 2243 1898 A 116 GLU HBx A 113 LYS HA 1.0 1.8 4.44 2244 1899 A 113 LYS HDy A 113 LYS HGy 1.0 1.8 3.65 2245 1899 A 113 LYS HDx A 113 LYS HGy 1.0 1.8 3.65 2246 1900 A 113 LYS HGy A 113 LYS HEy 1.0 1.8 5.00 2247 1900 A 113 LYS HGy A 113 LYS HEx 1.0 1.8 5.00 2248 1901 A 114 LEU H A 113 LYS HGy 1.0 1.8 5.79 2249 1902 A 113 LYS HGx A 113 LYS HEy 1.0 1.8 4.09 2250 1902 A 113 LYS HGx A 113 LYS HEx 1.0 1.8 4.09 2251 1903 A 113 LYS HGx A 114 LEU H 1.0 1.8 5.69 2252 1904 A 113 LYS HBy A 113 LYS HGy 1.0 1.8 3.83 2253 1904 A 113 LYS HBx A 113 LYS HGy 1.0 1.8 3.83 2254 1905 A 113 LYS HGx A 113 LYS HBy 1.0 1.8 3.28 2255 1905 A 113 LYS HGx A 113 LYS HBx 1.0 1.8 3.28 2256 1906 A 113 LYS HDx A 113 LYS HBy 1.0 1.8 3.52 2257 1906 A 113 LYS HDy A 113 LYS HBy 1.0 1.8 3.52 2258 1906 A 113 LYS HDy A 113 LYS HBx 1.0 1.8 3.52 2259 1906 A 113 LYS HDx A 113 LYS HBx 1.0 1.8 3.52 2260 1907 A 113 LYS HBy A 113 LYS HEy 1.0 1.8 4.53 2261 1907 A 113 LYS HBy A 113 LYS HEx 1.0 1.8 4.53 2262 1907 A 113 LYS HBx A 113 LYS HEy 1.0 1.8 4.53 2263 1907 A 113 LYS HBx A 113 LYS HEx 1.0 1.8 4.53 2264 1908 A 113 LYS HBy A 114 LEU H 1.0 1.8 3.90 2265 1908 A 113 LYS HBx A 114 LEU H 1.0 1.8 3.90 2266 1909 A 116 GLU H A 113 LYS HBy 1.0 1.8 7.40 2267 1909 A 116 GLU H A 113 LYS HBx 1.0 1.8 7.40 2268 1910 A 113 LYS HDy A 113 LYS HEx 1.0 1.8 3.52 2269 1910 A 113 LYS HDy A 113 LYS HEy 1.0 1.8 3.52 2270 1910 A 113 LYS HDx A 113 LYS HEy 1.0 1.8 3.52 2271 1910 A 113 LYS HDx A 113 LYS HEx 1.0 1.8 3.52 2272 1911 A 113 LYS HDy A 114 LEU H 1.0 1.8 7.28 2273 1911 A 113 LYS HDx A 114 LEU H 1.0 1.8 7.28 2274 1912 A 114 LEU H A 114 LEU HBy 1.0 1.8 3.74 2275 1913 A 114 LEU H A 114 LEU HBx 1.0 1.8 3.93 2276 1914 A 114 LEU H A 114 LEU HG 1.0 1.8 5.39 2277 1915 A 114 LEU H A 114 LEU HDx% 1.0 1.8 6.32 2278 1916 A 114 LEU H A 114 LEU HDy% 1.0 1.8 6.47 2279 1917 A 114 LEU H A 115 VAL H 1.0 1.8 5.04 2280 1918 A 116 GLU H A 114 LEU H 1.0 1.8 6.65 2281 1919 A 114 LEU HG A 114 LEU HA 1.0 1.8 4.34 2282 1920 A 114 LEU HDx% A 114 LEU HA 1.0 1.8 5.27 2283 1921 A 114 LEU HDy% A 114 LEU HA 1.0 1.8 3.38 2284 1922 A 114 LEU HA A 117 GLU H 1.0 1.8 5.26 2285 1923 A 114 LEU HA A 117 GLU HBy 1.0 1.8 4.22 2286 1924 A 114 LEU HA A 118 ALA H 1.0 1.8 6.51 2287 1925 A 114 LEU HBy A 114 LEU HG 1.0 1.8 2.90 2288 1926 A 114 LEU HBy A 114 LEU HDx% 1.0 1.8 5.20 2289 1927 A 114 LEU HBy A 114 LEU HDy% 1.0 1.8 4.74 2290 1928 A 114 LEU HBy A 115 VAL H 1.0 1.8 4.53 2291 1929 A 114 LEU HBx A 114 LEU HDx% 1.0 1.8 5.12 2292 1930 A 114 LEU HBx A 114 LEU HDy% 1.0 1.8 3.38 2293 1931 A 114 LEU HBx A 115 VAL H 1.0 1.8 4.24 2294 1932 A 115 VAL H A 114 LEU HG 1.0 1.8 6.47 2295 1933 A 114 LEU HDy% A 117 GLU H 1.0 1.8 7.89 2296 1934 A 114 LEU HDy% A 118 ALA HB% 1.0 1.8 7.22 2297 1935 A 115 VAL H A 115 VAL HB 1.0 1.8 3.77 2298 1936 A 115 VAL HGx% A 115 VAL H 1.0 1.8 4.14 2299 1936 A 115 VAL HGy% A 115 VAL H 1.0 1.8 4.14 2300 1937 A 116 GLU H A 115 VAL H 1.0 1.8 6.01 2301 1938 A 115 VAL HGy% A 115 VAL HA 1.0 1.8 3.98 2302 1938 A 115 VAL HGx% A 115 VAL HA 1.0 1.8 3.98 2303 1939 A 117 GLU H A 115 VAL HA 1.0 1.8 6.47 2304 1940 A 118 ALA H A 115 VAL HA 1.0 1.8 4.25 2305 1941 A 118 ALA HB% A 115 VAL HA 1.0 1.8 4.66 2306 1942 A 116 GLU H A 115 VAL HB 1.0 1.8 4.66 2307 1943 A 115 VAL HGx% A 116 GLU H 1.0 1.8 6.36 2308 1943 A 115 VAL HGy% A 116 GLU H 1.0 1.8 6.36 2309 1944 A 115 VAL HGy% A 118 ALA HB% 1.0 1.8 7.01 2310 1944 A 115 VAL HGx% A 118 ALA HB% 1.0 1.8 7.01 2311 1945 A 115 VAL HGx% A 119 GLN H 1.0 1.8 6.80 2312 1945 A 115 VAL HGy% A 119 GLN H 1.0 1.8 6.80 2313 1946 A 115 VAL HGx% A 119 GLN HE2y 1.0 1.8 4.84 2314 1946 A 115 VAL HGy% A 119 GLN HE2y 1.0 1.8 4.84 2315 1947 A 115 VAL HGx% A 119 GLN HE2x 1.0 1.8 5.99 2316 1947 A 115 VAL HGy% A 119 GLN HE2x 1.0 1.8 5.99 2317 1948 A 116 GLU H A 116 GLU HBx 1.0 1.8 3.73 2318 1949 A 116 GLU H A 116 GLU HBy 1.0 1.8 4.36 2319 1950 A 116 GLU H A 116 GLU HGy 1.0 1.8 5.33 2320 1950 A 116 GLU H A 116 GLU HGx 1.0 1.8 5.33 2321 1951 A 116 GLU H A 117 GLU H 1.0 1.8 6.65 2322 1952 A 116 GLU H A 118 ALA HB% 1.0 1.8 7.50 2323 1953 A 116 GLU HGy A 116 GLU HA 1.0 1.8 3.43 2324 1953 A 116 GLU HGx A 116 GLU HA 1.0 1.8 3.43 2325 1954 A 118 ALA H A 116 GLU HA 1.0 1.8 5.16 2326 1955 A 119 GLN H A 116 GLU HA 1.0 1.8 5.29 2327 1956 A 116 GLU HA A 119 GLN HBy 1.0 1.8 4.95 2328 1957 A 116 GLU HBx A 116 GLU HGy 1.0 1.8 3.19 2329 1957 A 116 GLU HBx A 116 GLU HGx 1.0 1.8 3.19 2330 1958 A 116 GLU HBx A 117 GLU H 1.0 1.8 4.69 2331 1959 A 116 GLU HBx A 117 GLU HGy 1.0 1.8 5.96 2332 1960 A 116 GLU HBy A 117 GLU H 1.0 1.8 6.34 2333 1961 A 117 GLU H A 117 GLU HBy 1.0 1.8 3.98 2334 1962 A 117 GLU H A 117 GLU HBx 1.0 1.8 4.58 2335 1963 A 117 GLU H A 117 GLU HGy 1.0 1.8 3.87 2336 1964 A 117 GLU H A 117 GLU HGx 1.0 1.8 3.90 2337 1965 A 117 GLU H A 118 ALA H 1.0 1.8 6.26 2338 1966 A 117 GLU H A 118 ALA HA 1.0 1.8 6.09 2339 1967 A 117 GLU H A 118 ALA HB% 1.0 1.8 7.19 2340 1968 A 117 GLU HBx A 117 GLU HA 1.0 1.8 3.33 2341 1969 A 117 GLU HGy A 117 GLU HA 1.0 1.8 3.74 2342 1970 A 117 GLU HGx A 117 GLU HA 1.0 1.8 4.37 2343 1971 A 119 GLN H A 117 GLU HA 1.0 1.8 6.50 2344 1972 A 117 GLU HBy A 118 ALA H 1.0 1.8 4.72 2345 1973 A 118 ALA H A 117 GLU HBx 1.0 1.8 4.94 2346 1974 A 118 ALA H A 117 GLU HGx 1.0 1.8 5.76 2347 1975 A 118 ALA H A 118 ALA HB% 1.0 1.8 4.97 2348 1976 A 118 ALA H A 119 GLN H 1.0 1.8 4.30 2349 1977 A 118 ALA H A 119 GLN HGy 1.0 1.8 6.59 2350 1977 A 118 ALA H A 119 GLN HGx 1.0 1.8 6.59 2351 1978 A 118 ALA HB% A 119 GLN H 1.0 1.8 4.82 2352 1979 A 118 ALA HB% A 119 GLN HGx 1.0 1.8 6.16 2353 1979 A 118 ALA HB% A 119 GLN HGy 1.0 1.8 6.16 2354 1980 A 119 GLN H A 119 GLN HBy 1.0 1.8 4.24 2355 1981 A 119 GLN H A 119 GLN HE2y 1.0 1.8 3.53 2356 1982 A 119 GLN H A 119 GLN HE2x 1.0 1.8 6.65 2357 1983 A 119 GLN H A 119 GLN HGy 1.0 1.8 5.00 2358 1983 A 119 GLN H A 119 GLN HGx 1.0 1.8 5.00 2359 1984 A 119 GLN HE2y A 119 GLN HA 1.0 1.8 5.35 2360 1985 A 119 GLN HGy A 119 GLN HA 1.0 1.8 4.63 2361 1985 A 119 GLN HGx A 119 GLN HA 1.0 1.8 4.63 2362 1986 A 119 GLN HE2y A 119 GLN HBy 1.0 1.8 4.77 2363 1987 A 119 GLN HE2x A 119 GLN HBy 1.0 1.8 6.65 2364 1988 A 119 GLN HBy A 119 GLN HGy 1.0 1.8 3.44 2365 1988 A 119 GLN HBy A 119 GLN HGx 1.0 1.8 3.44 2366 1989 A 119 GLN HE2y A 119 GLN HBx 1.0 1.8 5.12 2367 1990 A 119 GLN HE2x A 119 GLN HBx 1.0 1.8 5.36 2368 1991 A 119 GLN HGy A 119 GLN HBx 1.0 1.8 3.19 2369 1991 A 119 GLN HGx A 119 GLN HBx 1.0 1.8 3.19 2370 1992 A 119 GLN HE2y A 119 GLN HGy 1.0 1.8 4.16 2371 1992 A 119 GLN HE2y A 119 GLN HGx 1.0 1.8 4.16 2372 1993 A 119 GLN HE2x A 119 GLN HGy 1.0 1.8 4.61 2373 1993 A 119 GLN HE2x A 119 GLN HGx 1.0 1.8 4.61 stop_ save_ save_AMBER_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode AMBER_dihedral_5 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 2 GLU C A 3 ALA N A 3 ALA CA A 3 ALA C 1.0 -70.0 -30.0 PHI 2 2 A 3 ALA N A 3 ALA CA A 3 ALA C A 4 LEU N 1.0 -60.0 -10.0 PSI 3 3 A 3 ALA C A 4 LEU N A 4 LEU CA A 4 LEU C 1.0 -70.0 -30.0 PHI 4 4 A 4 LEU N A 4 LEU CA A 4 LEU C A 5 ALA N 1.0 -60.0 -10.0 PSI 5 5 A 4 LEU C A 5 ALA N A 5 ALA CA A 5 ALA C 1.0 -70.0 -30.0 PHI 6 6 A 5 ALA N A 5 ALA CA A 5 ALA C A 6 LYS N 1.0 -60.0 -10.0 PSI 7 7 A 5 ALA C A 6 LYS N A 6 LYS CA A 6 LYS C 1.0 -70.0 -30.0 PHI 8 8 A 6 LYS N A 6 LYS CA A 6 LYS C A 7 LEU N 1.0 -60.0 -10.0 PSI 9 9 A 6 LYS C A 7 LEU N A 7 LEU CA A 7 LEU C 1.0 -70.0 -30.0 PHI 10 10 A 7 LEU N A 7 LEU CA A 7 LEU C A 8 ILE N 1.0 -60.0 -10.0 PSI 11 11 A 7 LEU C A 8 ILE N A 8 ILE CA A 8 ILE C 1.0 -70.0 -30.0 PHI 12 12 A 8 ILE N A 8 ILE CA A 8 ILE C A 9 SER N 1.0 -60.0 -10.0 PSI 13 13 A 8 ILE C A 9 SER N A 9 SER CA A 9 SER C 1.0 -75.0 -25.0 PHI 14 14 A 9 SER N A 9 SER CA A 9 SER C A 10 LEU N 1.0 -60.0 -10.0 PSI 15 15 A 9 SER C A 10 LEU N A 10 LEU CA A 10 LEU C 1.0 -70.0 -30.0 PHI 16 16 A 10 LEU N A 10 LEU CA A 10 LEU C A 11 GLN N 1.0 -60.0 -10.0 PSI 17 17 A 13 THR C A 14 GLU N A 14 GLU CA A 14 GLU C 1.0 -140.0 -80.0 PHI 18 18 A 14 GLU N A 14 GLU CA A 14 GLU C A 15 ALA N 1.0 60.0 180.0 PSI 19 19 A 14 GLU C A 15 ALA N A 15 ALA CA A 15 ALA C 1.0 -140.0 -80.0 PHI 20 20 A 15 ALA N A 15 ALA CA A 15 ALA C A 16 THR N 1.0 60.0 180.0 PSI 21 21 A 15 ALA C A 16 THR N A 16 THR CA A 16 THR C 1.0 -140.0 -80.0 PHI 22 22 A 16 THR N A 16 THR CA A 16 THR C A 17 ILE N 1.0 60.0 180.0 PSI 23 23 A 16 THR C A 17 ILE N A 17 ILE CA A 17 ILE C 1.0 -140.0 -80.0 PHI 24 24 A 17 ILE N A 17 ILE CA A 17 ILE C A 18 VAL N 1.0 60.0 180.0 PSI 25 25 A 17 ILE C A 18 VAL N A 18 VAL CA A 18 VAL C 1.0 -140.0 -80.0 PHI 26 26 A 18 VAL N A 18 VAL CA A 18 VAL C A 19 THR N 1.0 60.0 180.0 PSI 27 27 A 18 VAL C A 19 THR N A 19 THR CA A 19 THR C 1.0 -140.0 -80.0 PHI 28 28 A 19 THR N A 19 THR CA A 19 THR C A 20 LEU N 1.0 60.0 180.0 PSI 29 29 A 27 LEU C A 28 SER N A 28 SER CA A 28 SER C 1.0 -140.0 -80.0 PHI 30 30 A 28 SER N A 28 SER CA A 28 SER C A 29 GLU N 1.0 60.0 180.0 PSI 31 31 A 28 SER C A 29 GLU N A 29 GLU CA A 29 GLU C 1.0 -140.0 -80.0 PHI 32 32 A 29 GLU N A 29 GLU CA A 29 GLU C A 30 GLU N 1.0 60.0 180.0 PSI 33 33 A 29 GLU C A 30 GLU N A 30 GLU CA A 30 GLU C 1.0 -140.0 -80.0 PHI 34 34 A 30 GLU N A 30 GLU CA A 30 GLU C A 31 GLN N 1.0 60.0 180.0 PSI 35 35 A 30 GLU C A 31 GLN N A 31 GLN CA A 31 GLN C 1.0 -140.0 -80.0 PHI 36 36 A 31 GLN N A 31 GLN CA A 31 GLN C A 32 VAL N 1.0 60.0 180.0 PSI 37 37 A 31 GLN C A 32 VAL N A 32 VAL CA A 32 VAL C 1.0 -140.0 -80.0 PHI 38 38 A 32 VAL N A 32 VAL CA A 32 VAL C A 33 ASP N 1.0 60.0 180.0 PSI 39 39 A 32 VAL C A 33 ASP N A 33 ASP CA A 33 ASP C 1.0 -140.0 -80.0 PHI 40 40 A 33 ASP N A 33 ASP CA A 33 ASP C A 34 VAL N 1.0 60.0 180.0 PSI 41 41 A 41 ASP C A 42 ILE N A 42 ILE CA A 42 ILE C 1.0 -140.0 -80.0 PHI 42 42 A 42 ILE N A 42 ILE CA A 42 ILE C A 43 ILE N 1.0 60.0 180.0 PSI 43 43 A 42 ILE C A 43 ILE N A 43 ILE CA A 43 ILE C 1.0 -140.0 -80.0 PHI 44 44 A 43 ILE N A 43 ILE CA A 43 ILE C A 44 LYS N 1.0 60.0 180.0 PSI 45 45 A 43 ILE C A 44 LYS N A 44 LYS CA A 44 LYS C 1.0 -140.0 -80.0 PHI 46 46 A 44 LYS N A 44 LYS CA A 44 LYS C A 45 VAL N 1.0 60.0 180.0 PSI 47 47 A 44 LYS C A 45 VAL N A 45 VAL CA A 45 VAL C 1.0 -140.0 -80.0 PHI 48 48 A 45 VAL N A 45 VAL CA A 45 VAL C A 46 VAL N 1.0 60.0 180.0 PSI 49 49 A 53 VAL C A 54 ASP N A 54 ASP CA A 54 ASP C 1.0 -140.0 -80.0 PHI 50 50 A 54 ASP N A 54 ASP CA A 54 ASP C A 55 GLY N 1.0 60.0 180.0 PSI 51 51 A 54 ASP C A 55 GLY N A 55 GLY CA A 55 GLY C 1.0 -146.0 -70.0 PHI 52 52 A 55 GLY C A 56 ARG N A 56 ARG CA A 56 ARG C 1.0 -146.0 -70.0 PHI 53 53 A 56 ARG N A 56 ARG CA A 56 ARG C A 57 VAL N 1.0 60.0 180.0 PSI 54 54 A 56 ARG C A 57 VAL N A 57 VAL CA A 57 VAL C 1.0 -140.0 -80.0 PHI 55 55 A 57 VAL N A 57 VAL CA A 57 VAL C A 58 ILE N 1.0 60.0 180.0 PSI 56 56 A 57 VAL C A 58 ILE N A 58 ILE CA A 58 ILE C 1.0 -140.0 -80.0 PHI 57 57 A 58 ILE N A 58 ILE CA A 58 ILE C A 59 GLU N 1.0 45.0 190.0 PSI 58 58 A 58 ILE C A 59 GLU N A 59 GLU CA A 59 GLU C 1.0 -165.0 -70.0 PHI 59 59 A 59 GLU N A 59 GLU CA A 59 GLU C A 60 GLY N 1.0 50.0 180.0 PSI 60 60 A 61 HIS C A 62 SER N A 62 SER CA A 62 SER C 1.0 -140.0 -80.0 PHI 61 61 A 62 SER N A 62 SER CA A 62 SER C A 63 MET N 1.0 60.0 180.0 PSI 62 62 A 62 SER C A 63 MET N A 63 MET CA A 63 MET C 1.0 -140.0 -80.0 PHI 63 63 A 63 MET N A 63 MET CA A 63 MET C A 64 VAL N 1.0 60.0 180.0 PSI 64 64 A 63 MET C A 64 VAL N A 64 VAL CA A 64 VAL C 1.0 -140.0 -80.0 PHI 65 65 A 64 VAL N A 64 VAL CA A 64 VAL C A 65 ASP N 1.0 60.0 180.0 PSI 66 66 A 64 VAL C A 65 ASP N A 65 ASP CA A 65 ASP C 1.0 -140.0 -80.0 PHI 67 67 A 65 ASP N A 65 ASP CA A 65 ASP C A 66 GLU N 1.0 60.0 180.0 PSI 68 68 A 75 PRO C A 76 VAL N A 76 VAL CA A 76 VAL C 1.0 -140.0 -80.0 PHI 69 69 A 76 VAL N A 76 VAL CA A 76 VAL C A 77 ALA N 1.0 60.0 180.0 PSI 70 70 A 76 VAL C A 77 ALA N A 77 ALA CA A 77 ALA C 1.0 -140.0 -80.0 PHI 71 71 A 77 ALA N A 77 ALA CA A 77 ALA C A 78 LYS N 1.0 60.0 180.0 PSI 72 72 A 77 ALA C A 78 LYS N A 78 LYS CA A 78 LYS C 1.0 -140.0 -80.0 PHI 73 73 A 78 LYS N A 78 LYS CA A 78 LYS C A 79 LYS N 1.0 60.0 180.0 PSI 74 74 A 82 SER C A 83 THR N A 83 THR CA A 83 THR C 1.0 -140.0 -80.0 PHI 75 75 A 83 THR N A 83 THR CA A 83 THR C A 84 VAL N 1.0 60.0 180.0 PSI 76 76 A 83 THR C A 84 VAL N A 84 VAL CA A 84 VAL C 1.0 -140.0 -80.0 PHI 77 77 A 84 VAL N A 84 VAL CA A 84 VAL C A 85 ILE N 1.0 60.0 180.0 PSI 78 78 A 88 SER C A 89 ILE N A 89 ILE CA A 89 ILE C 1.0 -140.0 -80.0 PHI 79 79 A 89 ILE N A 89 ILE CA A 89 ILE C A 90 ASN N 1.0 60.0 180.0 PSI 80 80 A 89 ILE C A 90 ASN N A 90 ASN CA A 90 ASN C 1.0 -140.0 -80.0 PHI 81 81 A 90 ASN N A 90 ASN CA A 90 ASN C A 91 GLN N 1.0 60.0 180.0 PSI 82 82 A 94 SER C A 95 LEU N A 95 LEU CA A 95 LEU C 1.0 -140.0 -80.0 PHI 83 83 A 95 LEU N A 95 LEU CA A 95 LEU C A 96 LEU N 1.0 60.0 180.0 PSI 84 84 A 95 LEU C A 96 LEU N A 96 LEU CA A 96 LEU C 1.0 -140.0 -80.0 PHI 85 85 A 96 LEU N A 96 LEU CA A 96 LEU C A 97 ILE N 1.0 60.0 180.0 PSI 86 86 A 96 LEU C A 97 ILE N A 97 ILE CA A 97 ILE C 1.0 -140.0 -80.0 PHI 87 87 A 97 ILE N A 97 ILE CA A 97 ILE C A 98 CYS N 1.0 60.0 180.0 PSI 88 88 A 97 ILE C A 98 CYS N A 98 CYS CA A 98 CYS C 1.0 -140.0 -80.0 PHI 89 89 A 98 CYS N A 98 CYS CA A 98 CYS C A 99 ALA N 1.0 60.0 180.0 PSI 90 90 A 98 CYS C A 99 ALA N A 99 ALA CA A 99 ALA C 1.0 -140.0 -80.0 PHI 91 91 A 99 ALA N A 99 ALA CA A 99 ALA C A 100 THR N 1.0 60.0 180.0 PSI 92 92 A 99 ALA C A 100 THR N A 100 THR CA A 100 THR C 1.0 -140.0 -80.0 PHI 93 93 A 100 THR N A 100 THR CA A 100 THR C A 101 HIS N 1.0 55.0 190.0 PSI 94 94 A 100 THR C A 101 HIS N A 101 HIS CA A 101 HIS C 1.0 -155.0 -70.0 PHI 95 95 A 101 HIS N A 101 HIS CA A 101 HIS C A 102 VAL N 1.0 60.0 180.0 PSI 96 96 A 102 VAL C A 103 GLY N A 103 GLY CA A 103 GLY C 1.0 -70.0 -30.0 PHI 97 97 A 103 GLY C A 104 ALA N A 104 ALA CA A 104 ALA C 1.0 -70.0 -30.0 PHI 98 98 A 104 ALA N A 104 ALA CA A 104 ALA C A 105 ASP N 1.0 -60.0 -10.0 PSI 99 99 A 104 ALA C A 105 ASP N A 105 ASP CA A 105 ASP C 1.0 -70.0 -30.0 PHI 100 100 A 105 ASP N A 105 ASP CA A 105 ASP C A 106 THR N 1.0 -60.0 -10.0 PSI 101 101 A 106 THR C A 107 THR N A 107 THR CA A 107 THR C 1.0 -70.0 -30.0 PHI 102 102 A 107 THR N A 107 THR CA A 107 THR C A 108 LEU N 1.0 -60.0 -10.0 PSI 103 103 A 107 THR C A 108 LEU N A 108 LEU CA A 108 LEU C 1.0 -70.0 -30.0 PHI 104 104 A 108 LEU N A 108 LEU CA A 108 LEU C A 109 SER N 1.0 -60.0 -10.0 PSI 105 105 A 108 LEU C A 109 SER N A 109 SER CA A 109 SER C 1.0 -70.0 -30.0 PHI 106 106 A 109 SER N A 109 SER CA A 109 SER C A 110 GLN N 1.0 -60.0 -10.0 PSI 107 107 A 109 SER C A 110 GLN N A 110 GLN CA A 110 GLN C 1.0 -70.0 -30.0 PHI 108 108 A 110 GLN N A 110 GLN CA A 110 GLN C A 111 ILE N 1.0 -60.0 -10.0 PSI 109 109 A 110 GLN C A 111 ILE N A 111 ILE CA A 111 ILE C 1.0 -70.0 -30.0 PHI 110 110 A 111 ILE N A 111 ILE CA A 111 ILE C A 112 VAL N 1.0 -60.0 -10.0 PSI 111 111 A 111 ILE C A 112 VAL N A 112 VAL CA A 112 VAL C 1.0 -70.0 -30.0 PHI 112 112 A 112 VAL N A 112 VAL CA A 112 VAL C A 113 LYS N 1.0 -60.0 -10.0 PSI 113 113 A 112 VAL C A 113 LYS N A 113 LYS CA A 113 LYS C 1.0 -70.0 -30.0 PHI 114 114 A 113 LYS N A 113 LYS CA A 113 LYS C A 114 LEU N 1.0 -60.0 -10.0 PSI 115 115 A 113 LYS C A 114 LEU N A 114 LEU CA A 114 LEU C 1.0 -70.0 -30.0 PHI 116 116 A 114 LEU N A 114 LEU CA A 114 LEU C A 115 VAL N 1.0 -60.0 -10.0 PSI 117 117 A 114 LEU C A 115 VAL N A 115 VAL CA A 115 VAL C 1.0 -70.0 -30.0 PHI 118 118 A 115 VAL N A 115 VAL CA A 115 VAL C A 116 GLU N 1.0 -60.0 -10.0 PSI 119 119 A 115 VAL C A 116 GLU N A 116 GLU CA A 116 GLU C 1.0 -70.0 -30.0 PHI 120 120 A 116 GLU N A 116 GLU CA A 116 GLU C A 117 GLU N 1.0 -60.0 -10.0 PSI 121 121 A 116 GLU C A 117 GLU N A 117 GLU CA A 117 GLU C 1.0 -70.0 -30.0 PHI 122 122 A 117 GLU N A 117 GLU CA A 117 GLU C A 118 ALA N 1.0 -60.0 -10.0 PSI 123 123 A 117 GLU C A 118 ALA N A 118 ALA CA A 118 ALA C 1.0 -70.0 -30.0 PHI 124 124 A 118 ALA N A 118 ALA CA A 118 ALA C A 119 GLN N 1.0 -60.0 -10.0 PSI 125 125 A 118 ALA C A 119 GLN N A 119 GLN CA A 119 GLN C 1.0 -70.0 -30.0 PHI stop_ save_ save_AMBER_dihedral_7 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode AMBER_dihedral_7 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A -3 SER CA A -3 SER N A -4 GLY C A -4 GLY CA 1.0 170.0 190.0 OMEGA stop_ save_ save_AMBER_dipolar_coupling_2 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode AMBER_dipolar_coupling_2 _nef_rdc_restraint_list.potential_type square-well-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 1 SER N A 1 SER H 1.0 5.51 5.51 . 2 2 A 3 ALA N A 3 ALA H 1.0 13.95 13.95 . 3 3 A 4 LEU N A 4 LEU H 1.0 13.38 13.38 . 4 4 A 5 ALA N A 5 ALA H 1.0 0.16 0.16 . 5 5 A 6 LYS N A 6 LYS H 1.0 15.32 15.32 . 6 6 A 7 LEU N A 7 LEU H 1.0 19.70 19.70 . 7 7 A 8 ILE N A 8 ILE H 1.0 18.89 18.89 . 8 8 A 9 SER N A 9 SER H 1.0 15.32 15.32 . 9 9 A 10 LEU N A 10 LEU H 1.0 11.68 11.68 . 10 10 A 11 GLN N A 11 GLN H 1.0 9.65 9.65 . 11 11 A 12 ALA N A 12 ALA H 1.0 -11.92 -11.92 . 12 12 A 13 THR N A 13 THR H 1.0 -8.19 -8.19 . 13 13 A 14 GLU N A 14 GLU H 1.0 -4.95 -4.95 . 14 14 A 15 ALA N A 15 ALA H 1.0 -2.51 -2.51 . 15 15 A 16 THR N A 16 THR H 1.0 0.89 0.89 . 16 16 A 17 ILE N A 17 ILE H 1.0 -10.78 -10.78 . 17 17 A 18 VAL N A 18 VAL H 1.0 2.19 2.19 . 18 18 A 19 THR N A 19 THR H 1.0 -7.86 -7.86 . 19 19 A 20 LEU N A 20 LEU H 1.0 -1.70 -1.70 . 20 20 A 21 ASP N A 21 ASP H 1.0 -6.00 -6.00 . 21 21 A 22 SER N A 22 SER H 1.0 9.40 9.40 . 22 22 A 23 ASP N A 23 ASP H 1.0 -6.16 -6.16 . 23 23 A 24 ASN N A 24 ASN H 1.0 -6.00 -6.00 . 24 24 A 25 ILE N A 25 ILE H 1.0 1.54 1.54 . 25 25 A 26 LEU N A 26 LEU H 1.0 -6.73 -6.73 . 26 26 A 27 LEU N A 27 LEU H 1.0 5.59 5.59 . 27 27 A 28 SER N A 28 SER H 1.0 -4.13 -4.13 . 28 28 A 29 GLU N A 29 GLU H 1.0 -2.19 -2.19 . 29 29 A 30 GLU N A 30 GLU H 1.0 -5.03 -5.03 . 30 30 A 31 GLN N A 31 GLN H 1.0 -0.16 -0.16 . 31 31 A 32 VAL N A 32 VAL H 1.0 -7.13 -7.13 . 32 32 A 33 ASP N A 33 ASP H 1.0 1.22 1.22 . 33 33 A 34 VAL N A 34 VAL H 1.0 -6.00 -6.00 . 34 34 A 35 GLU N A 35 GLU H 1.0 -11.68 -11.68 . 35 35 A 36 LEU N A 36 LEU H 1.0 -12.00 -12.00 . 36 36 A 37 VAL N A 37 VAL H 1.0 13.22 13.22 . 37 37 A 38 GLN N A 38 GLN H 1.0 15.32 15.32 . 38 38 A 39 ARG N A 39 ARG H 1.0 -2.76 -2.76 . 39 39 A 40 GLY N A 40 GLY H 1.0 -9.81 -9.81 . 40 40 A 41 ASP N A 41 ASP H 1.0 15.73 15.73 . 41 41 A 42 ILE N A 42 ILE H 1.0 8.51 8.51 . 42 42 A 43 ILE N A 43 ILE H 1.0 7.38 7.38 . 43 43 A 44 LYS N A 44 LYS H 1.0 0.32 0.32 . 44 44 A 45 VAL N A 45 VAL H 1.0 -13.70 -13.70 . 45 45 A 46 VAL N A 46 VAL H 1.0 -5.76 -5.76 . 46 46 A 48 GLY N A 48 GLY H 1.0 -9.89 -9.89 . 47 47 A 49 GLY N A 49 GLY H 1.0 8.27 8.27 . 48 48 A 53 VAL N A 53 VAL H 1.0 -6.08 -6.08 . 49 49 A 56 ARG N A 56 ARG H 1.0 -2.19 -2.19 . 50 50 A 57 VAL N A 57 VAL H 1.0 2.35 2.35 . 51 51 A 60 GLY N A 60 GLY H 1.0 -0.65 -0.65 . 52 52 A 61 HIS N A 61 HIS H 1.0 -1.46 -1.46 . 53 53 A 62 SER N A 62 SER H 1.0 -6.24 -6.24 . 54 54 A 63 MET N A 63 MET H 1.0 -7.54 -7.54 . 55 55 A 64 VAL N A 64 VAL H 1.0 -12.24 -12.24 . 56 56 A 65 ASP N A 65 ASP H 1.0 -0.08 -0.08 . 57 57 A 66 GLU N A 66 GLU H 1.0 -12.00 -12.00 . 58 58 A 67 SER N A 67 SER H 1.0 4.70 4.70 . 59 59 A 68 LEU N A 68 LEU H 1.0 16.05 16.05 . 60 60 A 69 ILE N A 69 ILE H 1.0 7.46 7.46 . 61 61 A 70 THR N A 70 THR H 1.0 7.70 7.70 . 62 62 A 71 GLY N A 71 GLY H 1.0 -0.49 -0.49 . 63 63 A 72 GLU N A 72 GLU H 1.0 0.49 0.49 . 64 64 A 73 ALA N A 73 ALA H 1.0 5.76 5.76 . 65 65 A 74 MET N A 74 MET H 1.0 -5.59 -5.59 . 66 66 A 76 VAL N A 76 VAL H 1.0 -11.68 -11.68 . 67 67 A 77 ALA N A 77 ALA H 1.0 -1.70 -1.70 . 68 68 A 78 LYS N A 78 LYS H 1.0 -7.46 -7.46 . 69 69 A 79 LYS N A 79 LYS H 1.0 -1.30 -1.30 . 70 70 A 81 GLY N A 81 GLY H 1.0 -7.95 -7.95 . 71 71 A 82 SER N A 82 SER H 1.0 2.76 2.76 . 72 72 A 83 THR N A 83 THR H 1.0 3.00 3.00 . 73 73 A 84 VAL N A 84 VAL H 1.0 -2.43 -2.43 . 74 74 A 85 ILE N A 85 ILE H 1.0 -9.40 -9.40 . 75 75 A 87 GLY N A 87 GLY H 1.0 18.97 18.97 . 76 76 A 88 SER N A 88 SER H 1.0 -0.89 -0.89 . 77 77 A 89 ILE N A 89 ILE H 1.0 8.27 8.27 . 78 78 A 90 ASN N A 90 ASN H 1.0 -8.84 -8.84 . 79 79 A 91 GLN N A 91 GLN H 1.0 -12.97 -12.97 . 80 80 A 92 ASN N A 92 ASN H 1.0 -6.24 -6.24 . 81 81 A 93 GLY N A 93 GLY H 1.0 7.86 7.86 . 82 82 A 95 LEU N A 95 LEU H 1.0 -0.49 -0.49 . 83 83 A 96 LEU N A 96 LEU H 1.0 -12.97 -12.97 . 84 84 A 97 ILE N A 97 ILE H 1.0 -11.11 -11.11 . 85 85 A 98 CYS N A 98 CYS H 1.0 -6.32 -6.32 . 86 86 A 99 ALA N A 99 ALA H 1.0 10.95 10.95 . 87 87 A 100 THR N A 100 THR H 1.0 0.41 0.41 . 88 88 A 101 HIS N A 101 HIS H 1.0 -6.81 -6.81 . 89 89 A 102 VAL N A 102 VAL H 1.0 -5.59 -5.59 . 90 90 A 103 GLY N A 103 GLY H 1.0 -0.65 -0.65 . 91 91 A 105 ASP N A 105 ASP H 1.0 15.32 15.32 . 92 92 A 106 THR N A 106 THR H 1.0 -12.00 -12.00 . 93 93 A 109 SER N A 109 SER H 1.0 17.43 17.43 . 94 94 A 110 GLN N A 110 GLN H 1.0 7.30 7.30 . 95 95 A 112 VAL N A 112 VAL H 1.0 16.05 16.05 . 96 96 A 113 LYS N A 113 LYS H 1.0 8.51 8.51 . 97 97 A 114 LEU N A 114 LEU H 1.0 9.24 9.24 . 98 98 A 115 VAL N A 115 VAL H 1.0 17.76 17.76 . 99 99 A 116 GLU N A 116 GLU H 1.0 11.92 11.92 . 100 100 A 117 GLU N A 117 GLU H 1.0 3.49 3.49 . 101 101 A 118 ALA N A 118 ALA H 1.0 7.95 7.95 . 102 102 A 119 GLN N A 119 GLN H 1.0 4.22 4.22 . stop_ save_